#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j57 n LYS 2 N 0.00 2.52 -3.55 0.11 5.02 0.43 -4.93 118.16 117.76 2j57 n LYS 2 Ca 0.00 -1.75 -0.14 0.00 -2.02 0.00 0.00 58.31 54.40 2j57 n LYS 2 Cb 0.00 -1.18 -0.06 0.00 -0.02 0.00 0.00 35.03 33.77 2j57 n LYS 2 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2j57 s ALA 3 N -0.95 -1.85 0.46 7.82 0.00 -1.26 -1.74 121.76 124.24 2j57 s ALA 3 Ca 0.15 1.46 0.04 0.00 0.00 0.00 0.00 51.96 53.62 2j57 s ALA 3 Cb 0.08 -0.37 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 2j57 s ALA 3 CO 0.11 -0.34 0.05 0.95 0.00 0.00 0.00 175.76 176.53 2j57 s THR 4 N -1.14 1.64 -0.41 0.00 -4.23 -0.21 -4.93 115.64 106.36 2j57 s THR 4 Ca -0.06 -1.93 0.03 0.00 -1.18 0.00 0.00 61.69 58.55 2j57 s THR 4 Cb -0.00 -2.58 0.12 0.00 1.34 0.00 0.00 72.50 71.38 2j57 s THR 4 CO 0.06 0.00 0.15 -0.63 -0.54 0.00 0.00 174.62 173.66 2j57 s ILE 5 N -2.78 2.05 0.16 2.99 1.01 -1.26 -1.21 121.20 122.16 2j57 s ILE 5 Ca 0.23 -2.57 -0.29 0.00 0.00 0.00 0.00 60.65 58.02 2j57 s ILE 5 Cb 0.05 -2.47 -0.02 0.00 0.01 0.00 0.00 42.46 40.02 2j57 s ILE 5 CO 0.12 -0.72 1.55 -0.65 0.00 0.00 0.00 174.94 175.24 2j57 h PRO 6 N 7.17 -0.15 -5.27 2.79 0.11 -1.95 -3.38 132.00 131.33 2j57 h PRO 6 Ca -0.06 0.01 -0.68 0.00 0.11 0.00 0.00 66.00 65.38 2j57 h PRO 6 Cb 0.96 0.03 -0.33 0.00 0.11 0.00 0.00 31.00 31.78 2j57 h PRO 6 CO 0.56 -0.10 -0.86 0.45 -0.21 0.00 0.00 178.00 177.84 2j57 s SER 7 N -5.30 3.20 0.19 -2.05 0.15 -1.26 -5.02 113.70 103.61 2j57 s SER 7 Ca -0.13 -0.56 -0.16 0.00 0.70 0.00 0.00 55.95 55.80 2j57 s SER 7 Cb 0.12 -1.45 0.17 0.00 -1.71 0.00 0.00 66.02 63.15 2j57 s SER 7 CO 0.64 0.12 1.64 -0.33 1.20 0.00 0.00 173.24 176.50 2j57 h GLU 8 N 7.02 -0.03 -6.14 5.44 4.39 -1.96 -3.44 114.58 119.85 2j57 h GLU 8 Ca -0.26 0.00 -0.51 0.00 0.34 0.00 0.00 59.36 58.93 2j57 h GLU 8 Cb 1.21 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.82 2j57 h GLU 8 CO 0.52 -0.02 -0.46 -1.54 -1.16 0.00 0.00 179.01 176.34 2j57 s SER 9 N -5.20 5.00 0.54 1.42 1.04 -1.26 -4.56 113.70 110.67 2j57 s SER 9 Ca -0.14 -0.67 -0.21 0.00 0.48 0.00 0.00 55.95 55.41 2j57 s SER 9 Cb 0.17 -0.79 -0.05 0.00 0.10 0.00 0.00 66.02 65.45 2j57 s SER 9 CO 0.72 -0.41 1.29 -2.84 0.98 0.00 0.00 173.24 172.98 2j57 s PRO 10 N -3.97 3.23 0.13 4.02 0.02 -1.26 -4.91 135.00 132.26 2j57 s PRO 10 Ca 0.41 2.07 0.05 0.00 0.02 0.00 0.00 61.00 63.56 2j57 s PRO 10 Cb -0.04 -2.23 -0.04 0.00 0.02 0.00 0.00 34.50 32.21 2j57 s PRO 10 CO 0.25 -1.06 -0.13 -0.59 -0.33 0.00 0.00 177.00 175.14 2j57 s PHE 11 N -1.40 1.36 0.27 6.54 -0.71 -0.76 -4.91 117.98 118.36 2j57 s PHE 11 Ca 0.71 -0.60 -0.31 0.00 -1.04 0.00 0.00 56.93 55.69 2j57 s PHE 11 Cb -0.36 -0.70 -0.12 0.00 -1.21 0.00 0.00 43.02 40.63 2j57 s PHE 11 CO 0.42 0.13 1.64 0.00 -1.34 0.00 0.00 175.22 176.08 2j57 s ALA 12 N -2.45 3.82 -1.05 