#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 5.91 0.11 1.61 0.01 -1.26 -4.98 113.70 115.10 2k25 s SER 2 Ca 0.00 0.22 -0.31 0.00 1.31 0.00 0.00 55.95 57.17 2k25 s SER 2 Cb 0.00 -1.96 -0.08 0.00 0.21 0.00 0.00 66.02 64.19 2k25 s SER 2 CO 0.00 0.25 1.44 -1.48 0.41 0.00 0.00 173.24 173.87 2k25 s LEU 3 N -0.11 4.36 0.19 2.44 0.05 -1.26 -5.02 118.68 119.33 2k25 s LEU 3 Ca 0.08 2.37 0.10 0.00 0.05 0.00 0.00 54.13 56.73 2k25 s LEU 3 Cb -0.12 -3.58 -0.04 0.00 -2.05 0.00 0.00 46.19 40.40 2k25 s LEU 3 CO 0.01 -0.71 -0.20 0.68 -0.55 0.00 0.00 176.35 175.58 2k25 s VAL 4 N 1.36 2.02 0.45 1.48 -7.23 -1.26 -5.11 120.40 112.10 2k25 s VAL 4 Ca 0.66 -2.02 -0.23 0.00 -1.81 0.00 0.00 61.98 58.58 2k25 s VAL 4 Cb -0.38 -1.98 -0.08 0.00 0.56 0.00 0.00 36.38 34.51 2k25 s VAL 4 CO 0.30 -0.30 1.17 -2.16 -0.31 0.00 0.00 175.10 173.81 2k25 s PRO 5 N -2.90 3.82 -0.28 4.82 0.04 -1.26 -4.94 135.00 134.30 2k25 s PRO 5 Ca 0.19 1.80 -0.27 0.00 0.04 0.00 0.00 61.00 62.76 2k25 s PRO 5 Cb -0.06 -2.48 0.18 0.00 0.04 0.00 0.00 34.50 32.19 2k25 s PRO 5 CO 0.08 -0.50 1.34 0.50 0.04 0.00 0.00 177.00 178.45 2k25 s ARG 6 N -2.60 0.15 0.00 4.56 3.52 -1.26 -5.19 118.95 118.13 2k25 s ARG 6 Ca 0.62 0.10 0.00 0.00 -0.13 0.00 0.00 55.73 56.32 2k25 s ARG 6 Cb -0.29 0.07 0.00 0.00 -1.56 0.00 0.00 34.95 33.17 2k25 s ARG 6 CO 0.36 -0.03 0.00 0.41 -0.81 0.00 0.00 175.30 175.23 2k25 n GLY 7 N 1.12 2.14 0.11 8.12 0.00 -1.26 -4.96 105.19 110.46 2k25 n GLY 7 Ca -0.06 -1.79 -0.15 0.00 0.00 0.00 0.00 46.02 44.02 2k25 n GLY 7 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2k25 n SER 8 N 0.00 1.42 -4.66 1.61 2.88 -1.26 -4.88 113.62 108.73 2k25 n SER 8 Ca 0.00 0.24 -0.35 0.00 -1.33 0.00 0.00 58.87 57.43 2k25 n SER 8 Cb 0.00 -0.33 -0.09 0.00 -0.75 0.00 0.00 64.21 63.04 2k25 n SER 8 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 2k25 s MET 9 N -2.56 3.81 -0.01 -1.46 -1.94 -1.26 -5.09 119.30 110.78 2k25 s MET 9 Ca -0.15 -0.34 0.04 0.00 -1.71 0.00 0.00 55.69 53.53 2k25 s MET 9 Cb 0.07 -3.15 -0.01 0.00 2.01 0.00 0.00 34.83 33.75 2k25 s MET 9 CO 0.78 0.37 -0.13 -0.65 -0.01 0.00 0.00 175.02 175.38 2k25 s GLN 10 N 0.10 1.06 0.28 2.03 -0.21 -1.25 -4.33 119.66 117.33 2k25 s GLN 10 Ca 0.05 -0.45 -0.07 0.00 0.02 0.00 0.00 55.36 54.91 2k25 s GLN 10 Cb -0.12 -1.01 -0.01 0.00 1.00 0.00 0.00 33.01 32.87 2k25 s GLN 10 CO 0.01 0.25 0.43 -1.50 -2.12 0.00 0.00 175.29 172.36 2k25 s ILE 11 N -0.23 0.00 -0.24 1.08 2.07 -0.78 -4.89 121.20 118.22 2k25 s ILE 11 Ca 0.04 -1.56 -0.08 0.00 -1.41 0.00 0.00 60.65 57.63 2k25 s ILE 11 Cb -0.06 -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 0.10 -0.36 -1.91 0.00 0.00 174.94 172.77 2k25 s PHE 12 N -3.66 3.18 -0.03 3.50 0.08 -1.26 -3.91 117.98 115.88 2k25 s PHE 12 Ca 0.28 -0.11 0.02 0.00 0.12 0.00 0.00 56.93 57.24 2k25 s PHE 12 Cb 0.01 -2.23 0.01 0.00 -0.57 0.00 0.00 43.02 40.23 2k25 s PHE 12 CO 0.13 -0.14 -0.08 0.08 -0.10 0.00 0.00 175.22 175.11 2k25 s VAL 13 N 1.29 0.74 -0.08 -0.44 1.01 -1.24 -3.24 120.40 118.44 2k25 s VAL 13 Ca 0.06 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 61.76 2k25 s VAL 13 Cb -0.15 -0.67 -0.01 0.00 0.00 0.00 0.00 36.38 35.56 2k25 s VAL 13 CO 0.05 0.24 -0.24 -0.54 0.00 0.00 0.00 175.10 174.60 2k25 s LYS 14 N 0.26 2.81 0.59 2.72 -0.14 -1.26 -3.29 119.74 121.43 2k25 s LYS 14 Ca -0.04 -0.88 -0.01 0.00 -1.36 0.00 0.00 55.97 53.67 2k25 s