#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k25 n SER 2 N 0.00 -1.87 -4.21 1.61 7.64 -1.26 -5.19 113.62 110.35 2k25 n SER 2 Ca 0.00 -2.06 -0.13 0.00 1.01 0.00 0.00 58.87 57.69 2k25 n SER 2 Cb 0.00 3.05 -0.10 0.00 -1.01 0.00 0.00 64.21 66.15 2k25 n SER 2 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 2k25 s LEU 3 N 0.00 2.50 -0.17 -3.43 -0.00 -1.26 -4.86 118.68 111.46 2k25 s LEU 3 Ca 0.21 -0.96 -0.09 0.00 -0.00 0.00 0.00 54.13 53.29 2k25 s LEU 3 Cb -0.03 -0.26 -0.05 0.00 -0.00 0.00 0.00 46.19 45.85 2k25 s LEU 3 CO 0.07 -0.35 0.14 -0.69 -0.00 0.00 0.00 176.35 175.52 2k25 s VAL 4 N -3.20 5.44 -0.87 1.48 1.01 -1.26 -5.02 120.40 117.98 2k25 s VAL 4 Ca 0.13 0.21 -0.25 0.00 0.00 0.00 0.00 61.98 62.07 2k25 s VAL 4 Cb 0.02 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.90 2k25 s VAL 4 CO -0.01 0.50 1.94 -2.16 0.00 0.00 0.00 175.10 175.37 2k25 s PRO 5 N -0.09 2.56 -0.20 2.72 0.04 -1.26 -4.87 135.00 133.90 2k25 s PRO 5 Ca 0.11 -0.18 -0.02 0.00 0.04 0.00 0.00 61.00 60.95 2k25 s PRO 5 Cb -0.11 -4.98 -0.00 0.00 0.04 0.00 0.00 34.50 29.44 2k25 s PRO 5 CO 0.00 -3.31 -0.10 1.03 0.04 0.00 0.00 177.00 174.66 2k25 s ARG 6 N 7.03 3.27 0.00 4.56 1.81 -1.26 -5.08 118.95 129.28 2k25 s ARG 6 Ca 0.70 -0.69 0.00 0.00 -1.72 0.00 0.00 55.73 54.02 2k25 s ARG 6 Cb -0.07 -2.84 0.00 0.00 -0.45 0.00 0.00 34.95 31.59 2k25 s ARG 6 CO 0.02 -0.15 0.00 0.41 -0.68 0.00 0.00 175.30 174.90 2k25 n GLY 7 N 4.59 -0.82 0.27 -3.53 0.00 -1.26 -4.73 105.19 99.71 2k25 n GLY 7 Ca -0.19 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 44.85 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 0.00 2.70 -4.62 1.61 7.64 -1.26 -5.03 113.62 114.66 2k25 n SER 8 Ca 0.00 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.54 2k25 n SER 8 Cb 0.00 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.10 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 -1.92 3.75 -0.01 1.43 -1.94 -1.26 -5.08 119.30 114.26 2k25 s MET 9 Ca 0.00 -0.38 0.04 0.00 -1.71 0.00 0.00 55.69 53.64 2k25 s MET 9 Cb 0.00 -3.09 -0.01 0.00 2.01 0.00 0.00 34.83 33.75 2k25 s MET 9 CO 0.00 0.35 -0.12 -0.65 -0.01 0.00 0.00 175.02 174.59 2k25 s GLN 10 N 0.12 1.00 0.28 2.03 -0.21 -1.25 -4.36 119.66 117.26 2k25 s GLN 10 Ca 0.03 -0.44 -0.07 0.00 0.02 0.00 0.00 55.36 54.91 2k25 s GLN 10 Cb -0.13 -0.96 -0.01 0.00 1.00 0.00 0.00 33.01 32.91 2k25 s GLN 10 CO 0.01 0.26 0.42 -1.50 -2.12 0.00 0.00 175.29 172.36 2k25 s ILE 11 N -0.28 0.00 -0.23 1.08 2.07 -0.56 -4.83 121.20 118.44 2k25 s ILE 11 Ca 0.05 -1.58 -0.08 0.00 -1.41 0.00 0.00 60.65 57.63 2k25 s ILE 11 Cb -0.05 -2.42 -0.04 0.00 0.13 0.00 0.00 42.46 40.08 2k25 s ILE 11 CO -0.00 0.00 0.08 0.12 -1.91 0.00 0.00 174.94 173.23 2k25 s PHE 12 N -3.67 3.16 -0.04 3.50 5.36 -1.26 -3.90 117.98 121.13 2k25 s PHE 12 Ca 0.28 -0.15 0.02 0.00 -0.96 0.00 0.00 56.93 56.13 2k25 s PHE 12 Cb 0.01 -2.20 0.01 0.00 -0.34 0.00 0.00 43.02 40.50 2k25 s PHE 12 CO 0.14 -0.13 -0.09 0.08 -1.46 0.00 0.00 175.22 173.75 2k25 s VAL 13 N 1.16 0.85 -0.18 3.12 1.01 -1.24 -3.13 120.40 121.98 2k25 s VAL 13 Ca 0.05 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 61.69 2k25 s VAL 13 Cb -0.14 -0.78 0.02 0.00 0.00 0.00 0.00 36.38 35.47 2k25 s VAL 13 CO 0.04 0.28 -0.19 -0.54 0.00 0.00 0.00 175.10 174.69 2k25 s LYS 14 N 0.52 3.02 0.96 2.72 -0.14 -1.26 -3.50 119.74 122.05 2k25 s LYS 14 Ca -0.09 -0.82 -0.15 0.00 -1.36 