1.99 0.00 -1.26 -0.99 121.76 121.81 2j57 s ALA 12 Ca 0.11 1.59 0.14 0.00 0.00 0.00 0.00 51.96 53.80 2j57 s ALA 12 Cb -0.03 -3.67 0.63 0.00 0.00 0.00 0.00 23.12 20.05 2j57 s ALA 12 CO 0.02 -0.98 1.45 0.00 0.00 0.00 0.00 175.76 176.26 2j57 n ALA 13 N 2.75 1.68 0.55 0.00 0.00 0.18 -2.01 120.51 123.66 2j57 n ALA 13 Ca 0.11 -0.05 0.07 0.00 0.00 0.00 0.00 53.44 53.57 2j57 n ALA 13 Cb 0.37 -1.23 0.34 0.00 0.00 0.00 0.00 19.45 18.92 2j57 n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2j57 n ALA 14 N -1.48 1.72 0.95 0.00 0.00 -1.26 -2.57 120.51 117.88 2j57 n ALA 14 Ca 0.04 -0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.54 2j57 n ALA 14 Cb 0.16 -1.25 0.14 0.00 0.00 0.00 0.00 19.45 18.50 2j57 n ALA 14 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2j57 n GLU 15 N -1.47 0.03 -2.56 0.00 1.02 -0.85 -4.85 120.64 111.95 2j57 n GLU 15 Ca 0.04 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.78 2j57 n GLU 15 Cb 0.17 -1.51 -0.05 0.00 -0.02 0.00 0.00 31.44 30.03 2j57 n GLU 15 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2j57 s VAL 16 N -3.02 3.68 0.45 2.62 1.01 -1.06 -5.02 120.40 119.06 2j57 s VAL 16 Ca 0.10 1.66 -0.21 0.00 0.00 0.00 0.00 61.98 63.52 2j57 s VAL 16 Cb 0.17 -4.04 -0.09 0.00 0.00 0.00 0.00 36.38 32.42 2j57 s VAL 16 CO 0.75 0.37 1.02 0.00 0.00 0.00 0.00 175.10 177.24 2j57 s ALA 17 N -1.21 2.96 0.47 5.51 0.00 -1.26 -5.00 121.76 123.23 2j57 s ALA 17 Ca 0.44 0.60 -0.24 0.00 0.00 0.00 0.00 51.96 52.76 2j57 s ALA 17 Cb -0.29 -3.24 -0.08 0.00 0.00 0.00 0.00 23.12 19.51 2j57 s ALA 17 CO 0.37 -0.20 1.42 -0.25 0.00 0.00 0.00 175.76 177.10 2j57 n ASP 18 N -0.64 3.17 0.00 0.00 10.43 -1.26 -2.48 116.55 125.77 2j57 n ASP 18 Ca 0.08 1.09 0.00 0.00 2.57 0.00 0.00 54.79 58.52 2j57 n ASP 18 Cb 0.52 -1.60 0.00 0.00 1.84 0.00 0.00 41.12 41.88 2j57 n ASP 18 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2j57 n GLY 19 N 0.62 2.65 3.66 0.44 0.00 -1.26 -4.99 105.19 106.31 2j57 n GLY 19 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 2j57 n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j57 n ALA 20 N 0.12 0.71 -1.60 4.61 0.00 -1.03 -4.91 120.51 118.40 2j57 n ALA 20 Ca 0.00 0.16 -0.44 0.00 0.00 0.00 0.00 53.44 53.16 2j57 n ALA 20 Cb 0.00 -2.18 -0.04 0.00 0.00 0.00 0.00 19.45 17.23 2j57 n ALA 20 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2j57 n ILE 21 N -0.84 0.43 -4.11 0.00 5.41 -1.26 -4.98 119.36 114.00 2j57 n ILE 21 Ca 0.10 -0.34 -0.25 0.00 1.00 0.00 0.00 62.75 63.26 2j57 n ILE 21 Cb 0.42 -2.32 -0.17 0.00 -0.71 0.00 0.00 39.64 36.86 2j57 n ILE 21 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2j57 s VAL 22 N 7.00 0.98 -0.36 1.39 1.01 -1.26 -1.27 120.40 127.89 2j57 s VAL 22 Ca 0.99 -0.31 -0.15 0.00 0.00 0.00 0.00 61.98 62.52 2j57 s VAL 22 Cb -0.46 -0.97 -0.00 0.00 0.00 0.00 0.00 36.38 34.94 