LYS 14 Cb -0.09 -2.24 0.12 0.00 -1.68 0.00 0.00 37.83 33.94 2k25 s LYS 14 CO 0.00 0.29 0.81 0.25 -0.76 0.00 0.00 175.35 175.94 2k25 n THR 15 N 3.22 0.00 0.08 2.17 -2.24 -0.75 -4.52 114.28 112.25 2k25 n THR 15 Ca -0.18 -1.18 -0.10 0.00 -2.27 0.00 0.00 64.05 60.31 2k25 n THR 15 Cb 0.52 -1.06 -0.05 0.00 -2.10 0.00 0.00 70.33 67.64 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 0.27 0.00 3.22 4.07 -1.89 -3.25 115.31 117.73 2k25 h LEU 16 Ca -0.27 -0.24 -0.17 0.00 0.08 0.00 0.00 57.88 57.28 2k25 h LEU 16 Cb 0.95 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 42.58 2k25 h LEU 16 CO 0.27 1.10 -0.83 0.00 -1.08 0.00 0.00 178.44 177.90 2k25 h THR 17 N 0.09 1.33 0.00 0.22 1.03 -1.94 -3.48 112.91 110.16 2k25 h THR 17 Ca -0.06 -2.90 0.00 0.00 -0.01 0.00 0.00 66.41 63.44 2k25 h THR 17 Cb 1.65 2.65 0.00 0.00 -1.07 0.00 0.00 68.15 71.38 2k25 h THR 17 CO 0.15 0.76 0.00 0.61 -0.01 0.00 0.00 175.52 177.03 2k25 n GLY 18 N 1.31 1.62 3.83 2.99 0.00 -1.23 -5.08 105.19 108.63 2k25 n GLY 18 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2k25 n GLY 18 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k25 s LYS 19 N -0.01 4.18 -0.14 1.61 2.36 -1.26 -4.80 119.74 121.68 2k25 s LYS 19 Ca 0.00 1.03 -0.00 0.00 -2.55 0.00 0.00 55.97 54.45 2k25 s LYS 19 Cb 0.00 -2.22 -0.01 0.00 -1.05 0.00 0.00 37.83 34.54 2k25 s LYS 19 CO 0.00 -0.01 -0.14 0.95 1.55 0.00 0.00 175.35 177.71 2k25 s THR 20 N -2.16 2.94 -0.02 3.43 -4.23 -1.26 -1.80 115.64 112.54 2k25 s THR 20 Ca 0.60 -0.69 0.02 0.00 -1.18 0.00 0.00 61.69 60.44 2k25 s THR 20 Cb -0.09 -2.24 0.00 0.00 1.34 0.00 0.00 72.50 71.51 2k25 s THR 20 CO 0.14 0.52 -0.08 0.27 -0.54 0.00 0.00 174.62 174.94 2k25 s ILE 21 N 0.48 0.66 -0.21 2.99 -0.00 -1.21 -5.05 121.20 118.86 2k25 s ILE 21 Ca -0.10 -0.31 -0.29 0.00 -0.00 0.00 0.00 60.65 59.96 2k25 s ILE 21 Cb -0.16 -0.58 0.01 0.00 -0.00 0.00 0.00 42.46 41.72 2k25 s ILE 21 CO 0.04 0.21 1.06 -0.89 -0.00 0.00 0.00 174.94 175.36 2k25 s THR 22 N 0.12 4.64 0.19 8.37 2.01 -1.26 -3.62 115.64 126.09 2k25 s THR 22 Ca -0.01 1.98 0.07 0.00 0.31 0.00 0.00 61.69 64.04 2k25 s THR 22 Cb -0.07 -4.28 -0.04 0.00 0.01 0.00 0.00 72.50 68.13 2k25 s THR 22 CO 0.00 -0.16 0.02 -0.76 -0.69 0.00 0.00 174.62 173.04 2k25 s LEU 23 N 3.12 3.37 0.10 4.42 2.01 -1.25 -4.17 118.68 126.27 2k25 s LEU 23 Ca 0.46 -0.40 -0.00 0.00 0.01 0.00 0.00 54.13 54.20 2k25 s LEU 23 Cb -0.16 -1.99 -0.04 0.00 0.01 0.00 0.00 46.19 44.01 2k25 s LEU 23 CO 0.08 0.07 0.25 -1.83 1.01 0.00 0.00 176.35 175.93 2k25 s GLU 24 N -3.12 3.46 0.06 1.70 -1.05 -1.26 -1.86 118.70 116.63 2k25 s GLU 24 Ca 0.29 -0.43 0.05 0.00 -0.15 0.00 0.00 54.97 54.73 2k25 s GLU 24 Cb -0.09 -2.99 -0.03 0.00 -0.44 0.00 0.00 34.13 30.59 2k25 s GLU 24 CO 0.20 0.56 -0.14 0.14 0.95 0.00 0.00 175.26 176.96 2k25 s VAL 25 N -1.60 1.14 -0.29 1.83 -7.23 -1.26 -4.91 120.40 108.08 2k25 s VAL 25 Ca 0.36 -1.16 -0.28 0.00 -1.81 0.00 0.00 61.98 59.09 2k25 s VAL 25 Cb -0.12 -1.07 0.20 0.00 0.56 0.00 0.00 36.38 35.95 2k25 s VAL 25 CO 0.28 -0.10 1.41 -1.61 -0.31 0.00 0.00 175.10 174.76 2k25 s GLU 26 N -1.44 0.03 0.36 4.82 2.02 -1.26 -4.94 118.70 118.29 2k25 s GLU 26 Ca 0.00 0.02 0.15 0.00 0.02 0.00 0.00 54.97 55.16 2k25 s GLU 26 Cb -0.09 0.02 0.69 0.00 0.10 0.00 0.00 34.13 34.84 2k25 s GLU 26 CO 0.02 -0.01 1.77 -1.00 0.02 0.00 0.00 175.26 176.06 2k25 h PRO 27 N 2.35 0.00 -0.00 0.39 0.13 -1.98 -3.03 132.00 129.86 2k25 h PRO 27 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 2k25 h PRO 27 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2k25 h PRO 27 CO 0.21 0.41 -0.80 0.43 -0.23 0.00 0.00 178.00 178.02 2k25 n SER 28 N -3.82 0.86 -4.35 1.44 7.64 -1.26 -2.51 113.62 111.62 2k25 n SER 28 Ca -0.01 -0.93 -0.43 0.00 1.01 0.00 0.00 58.87 58.51 2k25 n SER 28 Cb 0.47 0.98 -0.08 0.00 -1.01 0.00 0.00 64.21 64.57 2k25 n SER 28 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k25 s ASP 29 N -2.61 6.01 0.75 6.43 2.15 -1.15 -4.94 116.67 123.31 2k25 s ASP 29 Ca 0.07 -1.41 -0.07 0.00 0.43 0.00 0.00 52.55 51.56 2k25 s ASP 29 Cb 0.13 -2.13 0.10 0.00 -0.30 0.00 0.00 42.92 40.72 2k25 s ASP 29 CO 0.70 -0.63 1.06 0.28 -0.17 0.00 0.00 175.17 176.41 2k25 s THR 30 N 1.58 2.21 0.54 1.71 -1.32 -1.26 -4.16 115.64 114.93 2k25 s THR 30 Ca 0.04 -0.28 0.29 0.00 -1.21 0.00 0.00 61.69 60.53 2k25 s THR 30 Cb -0.24 -2.93 0.44 0.00 -1.51 0.00 0.00 72.50 68.26 2k25 s THR 30 CO 0.05 0.00 1.92 0.40 -2.21 0.00 0.00 174.62 174.78 2k25 h ILE 31 N -0.76 0.57 -0.14 5.08 5.03 -1.94 -0.89 117.51 124.46 2k25 h ILE 31 Ca -0.43 0.00 0.05 0.00 -0.12 0.00 0.00 64.86 64.36 2k25 h ILE 31 Cb 1.29 0.62 -0.06 0.00 -3.03 0.00 0.00 36.82 35.64 2k25 h ILE 31 CO 0.53 0.00 -0.27 -0.08 -0.68 0.00 0.00 178.15 177.65 2k25 h GLU 32 N 0.00 -0.32 0.20 2.37 4.81 -1.92 0.65 114.58 120.36 2k25 h GLU 32 Ca 0.34 0.02 -0.32 0.00 -0.13 0.00 0.00 59.36 59.27 2k25 h GLU 32 Cb 1.41 0.07 0.03 0.00 0.63 0.00 0.00 28.75 30.90 2k25 h GLU 32 CO -0.00 -0.22 -1.38 -0.97 -0.73 0.00 0.00 179.01 175.71 2k25 h ASN 33 N -0.34 0.84 -0.81 1.04 -1.24 -1.67 -3.28 115.58 110.13 2k25 h ASN 33 Ca 0.10 -0.85 0.18 0.00 0.71 0.00 0.00 56.30 56.44 2k25 h ASN 33 Cb 0.49 -0.27 -0.05 0.00 0.73 0.00 0.00 38.32 39.22 2k25 h ASN 33 CO -0.33 1.66 0.54 0.58 -1.29 0.00 0.00 177.43 178.59 2k25 h VAL 34 N 0.20 0.73 -0.66 2.57 2.07 -0.97 0.91 116.25 121.10 2k25 h VAL 34 Ca -0.22 -0.13 0.19 0.00 0.82 0.00 0.00 66.70 67.36 2k25 h VAL 34 Cb 2.06 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 32.14 2k25 h VAL 34 CO 0.26 0.07 0.55 0.07 0.02 0.00 0.00 177.57 178.54 2k25 h LYS 35 N 0.37 0.00 -0.16 1.57 5.09 -0.92 0.06 116.57 122.58 2k25 h LYS 35 Ca 0.41 0.00 -0.04 0.00 0.09 0.00 0.00 60.65 61.11 2k25 h LYS 35 Cb 1.03 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 33.35 2k25 h LYS 35 CO -0.13 0.00 -0.05 0.00 -2.09 0.00 0.00 179.45 177.18 2k25 h ALA 36 N 1.52 0.22 -0.18 0.07 0.00 -1.01 0.29 119.26 120.15 2k25 h ALA 36 Ca 0.32 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 55.01 2k25 h ALA 36 Cb 1.42 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 2k25 h ALA 36 CO -0.00 -0.01 -0.03 0.87 0.00 0.00 0.00 179.25 180.07 2k25 h LYS 37 N 0.01 0.01 -0.00 0.00 1.79 -1.10 -2.18 116.57 115.11 2k25 h LYS 37 Ca 0.04 -0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.37 2k25 h LYS 37 Cb 0.49 -0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.12 2k25 h LYS 37 CO 0.02 0.01 -0.64 0.97 -1.08 0.00 0.00 179.45 178.73 2k25 h ILE 38 N 0.01 1.46 -0.64 1.86 -0.00 -1.51 -3.06 117.51 115.62 2k25 h ILE 38 Ca 0.09 -2.18 0.17 0.00 -0.00 0.00 0.00 64.86 62.93 2k25 h ILE 38 Cb 0.13 2.18 -0.03 0.00 -0.00 0.00 0.00 36.82 39.09 2k25 h ILE 38 CO -0.18 0.62 0.45 1.56 -0.00 0.00 0.00 178.15 180.60 2k25 h GLN 39 N 0.00 0.12 0.00 2.19 4.20 0.23 0.31 115.11 122.16 2k25 h GLN 39 Ca -0.01 -0.01 -0.11 0.00 0.06 0.00 0.00 58.65 58.58 2k25 h GLN 39 Cb 1.13 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.86 2k25 h GLN 39 CO 0.08 0.08 -0.54 -0.44 -0.67 0.00 0.00 178.83 177.34 2k25 h ASP 40 N 0.12 0.00 0.17 1.46 3.32 -1.40 0.12 116.42 120.20 2k25 h ASP 40 Ca 0.31 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.35 2k25 h ASP 40 Cb 1.