0.00 0.00 55.97 53.55 2k25 s LYS 14 Cb -0.12 -2.59 0.18 0.00 -1.68 0.00 0.00 37.83 33.61 2k25 s LYS 14 CO 0.01 -0.20 1.21 0.95 -0.76 0.00 0.00 175.35 176.57 2k25 s THR 15 N 1.27 1.93 -1.49 2.17 -4.23 -0.79 -4.71 115.64 109.78 2k25 s THR 15 Ca 0.04 0.00 0.27 0.00 -1.18 0.00 0.00 61.69 60.83 2k25 s THR 15 Cb -0.13 -2.84 0.51 0.00 1.34 0.00 0.00 72.50 71.38 2k25 s THR 15 CO -0.12 0.00 1.94 0.00 -0.54 0.00 0.00 174.62 175.90 2k25 n LEU 16 N -3.86 0.00 -0.05 4.79 -0.00 -1.26 -3.29 117.00 113.32 2k25 n LEU 16 Ca 0.11 0.25 -0.05 0.00 -0.00 0.00 0.00 56.01 56.32 2k25 n LEU 16 Cb 0.60 -0.25 -0.09 0.00 -0.00 0.00 0.00 43.42 43.68 2k25 n LEU 16 CO 0.51 -0.03 -0.85 1.07 -0.00 0.00 0.00 177.39 178.09 2k25 n THR 17 N -1.25 0.74 0.00 1.47 5.66 -1.26 -5.02 114.28 114.62 2k25 n THR 17 Ca 0.14 -0.46 0.00 0.00 -3.05 0.00 0.00 64.05 60.68 2k25 n THR 17 Cb 0.20 -0.71 0.00 0.00 -1.55 0.00 0.00 70.33 68.27 2k25 n THR 17 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2k25 n GLY 18 N 2.33 1.01 3.74 1.09 0.00 -1.21 -5.13 105.19 107.03 2k25 n GLY 18 Ca -0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 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 2.64 -0.10 1.61 3.01 -1.26 -4.70 119.74 120.93 2k25 s LYS 19 Ca 0.00 1.87 0.04 0.00 -1.01 0.00 0.00 55.97 56.87 2k25 s LYS 19 Cb 0.00 -1.88 0.00 0.00 -1.01 0.00 0.00 37.83 34.94 2k25 s LYS 19 CO 0.00 -1.48 -0.23 0.95 0.51 0.00 0.00 175.35 175.10 2k25 s THR 20 N -1.65 2.00 -0.02 2.17 -4.23 -1.26 -1.89 115.64 110.75 2k25 s THR 20 Ca 0.78 -0.99 0.02 0.00 -1.18 0.00 0.00 61.69 60.33 2k25 s THR 20 Cb -0.32 -1.73 0.00 0.00 1.34 0.00 0.00 72.50 71.79 2k25 s THR 20 CO 0.38 0.55 -0.08 0.27 -0.54 0.00 0.00 174.62 175.20 2k25 s ILE 21 N 0.35 0.69 -0.09 2.99 -0.00 -1.23 -5.03 121.20 118.88 2k25 s ILE 21 Ca -0.18 -0.33 -0.30 0.00 -0.00 0.00 0.00 60.65 59.84 2k25 s ILE 21 Cb -0.18 -0.61 -0.02 0.00 -0.00 0.00 0.00 42.46 41.65 2k25 s ILE 21 CO 0.09 0.21 1.11 -0.89 -0.00 0.00 0.00 174.94 175.46 2k25 s THR 22 N 0.08 4.51 0.25 8.37 2.01 -1.26 -3.72 115.64 125.87 2k25 s THR 22 Ca -0.01 1.80 0.10 0.00 0.31 0.00 0.00 61.69 63.89 2k25 s THR 22 Cb -0.07 -4.16 -0.04 0.00 0.01 0.00 0.00 72.50 68.24 2k25 s THR 22 CO 0.00 -0.01 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.09 2k25 s LEU 23 N 2.24 3.02 0.10 4.42 2.01 -1.25 -4.25 118.68 124.97 2k25 s LEU 23 Ca 0.52 -0.71 0.01 0.00 0.01 0.00 0.00 54.13 53.96 2k25 s LEU 23 Cb -0.21 -1.58 -0.04 0.00 0.01 0.00 0.00 46.19 44.37 2k25 s LEU 23 CO 0.19 0.03 0.25 -1.83 1.01 0.00 0.00 176.35 176.00 2k25 s GLU 24 N -3.45 3.45 0.04 1.70 -1.05 -1.26 -1.50 118.70 116.64 2k25 s GLU 24 Ca 0.30 -0.47 0.06 0.00 -0.15 0.00 0.00 54.97 54.71 2k25 s GLU 24 Cb -0.07 -3.00 -0.02 0.00 -0.44 0.00 0.00 34.13 30.60 2k25 s GLU 24 CO 0.18 0.57 -0.17 0.14 0.95 0.00 0.00 175.26 176.92 2k25 s VAL 25 N -1.61 1.35 -0.30 1.83 -7.23 -1.26 -4.97 120.40 108.21 2k25 s VAL 25 Ca 0.35 -1.11 -0.17 0.00 -1.81 0.00 0.00 61.98 59.25 2k25 s VAL 25 Cb -0.12 -1.20 0.21 0.00 0.56 0.00 0.00 36.38 35.83 2k25 s VAL 25 CO 0.28 0.07 1.29 -0.70 -0.31 0.00 0.00 175.10 175.74 2k25 s GLU 26 N -1.20 0.03 0.15 4.82 2.56 -1.26 -4.96 118.70 118.84 2k25 s GLU 26 Ca 0.04 0.05 0.19 0.00 0.00 0.00 0.00 54.97 55.25 2k25 s GLU 26 Cb -0.08 0.01 0.82 0.00 2.00 0.00 0.00 34.13 36.87 2k25 s GLU 26 CO 0.02 -0.01 1.60 -0.35 -0.56 0.00 0.00 175.26 175.96 2k25 n PRO 27 N 2.91 