2j57 s VAL 22 CO 0.40 0.35 0.32 -0.69 0.00 0.00 0.00 175.10 175.48 2j57 s VAL 23 N 1.36 5.21 0.36 2.92 1.01 -0.86 -4.93 120.40 125.47 2j57 s VAL 23 Ca -0.02 -0.20 -0.11 0.00 0.00 0.00 0.00 61.98 61.65 2j57 s VAL 23 Cb -0.14 -3.83 -0.07 0.00 0.00 0.00 0.00 36.38 32.34 2j57 s VAL 23 CO -0.04 -0.14 0.72 -1.81 0.00 0.00 0.00 175.10 173.83 2j57 s ASP 24 N 1.73 6.59 -0.14 3.32 1.01 -1.26 -1.59 116.67 126.34 2j57 s ASP 24 Ca 0.09 1.11 0.02 0.00 0.71 0.00 0.00 52.55 54.48 2j57 s ASP 24 Cb -0.17 -2.31 0.01 0.00 1.01 0.00 0.00 42.92 41.46 2j57 s ASP 24 CO 0.11 -0.30 -0.19 -0.63 0.21 0.00 0.00 175.17 174.37 2j57 s ILE 25 N -2.19 1.87 -0.04 0.77 1.01 0.65 -0.32 121.20 122.96 2j57 s ILE 25 Ca 0.51 -0.85 -0.29 0.00 0.00 0.00 0.00 60.65 60.01 2j57 s ILE 25 Cb -0.10 -1.68 0.09 0.00 0.01 0.00 0.00 42.46 40.78 2j57 s ILE 25 CO 0.26 0.51 0.79 0.00 0.00 0.00 0.00 174.94 176.51 2j57 s ALA 26 N 1.00 -1.80 -1.63 9.38 0.00 -0.91 -0.05 121.76 127.75 2j57 s ALA 26 Ca -0.04 1.21 -0.02 0.00 0.00 0.00 0.00 51.96 53.11 2j57 s ALA 26 Cb -0.15 0.02 0.00 0.00 0.00 0.00 0.00 23.12 22.99 2j57 s ALA 26 CO -0.04 -0.47 0.19 1.63 0.00 0.00 0.00 175.76 177.06 2j57 n LYS 27 N 0.45 -2.71 -2.44 0.00 4.76 -1.26 -1.31 118.16 115.64 2j57 n LYS 27 Ca -0.14 0.92 -0.15 0.00 -2.87 0.00 0.00 58.31 56.07 2j57 n LYS 27 Cb 0.59 -5.64 0.00 0.00 -1.84 0.00 0.00 35.03 28.15 2j57 n LYS 27 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 2j57 n MET 28 N -3.31 -1.88 -3.92 1.97 2.81 -1.26 -5.01 117.12 106.52 2j57 n MET 28 Ca -0.19 0.69 -0.11 0.00 -1.81 0.00 0.00 57.70 56.28 2j57 n MET 28 Cb 0.66 -5.01 -0.13 0.00 -0.71 0.00 0.00 33.22 28.03 2j57 n MET 28 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2j57 s LYS 29 N -4.93 0.13 -0.07 0.03 1.02 -0.43 -4.72 119.74 110.78 2j57 s LYS 29 Ca 0.07 -0.22 -0.30 0.00 0.02 0.00 0.00 55.97 55.53 2j57 s LYS 29 Cb -0.03 0.01 -0.03 0.00 -0.52 0.00 0.00 37.83 37.27 2j57 s LYS 29 CO 0.08 -0.01 1.14 0.71 -0.92 0.00 0.00 175.35 176.35 2j57 s TYR 30 N -0.51 3.30 -0.17 3.18 2.02 -1.26 -2.14 117.35 121.77 2j57 s TYR 30 Ca -0.05 1.34 0.29 0.00 -0.37 0.00 0.00 57.07 58.28 2j57 s TYR 30 Cb -0.04 -3.35 0.92 0.00 -0.40 0.00 0.00 41.96 39.10 2j57 s TYR 30 CO -0.00 -0.96 1.82 0.93 -1.57 0.00 0.00 175.55 175.77 2j57 h GLU 31 N 7.32 0.00 -3.01 -0.62 5.08 -0.99 -3.31 114.58 119.06 2j57 h GLU 31 Ca -0.33 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.41 2j57 h GLU 31 Cb 1.16 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 30.01 2j57 h GLU 31 CO 0.87 0.00 -0.72 0.99 -1.00 0.00 0.00 179.01 179.15 2j57 s THR 32 N -3.45 1.67 -0.11 1.13 2.01 -1.26 -4.96 115.64 110.67 2j57 s THR 32 Ca 0.04 -2.89 0.30 0.00 0.31 0.00 0.00 61.69 59.45 2j57 s THR 32 Cb 0.07 -2.16 0.36 0.00 0.01 0.00 0.00 72.50 70.79 2j57 s THR 32 CO 0.59 -0.92 1.87 1.55 -0.69 0.00 0.00 