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.60 2k25 h ASP 40 CO -0.04 0.54 -0.08 0.11 -1.72 0.00 0.00 179.24 178.06 2k25 h LYS 41 N 0.00 -0.22 0.00 3.56 6.56 -0.52 -3.39 116.57 122.56 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 1.20 0.05 0.00 0.00 -0.57 0.00 0.00 32.23 32.91 2k25 h LYS 41 CO 0.07 0.18 -0.69 -0.85 -2.06 0.00 0.00 179.45 176.10 2k25 n GLU 42 N -4.92 0.73 -0.30 3.15 0.28 -0.77 -4.58 120.64 114.23 2k25 n GLU 42 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.93 2k25 n GLU 42 Cb 0.25 -0.85 0.00 0.00 1.43 0.00 0.00 31.44 32.28 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 2.71 1.75 3.69 -1.84 0.00 0.01 -2.65 105.19 108.87 2k25 n GLY 43 Ca 0.00 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 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 4.78 0.26 -0.61 -1.09 -1.26 -4.94 121.20 116.35 2k25 s ILE 44 Ca 0.00 2.03 -0.29 0.00 -2.23 0.00 0.00 60.65 60.16 2k25 s ILE 44 Cb 0.00 -4.31 -0.09 0.00 -1.58 0.00 0.00 42.46 36.48 2k25 s ILE 44 CO 0.00 0.03 1.26 -2.16 -1.23 0.00 0.00 174.94 172.84 2k25 s PRO 45 N 1.83 4.44 0.54 2.79 0.04 -1.26 -4.69 135.00 138.69 2k25 s PRO 45 Ca 0.49 2.05 0.33 0.00 0.04 0.00 0.00 61.00 63.91 2k25 s PRO 45 Cb -0.19 -3.15 1.37 0.00 0.04 0.00 0.00 34.50 32.57 2k25 s PRO 45 CO 0.20 -0.12 1.99 -1.00 0.04 0.00 0.00 177.00 178.11 2k25 h PRO 46 N 4.33 0.00 -0.36 0.56 0.13 -1.92 0.18 132.00 134.92 2k25 h PRO 46 Ca -0.47 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.61 2k25 h PRO 46 Cb 1.22 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 2k25 h PRO 46 CO 0.71 0.03 -0.02 -0.44 -0.23 0.00 0.00 178.00 178.05 2k25 h ASP 47 N 0.00 0.55 0.00 1.44 5.19 -1.99 -3.22 116.42 118.39 2k25 h ASP 47 Ca -0.00 -0.11 -0.12 0.00 -0.62 0.00 0.00 57.03 56.17 2k25 h ASP 47 Cb 0.51 -0.14 -0.02 0.00 0.18 0.00 0.00 39.33 39.85 2k25 h ASP 47 CO 0.00 0.63 -1.76 0.00 -3.12 0.00 0.00 179.24 175.00 2k25 n GLN 48 N -4.25 1.21 -1.64 3.56 6.02 -1.11 -4.97 117.38 116.19 2k25 n GLN 48 Ca 0.02 -0.06 -0.46 0.00 -0.01 0.00 0.00 57.00 56.48 2k25 n GLN 48 Cb 0.27 -1.33 -0.04 0.00 1.02 0.00 0.00 30.24 30.16 2k25 n GLN 48 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 2k25 n GLN 49 N -2.24 2.26 -2.06 -1.09 7.27 0.63 -4.74 117.38 117.42 2k25 n GLN 49 Ca -0.12 0.79 -0.32 0.00 0.07 0.00 0.00 57.00 57.42 2k25 n GLN 49 Cb 0.65 -2.83 0.00 0.00 2.41 0.00 0.00 30.24 30.47 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 4.73 3.43 -0.10 3.69 1.70 -1.26 -4.86 118.95 126.29 2k25 s ARG 50 Ca 0.94 1.09 0.04 0.00 -0.47 0.00 0.00 55.73 57.33 2k25 s ARG 50 Cb -0.57 -2.05 -0.00 0.00 -0.57 0.00 0.00 34.95 31.75 2k25 s ARG 50 CO 0.46 -0.71 -0.23 -0.51 -1.08 0.00 0.00 175.30 173.23 2k25 s LEU 51 N -4.56 2.12 -0.14 -1.89 1.02 -1.26 -2.56 118.68 111.41 2k25 s LEU 51 Ca 0.61 -0.55 -0.00 0.00 0.02 0.00 0.00 54.13 54.21 2k25 s LEU 51 Cb -0.14 -1.42 0.03 0.00 0.02 0.00 0.00 46.19 44.68 2k25 s LEU 51 CO 0.39 0.16 -0.06 -0.63 0.02 0.00 