0.11 -0.00 4.30 -0.04 -1.26 -2.41 135.00 138.61 2k25 n PRO 27 Ca -0.16 0.35 0.06 0.00 -0.04 0.00 0.00 63.50 63.71 2k25 n PRO 27 Cb 0.56 -1.71 -0.08 0.00 -0.04 0.00 0.00 33.50 32.23 2k25 n PRO 27 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2k25 n SER 28 N -1.92 1.36 -4.59 3.54 2.88 -1.26 -3.03 113.62 110.60 2k25 n SER 28 Ca 0.03 -0.41 -0.36 0.00 -1.33 0.00 0.00 58.87 56.80 2k25 n SER 28 Cb 0.20 1.26 -0.11 0.00 -0.75 0.00 0.00 64.21 64.81 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 -2.69 5.70 0.58 -3.46 -1.08 -1.01 -4.90 116.67 109.80 2k25 s ASP 29 Ca 0.00 0.00 0.01 0.00 -0.52 0.00 0.00 52.55 52.04 2k25 s ASP 29 Cb 0.08 -2.02 0.05 0.00 -1.46 0.00 0.00 42.92 39.57 2k25 s ASP 29 CO 0.48 0.06 0.81 0.28 0.52 0.00 0.00 175.17 177.33 2k25 s THR 30 N 1.07 2.58 0.57 1.71 -1.32 -1.26 -4.50 115.64 114.50 2k25 s THR 30 Ca 0.06 -0.63 0.28 0.00 -1.21 0.00 0.00 61.69 60.18 2k25 s THR 30 Cb -0.14 -2.95 0.38 0.00 -1.51 0.00 0.00 72.50 68.28 2k25 s THR 30 CO 0.04 0.00 1.98 0.40 -2.21 0.00 0.00 174.62 174.83 2k25 h ILE 31 N -0.03 0.49 -0.13 5.08 5.03 -1.95 -1.64 117.51 124.35 2k25 h ILE 31 Ca -0.42 0.00 0.05 0.00 -0.12 0.00 0.00 64.86 64.37 2k25 h ILE 31 Cb 1.30 0.71 -0.06 0.00 -3.03 0.00 0.00 36.82 35.74 2k25 h ILE 31 CO 0.51 0.00 -0.32 -0.08 -0.68 0.00 0.00 178.15 177.58 2k25 h GLU 32 N 0.00 -0.38 0.21 2.37 4.81 -1.95 0.10 114.58 119.74 2k25 h GLU 32 Ca 0.19 0.03 -0.31 0.00 -0.13 0.00 0.00 59.36 59.13 2k25 h GLU 32 Cb 0.93 0.09 0.03 0.00 0.63 0.00 0.00 28.75 30.43 2k25 h GLU 32 CO -0.00 -0.26 -1.34 -0.97 -0.73 0.00 0.00 179.01 175.71 2k25 h ASN 33 N -0.40 0.82 -0.80 1.04 -0.73 -1.77 -3.27 115.58 110.47 2k25 h ASN 33 Ca 0.10 -0.89 0.19 0.00 1.87 0.00 0.00 56.30 57.57 2k25 h ASN 33 Cb 0.55 -0.27 -0.05 0.00 0.27 0.00 0.00 38.32 38.83 2k25 h ASN 33 CO -0.36 1.65 0.55 0.58 -0.37 0.00 0.00 177.43 179.48 2k25 h VAL 34 N 0.13 0.69 -0.61 2.57 2.07 -1.12 0.11 116.25 120.09 2k25 h VAL 34 Ca -0.23 -0.08 0.18 0.00 0.82 0.00 0.00 66.70 67.39 2k25 h VAL 34 Cb 2.04 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 2k25 h VAL 34 CO 0.25 0.04 0.55 0.07 0.02 0.00 0.00 177.57 178.51 2k25 h LYS 35 N 0.24 0.00 -0.42 1.57 5.09 -0.85 0.73 116.57 122.93 2k25 h LYS 35 Ca 0.40 0.00 -0.03 0.00 0.09 0.00 0.00 60.65 61.10 2k25 h LYS 35 Cb 1.19 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 33.51 2k25 h LYS 35 CO -0.09 0.00 0.13 0.00 -2.09 0.00 0.00 179.45 177.40 2k25 h ALA 36 N 1.47 0.55 0.12 0.07 0.00 -0.99 0.16 119.26 120.63 2k25 h ALA 36 Ca 0.29 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2k25 h ALA 36 Cb 1.39 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2k25 h ALA 36 CO -0.00 0.20 -0.06 0.87 0.00 0.00 0.00 179.25 180.26 2k25 h LYS 37 N 0.54 -0.15 -0.09 0.00 1.79 -1.01 -2.68 116.57 114.97 2k25 h LYS 37 Ca 0.14 0.01 -0.05 0.00 -2.18 0.00 0.00 60.65 58.56 2k25 h LYS 37 Cb 0.27 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.94 2k25 h LYS 37 CO -0.00 0.01 -0.20 0.97 -1.08 0.00 0.00 179.45 179.15 2k25 h ILE 38 N -0.29 1.19 -0.03 1.86 -0.00 -1.48 -2.27 117.51 116.48 2k25 h ILE 38 Ca -0.02 -0.87 -0.03 0.00 -0.00 0.00 0.00 64.86 63.95 2k25 h ILE 38 Cb 0.24 1.34 -0.01 0.00 -0.00 0.00 0.00 36.82 38.39 2k25 h ILE 38 CO 0.03 0.26 -0.11 -0.61 -0.00 0.00 0.00 178.15 177.71 2k25 h GLN 39 N 0.14 0.05 0.00 2.19 4.15 -0.41 -1.32 115.11 119.90 2k25 h GLN 39 Ca 0.03 -0.01 -0.10 0.00 0.77 0.00 0.00 58.65 59.34 2k25 h GLN 39 Cb 0.43 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 2k25 h GLN 39 CO 0.03 0.16 -0.46 0.22 -1.93 0.00 0.00 178.83 176.85 2k25 h ASP 40 N 0.05 0.00 0.06 -0.69 3.58 -1.09 0.25 116.42 118.58 2k25 h ASP 40 Ca 0.01 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.46 2k25 h ASP 40 Cb 0.23 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.28 2k25 h ASP 40 CO 0.02 0.46 -0.03 0.11 -2.88 0.00 0.00 179.24 176.92 2k25 h LYS 41 N 0.00 -0.07 0.00 0.28 1.79 -1.20 -3.42 116.57 113.94 2k25 h LYS 41 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2k25 h LYS 41 Cb 1.21 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 2k25 h LYS 41 CO 0.06 0.47 -0.74 0.39 -1.08 0.00 0.00 179.45 178.55 2k25 n GLU 42 N -4.77 1.33 -0.55 3.15 1.02 -0.71 -4.49 120.64 115.62 2k25 n GLU 42 Ca -0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 2k25 n GLU 42 Cb 0.28 -0.87 0.00 0.00 -0.02 0.00 0.00 31.44 30.83 2k25 n GLU 42 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k25 n GLY 43 N 2.70 1.03 3.76 0.62 0.00 0.08 -4.34 105.19 109.04 2k25 n GLY 43 Ca 0.00 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.00 3.24 -0.06 -0.61 1.01 -1.26 -4.92 121.20 116.60 2k25 s ILE 44 Ca 0.00 1.19 -0.30 0.00 0.00 0.00 0.00 60.65 61.54 2k25 s ILE 44 Cb 0.00 -3.76 -0.05 0.00 0.01 0.00 0.00 42.46 38.67 2k25 s ILE 44 CO 0.00 0.26 1.50 -2.16 0.00 0.00 0.00 174.94 174.53 2k25 s PRO 45 N -1.21 4.22 0.10 2.79 0.04 -1.26 -4.69 135.00 135.00 2k25 s PRO 45 Ca 0.48 2.02 -0.14 0.00 0.04 0.00 0.00 61.00 63.40 2k25 s PRO 45 Cb -0.35 -3.80 -0.08 0.00 0.04 0.00 0.00 34.50 30.31 2k25 s PRO 45 CO 0.44 -0.73 1.42 -1.00 0.04 0.00 0.00 177.00 177.17 2k25 h PRO 46 N 8.69 0.72 0.00 0.56 0.13 -1.93 0.15 132.00 140.32 2k25 h PRO 46 Ca -0.36 -0.38 0.00 0.00 -0.87 0.00 0.00 66.00 64.39 2k25 h PRO 46 Cb 1.16 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2k25 h PRO 46 CO 0.94 1.00 0.00 -0.44 -0.23 0.00 0.00 178.00 179.27 2k25 h ASP 47 N 0.47 0.00 0.00 1.44 3.32 -1.98 -2.14 116.42 117.53 2k25 h ASP 47 Ca 0.05 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.93 2k25 h ASP 47 Cb 0.87 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.39 2k25 h ASP 47 CO 0.07 0.00 -1.80 0.00 -1.72 0.00 0.00 179.24 175.80 2k25 n GLN 48 N -2.41 1.47 -2.44 3.56 1.13 -1.09 -5.01 117.38 112.59 2k25 n GLN 48 Ca -0.01 -0.04 -0.27 0.00 -1.94 0.00 0.00 57.00 54.74 2k25 n GLN 48 Cb 0.09 -1.33 0.02 0.00 0.11 0.00 0.00 30.24 29.14 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 -2.50 3.08 0.25 -1.09 -2.07 0.50 -4.96 119.66 112.87 2k25 s GLN 49 Ca -0.06 0.06 0.02 0.00 -1.82 0.00 0.00 55.36 53.55 2k25 s GLN 49 Cb 0.05 -2.29 0.02 0.00 -1.09 0.00 0.00 33.01 29.69 2k25 s GLN 49 CO 0.54 -0.58 0.12 2.89 -1.32 0.00 0.00 175.29 176.94 2k25 n ARG 50 N -2.51 1.22 -4.71 9.60 1.85 -1.26 -4.85 116.66 116.00 2k25 n ARG 50 Ca 0.04 -1.64 -0.25 0.00 -1.00 0.00 0.00 57.85 54.99 2k25 n ARG 50 Cb 0.57 0.27 -0.16 0.00 -1.05 0.00 0.00 32.46 32.09 2k25 n ARG 50 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 2k25 s LEU 51 N 0.00 1.83 -0.16 2.89 2.96 -1.20 -4.31 118.68 120.68 2k25 s LEU 51 Ca 0.09 -0.32 0.00 0.00 -0.22 0.00 0.00 54.13 53.69 2k25 s LEU 51 Cb -0.01 -0.88 0.03 0.00 0.50 0.00 0.00 46.19 45.83 2k25 s LEU 51 CO 0.06 0.11 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.45 