174.62 177.02 2j57 h PRO 33 N 6.44 0.00 -4.19 4.92 0.13 -1.87 -3.37 132.00 134.06 2j57 h PRO 33 Ca 0.02 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.54 2j57 h PRO 33 Cb 0.90 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.64 2j57 h PRO 33 CO 0.53 0.00 -0.77 -2.00 -0.23 0.00 0.00 178.00 175.54 2j57 s GLU 34 N -3.51 1.34 -0.17 0.86 2.12 -1.26 -0.65 118.70 117.43 2j57 s GLU 34 Ca 0.03 -1.13 -0.02 0.00 0.36 0.00 0.00 54.97 54.21 2j57 s GLU 34 Cb 0.08 -2.54 -0.01 0.00 0.26 0.00 0.00 34.13 31.92 2j57 s GLU 34 CO 0.56 -0.74 -0.09 -1.17 -0.54 0.00 0.00 175.26 173.27 2j57 s LEU 35 N 1.38 2.83 -0.23 2.70 2.96 -0.49 -5.00 118.68 122.83 2j57 s LEU 35 Ca 0.01 -0.34 -0.15 0.00 -0.22 0.00 0.00 54.13 53.43 2j57 s LEU 35 Cb -0.18 -1.68 -0.04 0.00 0.50 0.00 0.00 46.19 44.79 2j57 s LEU 35 CO -0.11 0.09 0.36 -1.00 -1.32 0.00 0.00 176.35 174.37 2j57 s HIS 36 N 0.82 3.32 0.42 5.38 3.76 -1.26 0.12 115.29 127.84 2j57 s HIS 36 Ca -0.03 0.49 0.04 0.00 -0.15 0.00 0.00 55.06 55.41 2j57 s HIS 36 Cb -0.15 -2.51 -0.05 0.00 1.11 0.00 0.00 32.58 30.98 2j57 s HIS 36 CO 0.01 -0.08 0.04 0.14 -0.85 0.00 0.00 174.74 173.99 2j57 s VAL 37 N 1.56 1.37 0.15 -0.90 -7.23 0.25 -4.95 120.40 110.66 2j57 s VAL 37 Ca 0.16 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.37 2j57 s VAL 37 Cb -0.15 -2.63 -0.04 0.00 0.56 0.00 0.00 36.38 34.12 2j57 s VAL 37 CO 0.08 0.00 0.15 -0.54 -0.31 0.00 0.00 175.10 174.48 2j57 s LYS 38 N -3.80 2.98 0.39 4.82 1.02 -1.26 -0.31 119.74 123.58 2j57 s LYS 38 Ca 0.26 -0.80 -0.24 0.00 0.02 0.00 0.00 55.97 55.21 2j57 s LYS 38 Cb 0.06 -2.71 -0.12 0.00 -0.52 0.00 0.00 37.83 34.55 2j57 s LYS 38 CO 0.13 0.50 0.84 0.28 -0.92 0.00 0.00 175.35 176.18 2j57 n VAL 39 N -0.24 2.16 0.00 3.17 0.31 -1.26 -1.71 118.33 120.76 2j57 n VAL 39 Ca -0.08 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.75 2j57 n VAL 39 Cb 0.54 -0.88 0.00 0.00 -0.91 0.00 0.00 33.84 32.59 2j57 n VAL 39 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2j57 n GLY 40 N 1.42 2.70 3.73 2.92 0.00 -0.37 -5.04 105.19 110.55 2j57 n GLY 40 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2j57 n GLY 40 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2j57 s ASP 41 N -2.74 7.18 -0.42 1.61 1.01 -0.70 -4.75 116.67 117.86 2j57 s ASP 41 Ca 0.00 2.06 -0.20 0.00 0.71 0.00 0.00 52.55 55.12 2j57 s ASP 41 Cb 0.00 -2.59 0.02 0.00 1.01 0.00 0.00 42.92 41.36 2j57 s ASP 41 CO 0.00 -0.33 0.60 -0.89 0.21 0.00 0.00 175.17 174.76 2j57 s THR 42 N 0.28 4.89 -0.02 -1.27 2.01 -1.26 -1.80 115.64 118.47 2j57 s THR 42 Ca 0.53 0.08 -0.24 0.00 0.31 0.00 0.00 61.69 62.37 2j57 s THR 42 Cb -0.29 -4.16 -0.04 0.00 0.01 0.00 0.00 72.50 68.02 2j57 s THR 42 CO 0.33 -0.53 0.73 -0.69 -0.69 0.00 0.00 174.62 173.77 2j57 s VAL 43 N 2.68 4.91 -0.16 3.82 1.01 -0.12 -4.33 120.40 128.21 2j57 s VAL 43 Ca 0.21 