0.00 176.35 176.22 2k25 s ILE 52 N 0.34 1.06 -0.13 -0.59 1.09 -0.99 -2.98 121.20 119.00 2k25 s ILE 52 Ca -0.18 -0.44 -0.01 0.00 -1.10 0.00 0.00 60.65 58.92 2k25 s ILE 52 Cb -0.18 -1.15 0.03 0.00 -1.06 0.00 0.00 42.46 40.10 2k25 s ILE 52 CO 0.09 0.26 -0.05 0.12 -0.10 0.00 0.00 174.94 175.25 2k25 s PHE 53 N 1.68 1.38 -1.66 3.97 5.36 0.11 -3.14 117.98 125.68 2k25 s PHE 53 Ca 0.03 -0.75 0.00 0.00 -0.96 0.00 0.00 56.93 55.26 2k25 s PHE 53 Cb -0.14 -1.17 0.00 0.00 -0.34 0.00 0.00 43.02 41.37 2k25 s PHE 53 CO -0.08 -0.52 0.00 0.00 -1.46 0.00 0.00 175.22 173.16 2k25 n ALA 54 N 4.97 -0.64 0.00 11.12 0.00 -1.26 -0.50 120.51 134.19 2k25 n ALA 54 Ca -0.11 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2k25 n ALA 54 Cb 0.49 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.89 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 -0.95 2.14 3.83 0.00 0.00 -1.26 -5.02 105.19 103.92 2k25 n GLY 55 Ca -0.23 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.43 2k25 n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k25 s LYS 56 N -0.36 3.73 0.03 1.61 -2.85 0.34 -5.08 119.74 117.16 2k25 s LYS 56 Ca 0.00 -0.09 -0.04 0.00 -1.00 0.00 0.00 55.97 54.85 2k25 s LYS 56 Cb 0.00 -3.27 -0.04 0.00 -2.06 0.00 0.00 37.83 32.46 2k25 s LYS 56 CO 0.00 0.61 0.24 -1.14 0.10 0.00 0.00 175.35 175.17 2k25 s GLN 57 N -0.58 3.51 0.35 1.78 0.74 -1.26 0.05 119.66 124.26 2k25 s GLN 57 Ca 0.14 -0.22 0.01 0.00 0.05 0.00 0.00 55.36 55.34 2k25 s GLN 57 Cb -0.12 -3.05 -0.00 0.00 1.10 0.00 0.00 33.01 30.94 2k25 s GLN 57 CO 0.03 0.63 0.02 1.47 -0.55 0.00 0.00 175.29 176.89 2k25 n LEU 58 N 0.77 0.00 0.00 3.68 -0.00 -1.16 -4.99 117.00 115.30 2k25 n LEU 58 Ca -0.09 -2.31 0.00 0.00 -0.00 0.00 0.00 56.01 53.62 2k25 n LEU 58 Cb 0.52 0.37 0.00 0.00 -0.00 0.00 0.00 43.42 44.31 2k25 n LEU 58 CO 0.45 -0.33 0.00 -0.62 -0.00 0.00 0.00 177.39 176.89 2k25 n GLU 59 N -0.86 0.00 -1.53 1.47 1.02 -1.26 -4.56 120.64 114.92 2k25 n GLU 59 Ca -0.13 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.63 2k25 n GLU 59 Cb 0.46 -0.26 0.04 0.00 -0.02 0.00 0.00 31.44 31.66 2k25 n GLU 59 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2k25 n ASP 60 N -1.76 -0.26 -3.92 1.62 -0.08 -1.26 -4.95 116.55 105.94 2k25 n ASP 60 Ca 0.00 0.79 -0.31 0.00 -1.51 0.00 0.00 54.79 53.76 2k25 n ASP 60 Cb 0.00 -1.26 -0.09 0.00 2.34 0.00 0.00 41.12 42.11 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 1.57 4.19 3.42 0.27 0.00 -1.26 -5.05 105.19 108.33 2k25 n GLY 61 Ca 0.12 -2.62 -0.20 0.00 0.00 0.00 0.00 46.02 43.32 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 -1.60 1.57 0.63 1.61 1.81 -1.26 -4.95 118.95 116.75 2k25 s ARG 62 Ca 0.28 -1.85 -0.12 0.00 -1.72 0.00 0.00 55.73 52.31 2k25 s ARG 62 Cb -0.03 -0.83 -0.03 0.00 -0.45 0.00 0.00 34.95 33.62 2k25 s ARG 62 CO -0.13 -0.15 1.04 0.95 -0.68 0.00 0.00 175.30 176.33 2k25 s THR 63 N -3.30 4.29 0.24 0.02 -4.23 -1.26 -4.51 115.64 106.90 2k25 s THR 63 Ca 0.34 0.85 -0.05 0.00 -1.18 0.00 0.00 61.69 61.66 2k25 s THR 63 Cb 0.08 -3.60 0.21 0.00 1.34 0.00 0.00 72.50 70.53 2k25 s THR 63 CO 0.14 -0.87 1.82 -0.07 -0.54 0.00 0.00 174.62 175.09 2k25 h LEU 64 N -0.16 0.71 -0.78 4.79 3.38 -1.75 0.28 115.31 121.77 2k25 h LEU 64 Ca -0.45 0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.44 2k25 h LEU 64 Cb 1.20 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.83 2k25 h LEU 