2k25 s ILE 52 N 0.24 1.52 -0.16 6.68 1.09 -1.13 0.02 121.20 129.46 2k25 s ILE 52 Ca -0.07 -0.73 0.00 0.00 -1.10 0.00 0.00 60.65 58.75 2k25 s ILE 52 Cb -0.12 -1.51 0.03 0.00 -1.06 0.00 0.00 42.46 39.80 2k25 s ILE 52 CO 0.03 0.33 -0.10 0.12 -0.10 0.00 0.00 174.94 175.22 2k25 s PHE 53 N 1.48 2.02 -1.70 3.97 5.36 0.89 -2.50 117.98 127.50 2k25 s PHE 53 Ca 0.03 -1.21 -0.01 0.00 -0.96 0.00 0.00 56.93 54.77 2k25 s PHE 53 Cb -0.14 -1.49 0.00 0.00 -0.34 0.00 0.00 43.02 41.06 2k25 s PHE 53 CO -0.09 -0.65 0.19 0.00 -1.46 0.00 0.00 175.22 173.20 2k25 n ALA 54 N 4.80 -0.74 -0.15 11.12 0.00 -1.26 -0.77 120.51 133.50 2k25 n ALA 54 Ca -0.14 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2k25 n ALA 54 Cb 0.49 -2.71 0.00 0.00 0.00 0.00 0.00 19.45 17.23 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 -1.17 1.87 3.68 0.00 0.00 -1.26 -5.01 105.19 103.29 2k25 n GLY 55 Ca -0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.29 4.12 0.28 1.61 2.20 0.05 -5.08 119.74 122.63 2k25 s LYS 56 Ca 0.00 -0.16 -0.26 0.00 -0.36 0.00 0.00 55.97 55.19 2k25 s LYS 56 Cb 0.00 -3.51 -0.09 0.00 -1.51 0.00 0.00 37.83 32.71 2k25 s LYS 56 CO 0.00 0.09 0.89 1.14 -0.36 0.00 0.00 175.35 177.12 2k25 s GLN 57 N 0.96 4.58 0.00 4.03 -2.07 -1.26 -0.08 119.66 125.82 2k25 s GLN 57 Ca 0.10 1.27 0.00 0.00 -1.82 0.00 0.00 55.36 54.91 2k25 s GLN 57 Cb -0.13 -2.93 0.00 0.00 -1.09 0.00 0.00 33.01 28.86 2k25 s GLN 57 CO 0.04 0.36 0.00 1.28 -1.32 0.00 0.00 175.29 175.65 2k25 n LEU 58 N 0.83 0.00 0.00 2.60 4.32 0.10 -4.94 117.00 119.91 2k25 n LEU 58 Ca -0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 56.01 55.87 2k25 n LEU 58 Cb 0.50 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.26 2k25 n LEU 58 CO 0.45 0.00 -0.07 -0.62 -1.22 0.00 0.00 177.39 175.93 2k25 n GLU 59 N 0.00 0.53 -3.39 3.23 1.02 -1.26 -3.27 120.64 117.49 2k25 n GLU 59 Ca 0.00 -1.84 -0.23 0.00 -0.02 0.00 0.00 57.16 55.07 2k25 n GLU 59 Cb 0.00 1.20 0.04 0.00 -0.02 0.00 0.00 31.44 32.66 2k25 n GLU 59 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 2k25 s ASP 60 N -2.32 4.85 0.00 1.62 -4.77 -1.26 -4.84 116.67 109.94 2k25 s ASP 60 Ca 0.15 -1.08 0.00 0.00 -3.30 0.00 0.00 52.55 48.33 2k25 s ASP 60 Cb 0.01 0.50 0.00 0.00 -1.09 0.00 0.00 42.92 42.34 2k25 s ASP 60 CO 0.11 -1.33 0.00 0.61 0.70 0.00 0.00 175.17 175.25 2k25 n GLY 61 N -2.11 3.84 3.45 2.12 0.00 -1.26 -5.09 105.19 106.14 2k25 n GLY 61 Ca 0.09 -0.95 -0.22 0.00 0.00 0.00 0.00 46.02 44.94 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 1.61 0.99 1.61 1.81 -1.26 -5.07 118.95 118.64 2k25 s ARG 62 Ca 0.00 -1.81 -0.17 0.00 -1.72 0.00 0.00 55.73 52.03 2k25 s ARG 62 Cb 0.00 -1.30 0.22 0.00 -0.45 0.00 0.00 34.95 33.42 2k25 s ARG 62 CO 0.00 0.08 1.33 0.95 -0.68 0.00 0.00 175.30 176.98 2k25 s THR 63 N -2.90 1.98 0.22 0.02 -4.23 -1.26 -4.64 115.64 104.82 2k25 s THR 63 Ca 0.30 0.00 -0.01 0.00 -1.18 0.00 0.00 61.69 60.80 2k25 s THR 63 Cb 0.03 -2.97 -0.01 0.00 1.34 0.00 0.00 72.50 70.88 2k25 s THR 63 CO 0.13 0.00 1.58 -0.07 -0.54 0.00 0.00 174.62 175.72 2k25 h LEU 64 N -1.76 0.55 -0.91 4.79 3.38 -1.75 -2.26 115.31 117.35 2k25 h LEU 64 Ca -0.44 -0.26 -0.11 0.00 0.09 0.00 0.00 57.88 57.16 2k25 h LEU 64 Cb 1.23 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 2k25 h LEU 64 CO 0.34 0.92 -0.41 -1.28 0.09 0.00 0.00 178.44 178.11 2k25 h SER 65 N 0.42 0.29 0.19 -0.43 0.87 -1.83 0.93 113.55 