1.52 0.01 0.00 0.00 0.00 0.00 61.98 63.71 2j57 s VAL 43 Cb -0.15 -4.07 0.01 0.00 0.00 0.00 0.00 36.38 32.17 2j57 s VAL 43 CO 0.17 0.31 -0.18 -0.89 0.00 0.00 0.00 175.10 174.51 2j57 s THR 44 N 0.39 2.38 0.17 3.92 2.01 -0.40 -0.12 115.64 123.99 2j57 s THR 44 Ca 0.38 -0.86 -0.23 0.00 0.31 0.00 0.00 61.69 61.30 2j57 s THR 44 Cb -0.19 -1.99 -0.08 0.00 0.01 0.00 0.00 72.50 70.25 2j57 s THR 44 CO 0.20 0.53 0.73 0.26 -0.69 0.00 0.00 174.62 175.64 2j57 s TRP 45 N 0.97 3.81 -0.04 4.92 0.51 -0.13 -2.03 118.94 126.96 2j57 s TRP 45 Ca -0.03 1.50 -0.00 0.00 -2.12 0.00 0.00 56.10 55.45 2j57 s TRP 45 Cb -0.15 -2.68 0.03 0.00 -0.81 0.00 0.00 33.47 29.86 2j57 s TRP 45 CO -0.04 0.47 0.02 0.42 -0.51 0.00 0.00 176.95 177.31 2j57 s ILE 46 N -1.26 0.11 -0.27 2.03 1.01 -0.62 -1.18 121.20 121.02 2j57 s ILE 46 Ca 0.37 0.19 -0.25 0.00 0.00 0.00 0.00 60.65 60.96 2j57 s ILE 46 Cb -0.20 -0.26 -0.00 0.00 0.01 0.00 0.00 42.46 42.00 2j57 s ILE 46 CO 0.23 0.16 0.85 0.21 0.00 0.00 0.00 174.94 176.40 2j57 s ASN 47 N 1.45 6.80 0.00 3.58 2.47 -0.01 -0.25 114.94 128.97 2j57 s ASN 47 Ca -0.04 0.93 0.21 0.00 0.42 0.00 0.00 52.86 54.38 2j57 s ASN 47 Cb -0.13 -2.44 0.58 0.00 -1.45 0.00 0.00 41.25 37.81 2j57 s ASN 47 CO -0.03 -0.59 1.49 0.54 -3.72 0.00 0.00 177.10 174.79 2j57 n ARG 48 N 6.17 2.55 -4.23 0.43 5.12 0.93 0.13 116.66 127.76 2j57 n ARG 48 Ca 0.06 -2.40 -0.13 0.00 -1.93 0.00 0.00 57.85 53.44 2j57 n ARG 48 Cb 0.48 -1.52 -0.10 0.00 -1.16 0.00 0.00 32.46 30.15 2j57 n ARG 48 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 2j57 s GLU 49 N -1.15 1.14 0.26 5.56 -1.05 -1.25 -4.90 118.70 117.31 2j57 s GLU 49 Ca 0.44 -1.57 0.03 0.00 -0.15 0.00 0.00 54.97 53.72 2j57 s GLU 49 Cb 0.23 -0.10 0.33 0.00 -0.44 0.00 0.00 34.13 34.14 2j57 s GLU 49 CO 0.31 -0.22 1.63 0.00 0.95 0.00 0.00 175.26 177.93 2j57 h ALA 50 N 2.66 0.96 -2.04 -0.84 0.00 -1.95 -3.15 119.26 114.90 2j57 h ALA 50 Ca -0.37 -0.45 -0.58 0.00 0.00 0.00 0.00 54.91 53.52 2j57 h ALA 50 Cb 1.22 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.92 2j57 h ALA 50 CO 0.61 0.63 1.40 -0.12 0.00 0.00 0.00 179.25 181.77 2j57 n MET 51 N -4.00 2.19 -1.73 0.00 0.00 -1.26 -4.51 117.12 107.81 2j57 n MET 51 Ca -0.02 0.68 -0.41 0.00 0.00 0.00 0.00 57.70 57.96 2j57 n MET 51 Cb 0.52 -3.10 0.01 0.00 0.00 0.00 0.00 33.22 30.65 2j57 n MET 51 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 2j57 n PRO 52 N 8.27 2.11 -4.12 2.12 -0.02 -1.26 -4.85 135.00 137.24 2j57 n PRO 52 Ca 0.27 0.75 -0.08 0.00 -2.02 0.00 0.00 63.50 62.42 2j57 n PRO 52 Cb 0.42 -2.50 -0.10 0.00 -0.02 0.00 0.00 33.50 31.29 2j57 n PRO 52 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2j57 s HIS 53 N -1.19 0.66 0.24 6.00 3.76 -0.76 -4.92 115.29 119.08 2j57 s HIS 53 Ca 0.61 -1.07 0.04 0.00 -0.15 0.00 0.00 55.06 54.48 2j57 s HIS 53 Cb -0.48 -0.44 -0.01 