64 CO 0.59 0.42 -0.60 -1.28 0.09 0.00 0.00 178.44 177.66 2k25 h SER 65 N 0.83 0.00 -0.09 -0.43 0.87 -1.71 0.34 113.55 113.37 2k25 h SER 65 Ca 0.39 0.00 -0.22 0.00 -1.23 0.00 0.00 61.79 60.73 2k25 h SER 65 Cb 0.32 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.29 2k25 h SER 65 CO -0.23 0.60 -0.81 -0.33 -0.53 0.00 0.00 176.83 175.54 2k25 h GLU 66 N 0.00 0.70 -0.01 2.24 5.08 -1.37 -3.19 114.58 118.03 2k25 h GLU 66 Ca -0.01 -0.64 0.00 0.00 -1.00 0.00 0.00 59.36 57.72 2k25 h GLU 66 Cb 1.07 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2k25 h GLU 66 CO 0.08 1.24 -0.16 0.98 -1.00 0.00 0.00 179.01 180.15 2k25 n TYR 67 N -3.98 0.00 -1.27 4.33 4.19 0.83 -4.92 117.16 116.34 2k25 n TYR 67 Ca -0.09 0.00 -0.09 0.00 3.31 0.00 0.00 57.90 61.03 2k25 n TYR 67 Cb 0.76 -0.05 -0.04 0.00 0.49 0.00 0.00 39.34 40.50 2k25 n TYR 67 CO 0.00 0.00 0.00 -1.71 0.91 0.00 0.00 176.86 176.06 2k25 n ASN 68 N -0.08 -5.23 -4.92 2.98 2.85 0.10 -4.97 115.26 105.99 2k25 n ASN 68 Ca 0.14 0.23 -0.26 0.00 -0.11 0.00 0.00 54.58 54.59 2k25 n ASN 68 Cb 0.39 -3.55 0.00 0.00 1.24 0.00 0.00 39.78 37.86 2k25 n ASN 68 CO 0.00 0.00 0.00 0.27 -2.11 0.00 0.00 177.26 175.42 2k25 s ILE 69 N -1.97 4.75 -0.14 -1.44 -4.36 -0.03 -4.97 121.20 113.03 2k25 s ILE 69 Ca 0.00 -0.06 0.00 0.00 -0.26 0.00 0.00 60.65 60.34 2k25 s ILE 69 Cb 0.00 -3.79 0.03 0.00 1.25 0.00 0.00 42.46 39.95 2k25 s ILE 69 CO 0.00 -0.69 -0.11 -1.10 0.24 0.00 0.00 174.94 173.28 2k25 s GLN 70 N -4.64 1.94 0.00 0.37 -0.21 -1.26 -4.47 119.66 111.38 2k25 s GLN 70 Ca 0.46 -0.49 0.00 0.00 0.02 0.00 0.00 55.36 55.35 2k25 s GLN 70 Cb -0.10 -1.96 0.00 0.00 1.00 0.00 0.00 33.01 31.94 2k25 s GLN 70 CO 0.42 -0.29 0.85 1.63 -2.12 0.00 0.00 175.29 175.78 2k25 n LYS 71 N 4.83 2.08 -1.08 2.91 4.76 -1.26 -4.87 118.16 125.53 2k25 n LYS 71 Ca -0.15 -1.21 -0.32 0.00 -2.87 0.00 0.00 58.31 53.77 2k25 n LYS 71 Cb 0.49 -0.89 -0.03 0.00 -1.84 0.00 0.00 35.03 32.76 2k25 n LYS 71 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 2k25 n GLU 72 N -0.36 3.04 0.00 1.97 0.28 -1.26 -4.18 120.64 120.13 2k25 n GLU 72 Ca 0.00 -1.87 0.00 0.00 -0.16 0.00 0.00 57.16 55.13 2k25 n GLU 72 Cb 0.28 -2.63 0.00 0.00 1.43 0.00 0.00 31.44 30.52 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 3.75 0.00 -3.66 -1.84 2.88 -1.26 -5.12 113.62 108.37 2k25 n SER 73 Ca 0.65 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.92 2k25 n SER 73 Cb 0.22 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.51 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 0.21 -0.04 2.46 2.01 -1.26 -4.46 115.64 114.57 2k25 s THR 74 Ca 0.00 -0.42 0.02 0.00 0.31 0.00 0.00 61.69 61.60 2k25 s THR 74 Cb 0.00 -0.84 0.01 0.00 0.01 0.00 0.00 72.50 71.68 2k25 s THR 74 CO 0.00 -0.29 -0.08 -0.22 -0.69 0.00 0.00 174.62 173.34 2k25 s LEU 75 N 2.00 1.63 -0.30 4.42 1.98 -1.20 -4.76 118.68 122.44 2k25 s LEU 75 Ca 0.01 -0.19 0.03 0.00 -2.89 0.00 0.00 54.13 51.09 2k25 s LEU 75 Cb -0.17 -0.57 0.08 0.00 0.66 0.00 0.00 46.19 46.19 2k25 s LEU 75 CO -0.11 0.03 -0.02 -1.00 -1.89 0.00 0.00 176.35 173.36 2k25 s HIS 76 N 0.48 3.48 -0.35 5.38 3.76 -1.19 -4.01 115.29 122.84 2k25 s HIS 76 Ca -0.08 -2.56 0.00 0.00 -0.15 0.00 0.00 55.06 52.28 2k25 s HIS 76 Cb -0.12 -2.41 0.11 0.00 1.11 0.00 0.00 32.58 31.28 2k25 s HIS 76 CO 0.01 -0.91 0.15 -0.48 -0.85 0.00 0.00 174.74 172.66 2k25 s LEU 77 N 1.04 2.38 -0.02 0.89 2.34 -1.26 -2.35 118.68 121.70 2k25 s LEU 77 Ca 0.00 -1.99 -0.12 0.00 0.06 0.00 0.00 54.13 52.08 2k25 s LEU 77 Cb -0.20 -0.91 0.02 0.00 -0.56 0.00 0.00 46.19 44.54 2k25 s LEU 77 CO -0.06 -0.36 0.24 -0.69 -1.06 0.00 0.00 176.35 174.42 2k25 s VAL 78 N 1.18 0.06 -0.18 1.48 1.01 -1.06 -4.76 120.40 118.13 2k25 s VAL 78 Ca 0.13 -0.51 -0.20 0.00 0.00 0.00 0.00 61.98 61.40 2k25 s VAL 78 Cb -0.20 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 2k25 s VAL 78 CO -0.15 -0.28 0.57 -0.22 0.00 0.00 0.00 175.10 175.02 2k25 s LEU 79 N -1.22 4.17 0.00 3.92 2.96 -1.26 -4.09 118.68 123.16 2k25 s LEU 79 Ca -0.13 0.79 0.00 0.00 -0.22 0.00 0.00 54.13 54.57 2k25 s LEU 79 Cb -0.06 -2.81 0.00 0.00 0.50 0.00 0.00 46.19 43.82 2k25 s LEU 79 CO 0.03 -0.20 0.00 -1.14 -1.32 0.00 0.00 176.35 173.72 2k25 n ARG 80 N 4.72 0.00 -2.79 1.98 0.63 -1.26 -4.70 116.66 115.24 2k25 n ARG 80 Ca -0.03 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.47 2k25 n ARG 80 Cb 0.50 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 33.39 2k25 n ARG 80 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2k25 s LEU 81 N 0.00 4.45 0.00 6.15 1.02 -1.26 -4.55 118.68 124.49 2k25 s LEU 81 Ca 0.00 -1.78 0.00 0.00 0.02 0.00 0.00 54.13 52.37 2k25 s LEU 81 Cb 0.00 -2.46 0.00 0.00 0.02 0.00 0.00 46.19 43.75 2k25 s LEU 81 CO 0.00 -1.25 0.00 -1.14 0.02 0.00 0.00 176.35 173.98 2k25 n ARG 82 N 7.47 0.00 0.00 1.70 3.00 -1.26 -4.51 116.66 123.05 2k25 n ARG 82 Ca 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.11 2k25 n ARG 82 Cb 0.50 -0.60 0.00 0.00 0.00 0.00 0.00 32.46 32.36 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 2.33 -1.50 3.86 5.14 0.00 -1.26 -5.02 105.19 108.74 2k25 n GLY 83 Ca 0.00 -1.35 -0.31 0.00 0.00 0.00 0.00 46.02 44.36 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 0.00 3.51 -0.20 1.61 2.02 -1.26 -5.09 117.35 117.94 2k25 s TYR 84 Ca 0.00 1.24 -0.27 0.00 -0.37 0.00 0.00 57.07 57.67 2k25 s TYR 84 Cb 0.00 -2.63 0.08 0.00 -0.40 0.00 0.00 41.96 39.01 2k25 s TYR 84 CO 0.00 -0.36 0.76 0.00 -1.57 0.00 0.00 175.55 174.37 2k25 s ALA 85 N -2.70 -1.81 0.14 3.71 0.00 -1.26 -5.11 121.76 114.73 2k25 s ALA 85 Ca 0.55 1.78 -0.25 0.00 0.00 0.00 0.00 51.96 54.03 2k25 s ALA 85 Cb -0.10 -0.83 0.07 0.00 0.00 0.00 0.00 23.12 22.25 2k25 s ALA 85 CO 0.38 -0.34 0.89 0.34 0.00 0.00 0.00 175.76 177.04 2k25 s ASP 86 N -0.19 -0.25 -0.04 0.00 2.15 -1.08 -5.08 116.67 112.18 2k25 s ASP 86 Ca -0.03 -0.32 -0.36 0.00 0.43 0.00 0.00 52.55 52.26 2k25 s ASP 86 Cb -0.03 0.51 -0.14 0.00 -0.30 0.00 0.00 42.92 42.95 2k25 s ASP 86 CO 0.03 -0.91 1.66 0.18 -0.17 0.00 0.00 175.17 175.96 2k25 n LEU 87 N -0.42 2.72 0.00 -1.34 4.32 -1.26 -4.12 117.00 116.90 2k25 n LEU 87 Ca -0.07 1.05 -0.27 0.00 -0.02 0.00 0.00 56.01 56.71 2k25 n LEU 87 Cb 0.61 -1.29 0.26 0.00 -1.62 0.00 0.00 43.42 41.38 2k25 n LEU 87 CO 0.13 -0.41 0.30 0.54 -1.22 0.00 0.00 177.39 176.73 2k25 n ARG 88 N 4.70 -4.22 -1.38 3.23 5.12 -1.13 -4.82 116.66 118.15 2k25 n ARG 88 Ca 0.21 -1.29 -0.25 0.00 -1.93 0.00 0.00 57.85 54.60 2k25 n ARG 88 Cb 0.23 -1.77 -0.09 0.00 -1.16 0.00 0.00 32.46 29.68 2k25 n ARG 88 CO 0.00 0.00 0.00 -1.91 -1.93 0.00 0.00 177.63 173.79 2k25 n GLU 89 N -4.94 2.63 -3.08 5.56 4.07 -1.26 -4.77 120.64 118.85 2k25 n GLU 89 Ca 0.12 -2.04 -0.14 0.00 -0.06 0.00 0.00 57.16 55.04 2k25 n GLU 89 Cb 0.53 -2.20 0.01 0.00 -0.06 0.00 0.00 31.44 29.72 2k25 