113.99 2k25 h SER 65 Ca 0.03 -0.12 -0.21 0.00 -1.23 0.00 0.00 61.79 60.26 2k25 h SER 65 Cb 0.95 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 2k25 h SER 65 CO 0.08 0.67 -0.82 -0.33 -0.53 0.00 0.00 176.83 175.90 2k25 h GLU 66 N 0.23 0.50 -0.00 2.24 5.08 -1.79 -3.09 114.58 117.75 2k25 h GLU 66 Ca 0.02 -0.45 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2k25 h GLU 66 Cb 0.82 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2k25 h GLU 66 CO 0.07 1.09 -0.27 0.66 -1.00 0.00 0.00 179.01 179.55 2k25 n TYR 67 N -3.83 0.00 -3.30 4.33 4.02 -0.86 -4.93 117.16 112.58 2k25 n TYR 67 Ca -0.06 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.59 2k25 n TYR 67 Cb 0.76 -0.23 0.03 0.00 -0.02 0.00 0.00 39.34 39.88 2k25 n TYR 67 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2k25 n ASN 68 N -1.12 -5.28 -4.79 7.72 3.02 0.26 -4.97 115.26 110.10 2k25 n ASN 68 Ca 0.10 -0.41 -0.27 0.00 -0.03 0.00 0.00 54.58 53.97 2k25 n ASN 68 Cb 0.32 -4.26 -0.06 0.00 -0.61 0.00 0.00 39.78 35.17 2k25 n ASN 68 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2k25 s ILE 69 N -3.14 4.47 -0.45 2.41 -4.36 -0.83 -5.02 121.20 114.29 2k25 s ILE 69 Ca 0.41 -1.03 -0.02 0.00 -0.26 0.00 0.00 60.65 59.75 2k25 s ILE 69 Cb -0.20 -3.25 0.20 0.00 1.25 0.00 0.00 42.46 40.46 2k25 s ILE 69 CO 0.51 -0.06 2.29 0.00 0.24 0.00 0.00 174.94 177.91 2k25 n GLN 70 N -0.17 2.19 0.25 0.37 6.02 -1.26 -4.59 117.38 120.19 2k25 n GLN 70 Ca -0.08 -2.19 0.18 0.00 -0.01 0.00 0.00 57.00 54.89 2k25 n GLN 70 Cb 0.54 -1.93 0.90 0.00 1.02 0.00 0.00 30.24 30.77 2k25 n GLN 70 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 2k25 h LYS 71 N 2.17 0.00 -3.01 -1.09 3.64 -1.93 -3.17 116.57 113.18 2k25 h LYS 71 Ca 0.39 0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 59.22 2k25 h LYS 71 Cb 0.78 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.61 2k25 h LYS 71 CO 0.96 0.00 3.10 -1.91 -2.27 0.00 0.00 179.45 179.33 2k25 n GLU 72 N -3.54 3.10 0.00 1.90 2.13 -1.26 -4.11 120.64 118.86 2k25 n GLU 72 Ca 0.00 -1.87 0.00 0.00 0.66 0.00 0.00 57.16 55.95 2k25 n GLU 72 Cb 0.28 -2.62 0.00 0.00 0.27 0.00 0.00 31.44 29.37 2k25 n GLU 72 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2k25 n SER 73 N 3.61 0.00 -3.71 4.31 2.88 -1.20 -5.09 113.62 114.43 2k25 n SER 73 Ca 0.66 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.93 2k25 n SER 73 Cb 0.27 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.57 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 0.00 0.41 0.04 2.46 2.01 -1.26 -4.36 115.64 114.94 2k25 s THR 74 Ca 0.00 -0.51 0.04 0.00 0.31 0.00 0.00 61.69 61.53 2k25 s THR 74 Cb 0.00 -0.96 -0.02 0.00 0.01 0.00 0.00 72.50 71.52 2k25 s THR 74 CO 0.00 -0.24 -0.13 -0.76 -0.69 0.00 0.00 174.62 172.80 2k25 s LEU 75 N 1.91 2.17 -0.22 4.42 2.01 -1.18 -4.43 118.68 123.36 2k25 s LEU 75 Ca -0.00 -0.45 -0.03 0.00 0.01 0.00 0.00 54.13 53.67 2k25 s LEU 75 Cb -0.17 -0.51 0.07 0.00 0.01 0.00 0.00 46.19 45.59 2k25 s LEU 75 CO -0.09 -0.00 0.06 -1.00 1.01 0.00 0.00 176.35 176.33 2k25 s HIS 76 N -0.88 1.08 -0.32 0.29 3.76 -1.04 -3.83 115.29 114.36 2k25 s HIS 76 Ca -0.00 -1.02 -0.00 0.00 -0.15 0.00 0.00 55.06 53.89 2k25 s HIS 76 Cb -0.08 -1.14 0.10 0.00 1.11 0.00 0.00 32.58 32.57 2k25 s HIS 76 CO 0.01 -0.68 0.09 -0.48 -0.85 0.00 0.00 174.74 172.83 2k25 s LEU 77 N 1.84 2.58 -0.15 0.89 2.34 -1.26 -2.85 118.68 122.07 2k25 s LEU 77 Ca 