0.00 1.11 0.00 0.00 32.58 32.76 2j57 s HIS 53 CO 0.58 -0.36 0.24 0.27 -0.85 0.00 0.00 174.74 174.62 2j57 n ASN 54 N 0.04 -0.62 -4.47 1.40 6.94 -1.26 0.08 115.26 117.36 2j57 n ASN 54 Ca -0.12 -2.48 -0.30 0.00 -0.02 0.00 0.00 54.58 51.66 2j57 n ASN 54 Cb 0.62 1.34 -0.12 0.00 -2.36 0.00 0.00 39.78 39.26 2j57 n ASN 54 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 2j57 s VAL 55 N -2.88 2.80 -0.23 3.53 -7.23 -1.26 -4.41 120.40 110.71 2j57 s VAL 55 Ca 0.26 -1.34 -0.03 0.00 -1.81 0.00 0.00 61.98 59.06 2j57 s VAL 55 Cb 0.01 -2.23 0.12 0.00 0.56 0.00 0.00 36.38 34.83 2j57 s VAL 55 CO 0.18 0.23 0.29 -2.28 -0.31 0.00 0.00 175.10 173.21 2j57 s HIS 56 N -1.03 -0.50 -0.17 2.82 5.04 -0.53 -0.60 115.29 120.33 2j57 s HIS 56 Ca 0.16 0.35 -0.09 0.00 -1.54 0.00 0.00 55.06 53.94 2j57 s HIS 56 Cb -0.11 -0.25 -0.05 0.00 0.04 0.00 0.00 32.58 32.22 2j57 s HIS 56 CO 0.07 -0.71 0.13 -0.06 -2.34 0.00 0.00 174.74 171.84 2j57 s PHE 57 N 2.41 3.47 0.74 3.88 0.40 0.31 -2.28 117.98 126.90 2j57 s PHE 57 Ca 0.09 0.39 -0.11 0.00 -0.60 0.00 0.00 56.93 56.70 2j57 s PHE 57 Cb -0.15 -2.06 0.03 0.00 0.51 0.00 0.00 43.02 41.35 2j57 s PHE 57 CO -0.17 0.46 1.07 0.14 0.70 0.00 0.00 175.22 177.42 2j57 s VAL 58 N -0.19 3.68 0.04 -0.44 -7.23 -1.26 -1.68 120.40 113.33 2j57 s VAL 58 Ca 0.10 0.55 -0.36 0.00 -1.81 0.00 0.00 61.98 60.46 2j57 s VAL 58 Cb -0.11 -3.21 -0.19 0.00 0.56 0.00 0.00 36.38 33.42 2j57 s VAL 58 CO 0.00 -0.71 0.92 0.00 -0.31 0.00 0.00 175.10 175.00 2j57 n ALA 59 N -3.30 -3.40 -0.22 1.32 0.00 -1.26 -2.33 120.51 111.33 2j57 n ALA 59 Ca 0.08 0.55 0.00 0.00 0.00 0.00 0.00 53.44 54.06 2j57 n ALA 59 Cb 0.54 -1.67 0.00 0.00 0.00 0.00 0.00 19.45 18.32 2j57 n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j57 n GLY 60 N 1.56 0.97 0.07 0.00 0.00 -0.16 -4.88 105.19 102.75 2j57 n GLY 60 Ca 0.19 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.14 2j57 n GLY 60 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2j57 h VAL 61 N 0.00 0.22 0.00 1.61 2.07 -1.75 -3.42 116.25 114.98 2j57 h VAL 61 Ca 0.00 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.28 2j57 h VAL 61 Cb 0.00 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 2j57 h VAL 61 CO 0.00 0.07 -0.79 0.18 0.02 0.00 0.00 177.57 177.06 2j57 n LEU 62 N -4.61 0.55 0.00 2.57 4.77 -1.26 -4.93 117.00 114.09 2j57 n LEU 62 Ca -0.10 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.45 2j57 n LEU 62 Cb 0.30 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 2j57 n LEU 62 CO 0.11 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 2j57 n GLY 63 N 1.38 1.50 0.10 -0.72 0.00 -1.26 -0.43 105.19 105.76 2j57 n GLY 63 Ca 0.02 -0.64 -0.15 0.00 0.00 0.00 0.00 46.02 45.25 2j57 n GLY 63 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2j57 h GLU 64 N 0.00 0.19 -7.02 1.61 5.08 -1.95 -0.38 114.58 112.11 