n GLU 89 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2k25 n ASP 90 N 1.68 -7.25 -4.31 4.31 8.00 -1.26 -4.77 116.55 112.94 2k25 n ASP 90 Ca 0.51 0.20 -0.32 0.00 0.71 0.00 0.00 54.79 55.88 2k25 n ASP 90 Cb 0.61 -4.41 -0.06 0.00 -0.02 0.00 0.00 41.12 37.23 2k25 n ASP 90 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2k25 n PRO 91 N -0.69 1.55 -3.65 -0.24 -0.04 -1.26 -4.77 135.00 125.90 2k25 n PRO 91 Ca 0.03 -2.28 -0.01 0.00 -0.04 0.00 0.00 63.50 61.19 2k25 n PRO 91 Cb 0.53 -3.50 -0.05 0.00 -0.04 0.00 0.00 33.50 30.44 2k25 n PRO 91 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2k25 s ASP 92 N 6.09 -0.00 0.05 3.54 2.15 -1.26 -4.82 116.67 122.42 2k25 s ASP 92 Ca 0.66 0.00 -0.36 0.00 0.43 0.00 0.00 52.55 53.28 2k25 s ASP 92 Cb 0.04 0.00 -0.15 0.00 -0.30 0.00 0.00 42.92 42.51 2k25 s ASP 92 CO 0.14 -0.00 1.54 -2.11 -0.17 0.00 0.00 175.17 174.56 2k25 n ARG 93 N 0.67 1.63 -0.80 4.34 1.85 -1.26 -4.90 116.66 118.20 2k25 n ARG 93 Ca -0.01 0.59 -0.33 0.00 -1.00 0.00 0.00 57.85 57.10 2k25 n ARG 93 Cb 0.59 -2.31 0.12 0.00 -1.05 0.00 0.00 32.46 29.81 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 3.67 -0.41 -3.19 2.89 10.64 -1.26 -5.03 117.38 124.69 2k25 n GLN 94 Ca 0.19 -0.08 0.05 0.00 -1.83 0.00 0.00 57.00 55.33 2k25 n GLN 94 Cb 0.23 -1.78 -0.03 0.00 -0.86 0.00 0.00 30.24 27.80 2k25 n GLN 94 CO 0.00 0.00 0.00 0.16 -1.83 0.00 0.00 177.06 175.39 2k25 s ASP 95 N -1.93 -0.20 0.30 2.61 1.47 -1.26 -5.19 116.67 112.47 2k25 s ASP 95 Ca 0.56 0.19 -0.06 0.00 1.18 0.00 0.00 52.55 54.42 2k25 s ASP 95 Cb -0.20 1.20 -0.00 0.00 -0.34 0.00 0.00 42.92 43.58 2k25 s ASP 95 CO 0.68 -0.04 0.45 -1.38 0.68 0.00 0.00 175.17 175.56 2k25 s HIS 96 N 2.59 0.85 -0.36 2.11 -3.43 -1.26 -5.12 115.29 110.67 2k25 s HIS 96 Ca -0.04 -1.13 -0.02 0.00 -0.80 0.00 0.00 55.06 53.07 2k25 s HIS 96 Cb -0.06 -0.04 0.25 0.00 -1.43 0.00 0.00 32.58 31.31 2k25 s HIS 96 CO -0.12 -1.05 1.15 1.58 -2.00 0.00 0.00 174.74 174.30 2k25 n HIS 97 N -0.48 -1.00 -0.91 0.38 -0.00 -1.26 -5.17 115.22 106.78 2k25 n HIS 97 Ca 0.00 -0.83 -0.23 0.00 -0.00 0.00 0.00 57.72 56.67 2k25 n HIS 97 Cb 0.62 1.16 0.19 0.00 -0.00 0.00 0.00 29.99 31.96 2k25 n HIS 97 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 2k25 n PRO 98 N 1.84 -2.64 0.00 1.57 -0.04 -1.26 -5.06 135.00 129.41 2k25 n PRO 98 Ca 0.05 -1.32 0.00 0.00 -0.04 0.00 0.00 63.50 62.19 2k25 n PRO 98 Cb 0.68 -1.24 0.00 0.00 -0.04 0.00 0.00 33.50 32.90 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 -3.03 3.39 3.73 0.55 0.00 -1.26 -5.19 105.19 103.38 2k25 n GLY 99 Ca 0.11 -0.49 -0.08 0.00 0.00 0.00 0.00 46.02 45.56 2k25 n GLY 99 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k25 s SER 100 N 0.00 -0.34 0.00 1.61 0.01 -1.26 -5.17 113.70 108.55 2k25 s SER 100 Ca 0.00 -0.43 0.00 0.00 1.31 0.00 0.00 55.95 56.83 2k25 s SER 100 Cb 0.00 0.68 0.00 0.00 0.21 0.00 0.00 66.02 66.91 2k25 s SER 100 CO 0.00 -1.22 0.00 0.61 0.41 0.00 0.00 173.24 173.04 2k25 n GLY 101 N -0.44 4.23 3.63 3.44 0.00 -1.26 -5.18 105.19 109.61 2k25 n GLY 101 Ca -0.08 -1.06 -0.04 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.40 -2.09 -2.00 4.61 0.00 -1.26 -5.38 121.76 115.24 2k25 s ALA 102 Ca 0.00 1.81 0.14 0.00 0.00 0.00 0.00 51.96 53.91 2k25 s ALA 102 Cb 0.00 -1.39 0.83 0.00 0.00 0.00 0.00 23.12 22.57 2k25 s ALA 102 CO 0.00 -0.24 1.25 0.94 0.00 0.00 0.00 175.76 177.72