0.02 -1.73 -0.09 0.00 0.06 0.00 0.00 54.13 52.39 2k25 s LEU 77 Cb -0.17 -0.97 0.05 0.00 -0.56 0.00 0.00 46.19 44.54 2k25 s LEU 77 CO -0.14 -0.41 0.36 -0.69 -1.06 0.00 0.00 176.35 174.41 2k25 s VAL 78 N 1.50 -0.02 -0.30 1.48 1.01 -1.26 -4.92 120.40 117.88 2k25 s VAL 78 Ca 0.10 0.08 -0.02 0.00 0.00 0.00 0.00 61.98 62.14 2k25 s VAL 78 Cb -0.18 -0.53 0.05 0.00 0.00 0.00 0.00 36.38 35.73 2k25 s VAL 78 CO -0.22 0.03 0.01 -0.22 0.00 0.00 0.00 175.10 174.69 2k25 s LEU 79 N 1.01 3.94 -0.68 3.92 2.96 -1.26 -4.65 118.68 123.92 2k25 s LEU 79 Ca -0.07 -1.28 -0.16 0.00 -0.22 0.00 0.00 54.13 52.40 2k25 s LEU 79 Cb -0.07 -1.72 0.02 0.00 0.50 0.00 0.00 46.19 44.92 2k25 s LEU 79 CO -0.08 -0.27 0.63 -1.14 -1.32 0.00 0.00 176.35 174.17 2k25 n ARG 80 N 4.63 -1.70 -0.73 1.98 0.63 -1.26 -4.86 116.66 115.35 2k25 n ARG 80 Ca -0.13 1.02 -0.33 0.00 -0.92 0.00 0.00 57.85 57.48 2k25 n ARG 80 Cb 0.43 -2.13 0.15 0.00 0.45 0.00 0.00 32.46 31.36 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 -1.66 -2.25 0.10 6.15 -0.00 -1.26 -4.99 117.00 113.09 2k25 n LEU 81 Ca -0.23 -0.06 0.00 0.00 -0.00 0.00 0.00 56.01 55.72 2k25 n LEU 81 Cb 0.70 -0.93 0.00 0.00 -0.00 0.00 0.00 43.42 43.19 2k25 n LEU 81 CO 0.61 -3.14 -0.02 -1.14 -0.00 0.00 0.00 177.39 173.69 2k25 n ARG 82 N -1.43 0.00 0.00 1.47 0.63 -1.26 -5.13 116.66 110.94 2k25 n ARG 82 Ca 0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.94 2k25 n ARG 82 Cb 0.63 -0.15 0.00 0.00 0.45 0.00 0.00 32.46 33.39 2k25 n ARG 82 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2k25 n GLY 83 N 2.08 3.51 3.59 5.14 0.00 -1.26 -5.18 105.19 113.06 2k25 n GLY 83 Ca 0.00 -1.04 -0.04 0.00 0.00 0.00 0.00 46.02 44.93 2k25 n GLY 83 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2k25 s TYR 84 N 0.00 -0.17 0.08 1.61 5.04 -1.26 -5.08 117.35 117.57 2k25 s TYR 84 Ca 0.00 0.07 -0.26 0.00 -2.44 0.00 0.00 57.07 54.44 2k25 s TYR 84 Cb 0.00 0.53 0.08 0.00 0.35 0.00 0.00 41.96 42.93 2k25 s TYR 84 CO 0.00 -0.34 0.72 0.00 -1.34 0.00 0.00 175.55 174.59 2k25 s ALA 85 N -2.65 -1.70 -0.29 3.97 0.00 -1.26 -4.48 121.76 115.34 2k25 s ALA 85 Ca 0.09 0.77 -0.20 0.00 0.00 0.00 0.00 51.96 52.62 2k25 s ALA 85 Cb -0.00 0.61 0.17 0.00 0.00 0.00 0.00 23.12 23.90 2k25 s ALA 85 CO -0.05 -0.70 1.19 0.16 0.00 0.00 0.00 175.76 176.37 2k25 s ASP 86 N -2.49 -0.25 -0.50 0.00 -4.77 -1.26 -5.10 116.67 102.30 2k25 s ASP 86 Ca 0.01 0.44 -0.26 0.00 -3.30 0.00 0.00 52.55 49.44 2k25 s ASP 86 Cb -0.01 0.78 -0.05 0.00 -1.09 0.00 0.00 42.92 42.56 2k25 s ASP 86 CO -0.09 -0.07 2.17 -0.76 0.70 0.00 0.00 175.17 177.11 2k25 s LEU 87 N 0.67 3.37 -0.29 2.11 1.02 -1.26 -4.87 118.68 119.43 2k25 s LEU 87 Ca -0.02 0.89 -0.25 0.00 0.02 0.00 0.00 54.13 54.78 2k25 s LEU 87 Cb -0.04 -2.64 0.14 0.00 0.02 0.00 0.00 46.19 43.66 2k25 s LEU 87 CO -0.12 -2.58 1.11 -0.60 0.02 0.00 0.00 176.35 174.18 2k25 s ARG 88 N 7.56 0.42 0.28 1.70 3.52 -1.26 -5.04 118.95 126.13 2k25 s ARG 88 Ca 0.86 0.50 0.00 0.00 -0.13 0.00 0.00 55.73 56.96 2k25 s ARG 88 Cb -0.17 0.20 0.42 0.00 -1.56 0.00 0.00 34.95 33.84 2k25 s ARG 88 CO 0.25 -0.05 1.79 1.05 -0.81 0.00 0.00 175.30 177.53 2k25 h GLU 89 N 4.03 0.68 -1.19 5.12 4.11 -1.89 -3.47 114.58 121.96 2k25 h GLU 89 Ca -0.28 -0.18 0.30 0.00 0.07 0.00 0.00 59.36 59.27 2k25 h GLU 89 Cb 1.18 -0.08 -0.20 0.00 0.50 0.00 0.00 28.75 30.15 2k25 h GLU 89 CO 0.12 0.72 0.92 -0.51 0.07 0.00 0.00 179.01 180.33 