2j57 h GLU 64 Ca 0.00 -0.32 -0.49 0.00 -1.00 0.00 0.00 59.36 57.55 2j57 h GLU 64 Cb 0.00 0.12 0.05 0.00 0.50 0.00 0.00 28.75 29.42 2j57 h GLU 64 CO 0.00 1.03 0.44 0.00 -1.00 0.00 0.00 179.01 179.48 2j57 s ALA 65 N -2.63 2.94 0.40 3.43 0.00 -1.26 -2.92 121.76 121.73 2j57 s ALA 65 Ca -0.07 0.80 -0.26 0.00 0.00 0.00 0.00 51.96 52.43 2j57 s ALA 65 Cb 0.07 -3.33 -0.09 0.00 0.00 0.00 0.00 23.12 19.78 2j57 s ALA 65 CO 0.85 -0.50 1.29 0.00 0.00 0.00 0.00 175.76 177.40 2j57 s ALA 66 N -1.68 3.26 -0.43 0.00 0.00 -1.26 -4.12 121.76 117.52 2j57 s ALA 66 Ca 0.64 1.20 -0.20 0.00 0.00 0.00 0.00 51.96 53.61 2j57 s ALA 66 Cb -0.24 -3.47 0.02 0.00 0.00 0.00 0.00 23.12 19.43 2j57 s ALA 66 CO 0.29 -0.78 0.59 -1.17 0.00 0.00 0.00 175.76 174.68 2j57 s LEU 67 N -2.41 4.60 -0.62 0.00 0.20 -0.67 -4.88 118.68 114.89 2j57 s LEU 67 Ca 0.57 -0.42 -0.07 0.00 0.69 0.00 0.00 54.13 54.89 2j57 s LEU 67 Cb -0.37 -2.63 0.16 0.00 -0.43 0.00 0.00 46.19 42.91 2j57 s LEU 67 CO 0.48 -0.72 0.49 -0.54 -0.29 0.00 0.00 176.35 175.76 2j57 s LYS 68 N 2.63 2.78 0.90 1.98 1.02 -1.26 -0.53 119.74 127.25 2j57 s LYS 68 Ca 0.20 -2.27 -0.12 0.00 0.02 0.00 0.00 55.97 53.80 2j57 s LYS 68 Cb -0.15 -3.96 0.07 0.00 -0.52 0.00 0.00 37.83 33.28 2j57 s LYS 68 CO 0.17 -1.21 0.80 0.41 -0.92 0.00 0.00 175.35 174.61 2j57 n GLY 69 N 4.06 -1.09 3.76 -3.33 0.00 0.24 -4.99 105.19 103.83 2j57 n GLY 69 Ca 0.04 -0.66 -0.33 0.00 0.00 0.00 0.00 46.02 45.08 2j57 n GLY 69 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2j57 s PRO 70 N -3.97 2.47 -0.04 1.61 0.04 -1.26 -4.74 135.00 129.11 2j57 s PRO 70 Ca 0.64 1.42 -0.30 0.00 0.04 0.00 0.00 61.00 62.80 2j57 s PRO 70 Cb -0.24 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 2j57 s PRO 70 CO 0.61 -1.51 1.12 -1.64 0.04 0.00 0.00 177.00 175.61 2j57 s MET 71 N -4.26 4.42 -0.23 4.56 -1.94 -1.26 -4.56 119.30 116.03 2j57 s MET 71 Ca 0.67 1.58 -0.19 0.00 -1.71 0.00 0.00 55.69 56.04 2j57 s MET 71 Cb -0.21 -3.50 -0.03 0.00 2.01 0.00 0.00 34.83 33.10 2j57 s MET 71 CO 0.46 -0.32 0.56 -1.64 -0.01 0.00 0.00 175.02 174.08 2j57 s MET 72 N 1.77 4.14 1.04 2.03 -1.94 0.11 -4.80 119.30 121.66 2j57 s MET 72 Ca 0.54 0.46 -0.18 0.00 -1.71 0.00 0.00 55.69 54.80 2j57 s MET 72 Cb -0.23 -3.61 0.25 0.00 2.01 0.00 0.00 34.83 33.25 2j57 s MET 72 CO 0.23 -0.29 1.11 1.63 -0.01 0.00 0.00 175.02 177.69 2j57 n LYS 73 N 5.28 -2.24 -1.68 2.03 5.02 -1.26 -1.83 118.16 123.48 2j57 n LYS 73 Ca -0.03 -1.74 -0.44 0.00 -2.02 0.00 0.00 58.31 54.07 2j57 n LYS 73 Cb 0.50 -1.42 -0.04 0.00 -0.02 0.00 0.00 35.03 34.05 2j57 n LYS 73 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2j57 n LYS 74 N -4.19 2.57 -1.43 1.97 4.81 -1.19 -2.16 118.16 118.54 2j57 n LYS 74 Ca 0.15 0.94 -0.06 0.00 -0.87 0.00 0.00 58.31 58.47 2j57 n LYS 74 Cb 0.54 -2.83 -0.02 0.00 0.02 0.00 0.00 35.03 32.74 2j57 n LYS 