2k25 s ASP 90 N -6.69 -0.06 0.23 3.06 1.11 -1.26 -4.82 116.67 108.24 2k25 s ASP 90 Ca -0.09 0.00 0.00 0.00 0.18 0.00 0.00 52.55 52.65 2k25 s ASP 90 Cb 0.15 0.06 0.25 0.00 1.07 0.00 0.00 42.92 44.45 2k25 s ASP 90 CO 0.80 -0.09 1.60 1.55 1.18 0.00 0.00 175.17 180.20 2k25 h PRO 91 N 2.00 0.48 -0.34 8.23 0.13 -1.91 -3.44 132.00 137.14 2k25 h PRO 91 Ca -0.04 -0.25 0.24 0.00 -0.87 0.00 0.00 66.00 65.07 2k25 h PRO 91 Cb 1.14 0.01 -0.21 0.00 0.13 0.00 0.00 31.00 32.07 2k25 h PRO 91 CO 0.20 0.82 0.15 0.16 -0.23 0.00 0.00 178.00 179.11 2k25 s ASP 92 N -6.87 -0.44 0.10 1.44 1.47 -1.26 -5.18 116.67 105.94 2k25 s ASP 92 Ca -0.07 0.29 0.00 0.00 1.18 0.00 0.00 52.55 53.96 2k25 s ASP 92 Cb 0.12 1.38 -0.00 0.00 -0.34 0.00 0.00 42.92 44.08 2k25 s ASP 92 CO 0.81 -0.08 0.01 -2.11 0.68 0.00 0.00 175.17 174.48 2k25 n ARG 93 N 5.44 1.47 -3.90 2.11 1.85 -1.26 -4.92 116.66 117.44 2k25 n ARG 93 Ca -0.07 -0.77 -0.23 0.00 -1.00 0.00 0.00 57.85 55.78 2k25 n ARG 93 Cb 0.54 0.27 -0.05 0.00 -1.05 0.00 0.00 32.46 32.17 2k25 n ARG 93 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2k25 n GLN 94 N -0.25 1.09 -2.04 2.89 0.00 -1.26 -5.14 117.38 112.67 2k25 n GLN 94 Ca -0.03 -2.64 -0.31 0.00 0.00 0.00 0.00 57.00 54.02 2k25 n GLN 94 Cb 0.13 0.75 0.00 0.00 0.00 0.00 0.00 30.24 31.13 2k25 n GLN 94 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2k25 s ASP 95 N -2.98 6.29 0.36 2.61 2.15 -1.26 -5.09 116.67 118.74 2k25 s ASP 95 Ca 0.01 1.37 0.00 0.00 0.43 0.00 0.00 52.55 54.37 2k25 s ASP 95 Cb 0.00 -2.45 0.00 0.00 -0.30 0.00 0.00 42.92 40.18 2k25 s ASP 95 CO 0.01 -0.79 0.02 1.41 -0.17 0.00 0.00 175.17 175.65 2k25 n HIS 96 N -2.52 0.68 -2.67 -5.34 8.25 -1.26 -5.12 115.22 107.24 2k25 n HIS 96 Ca 0.05 -1.74 -0.04 0.00 -0.26 0.00 0.00 57.72 55.73 2k25 n HIS 96 Cb 0.54 -0.24 0.06 0.00 1.12 0.00 0.00 29.99 31.47 2k25 n HIS 96 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2k25 n HIS 97 N -0.93 -0.71 -0.54 4.41 1.44 -1.26 -5.17 115.22 112.46 2k25 n HIS 97 Ca -0.14 -0.73 -0.03 0.00 -2.01 0.00 0.00 57.72 54.82 2k25 n HIS 97 Cb 0.45 1.11 0.02 0.00 0.12 0.00 0.00 29.99 31.69 2k25 n HIS 97 CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 2k25 n PRO 98 N 1.85 -1.24 0.00 -1.40 -0.04 -1.26 -5.10 135.00 127.81 2k25 n PRO 98 Ca 0.05 -0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 2k25 n PRO 98 Cb 0.69 -0.16 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 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 1.72 5.47 3.51 0.55 0.00 -1.26 -5.19 105.19 109.98 2k25 n GLY 99 Ca 0.01 -1.16 -0.09 0.00 0.00 0.00 0.00 46.02 44.78 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 1.00 -0.42 0.00 1.61 1.04 -1.26 -5.19 113.70 110.48 2k25 s SER 100 Ca 0.00 -0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.36 2k25 s SER 100 Cb 0.00 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.62 2k25 s SER 100 CO 0.00 -0.82 0.00 0.61 0.98 0.00 0.00 173.24 174.01 2k25 n GLY 101 N -0.33 4.67 3.59 7.32 0.00 -1.26 -5.17 105.19 114.01 2k25 n GLY 101 Ca -0.11 -1.93 -0.04 0.00 0.00 0.00 0.00 46.02 43.94 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 -2.21 -2.03 -1.79 4.61 0.00 -1.26 -5.38 121.76 113.71 2k25 s ALA 102 Ca 0.00 1.23 0.14 0.00 0.00 0.00 0.00 51.96 53.34 2k25 s ALA 102 Cb 0.00 0.12 0.11 0.00 0.00 0.00 0.00 23.12 23.35 2k25 s ALA 102 CO 0.00 -0.72 0.95 0.00 0.00 0.00 0.00 175.76 175.99