74 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2j57 n GLU 75 N 6.37 -0.40 -3.83 1.64 -0.58 0.35 -5.00 120.64 119.19 2j57 n GLU 75 Ca 0.20 0.57 -0.21 0.00 -0.42 0.00 0.00 57.16 57.31 2j57 n GLU 75 Cb 0.35 -4.33 -0.02 0.00 -0.57 0.00 0.00 31.44 26.87 2j57 n GLU 75 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2j57 s GLN 76 N -2.99 3.06 0.05 3.49 -0.21 -0.92 -0.64 119.66 121.51 2j57 s GLN 76 Ca 0.00 -1.02 -0.01 0.00 0.02 0.00 0.00 55.36 54.35 2j57 s GLN 76 Cb 0.00 -2.70 -0.04 0.00 1.00 0.00 0.00 33.01 31.27 2j57 s GLN 76 CO 0.00 0.24 -0.04 0.00 -2.12 0.00 0.00 175.29 173.38 2j57 s ALA 77 N -2.15 0.53 -0.27 6.09 0.00 -0.17 -0.83 121.76 124.98 2j57 s ALA 77 Ca 0.38 -1.16 -0.16 0.00 0.00 0.00 0.00 51.96 51.02 2j57 s ALA 77 Cb -0.08 0.24 0.08 0.00 0.00 0.00 0.00 23.12 23.35 2j57 s ALA 77 CO 0.28 -0.33 0.66 -0.47 0.00 0.00 0.00 175.76 175.91 2j57 s TYR 78 N -3.59 -0.98 0.06 0.00 5.04 -0.32 -1.83 117.35 115.73 2j57 s TYR 78 Ca 0.05 2.01 0.07 0.00 -2.44 0.00 0.00 57.07 56.76 2j57 s TYR 78 Cb 0.06 0.55 -0.04 0.00 0.35 0.00 0.00 41.96 42.88 2j57 s TYR 78 CO -0.08 -0.49 -0.15 -1.12 -1.34 0.00 0.00 175.55 172.37 2j57 s SER 79 N 1.43 4.01 -0.07 4.32 0.01 -1.26 -0.95 113.70 121.20 2j57 s SER 79 Ca -0.09 -0.42 0.03 0.00 1.31 0.00 0.00 55.95 56.79 2j57 s SER 79 Cb -0.05 -0.69 0.01 0.00 0.21 0.00 0.00 66.02 65.50 2j57 s SER 79 CO -0.16 0.23 -0.15 -0.76 0.41 0.00 0.00 173.24 172.80 2j57 s LEU 80 N -1.71 1.79 -0.30 2.44 1.43 0.82 -3.90 118.68 119.25 2j57 s LEU 80 Ca 0.17 -0.36 -0.23 0.00 -1.03 0.00 0.00 54.13 52.68 2j57 s LEU 80 Cb -0.11 -0.97 -0.00 0.00 0.03 0.00 0.00 46.19 45.14 2j57 s LEU 80 CO 0.08 0.08 0.75 -0.89 0.23 0.00 0.00 176.35 176.60 2j57 s THR 81 N 0.47 4.84 -0.33 5.49 2.01 -0.35 -0.94 115.64 126.83 2j57 s THR 81 Ca -0.13 1.14 -0.21 0.00 0.31 0.00 0.00 61.69 62.80 2j57 s THR 81 Cb -0.15 -4.10 -0.00 0.00 0.01 0.00 0.00 72.50 68.26 2j57 s THR 81 CO 0.04 -0.19 0.66 -0.36 -0.69 0.00 0.00 174.62 174.08 2j57 s PHE 82 N 2.84 3.18 -1.61 4.92 0.40 -0.74 -1.04 117.98 125.92 2j57 s PHE 82 Ca 0.31 0.51 0.22 0.00 -0.60 0.00 0.00 56.93 57.36 2j57 s PHE 82 Cb -0.14 -3.11 -0.09 0.00 0.51 0.00 0.00 43.02 40.18 2j57 s PHE 82 CO 0.12 -0.57 1.00 0.25 0.70 0.00 0.00 175.22 176.72 2j57 n THR 83 N 5.53 0.00 -3.86 0.64 -2.24 -0.71 -1.24 114.28 112.39 2j57 n THR 83 Ca -0.00 -0.17 -0.11 0.00 -2.27 0.00 0.00 64.05 61.50 2j57 n THR 83 Cb 0.49 1.16 -0.10 0.00 -2.10 0.00 0.00 70.33 69.77 2j57 n THR 83 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2j57 s GLU 84 N -2.64 0.47 0.73 -0.78 2.12 -1.24 -4.65 118.70 112.70 2j57 s GLU 84 Ca 0.14 -0.36 -0.14 0.00 0.36 0.00 0.00 54.97 54.98 2j57 s GLU 84 Cb 0.17 0.20 0.04 0.00 0.26 0.00 0.00 34.13 34.80 2j57 s GLU 84 CO 0.68 -0.11 1.15 0.00 -0.54 0.00 0.00 175.26 176.43 2j57 s ALA 85 N -1.30 2.20 0.00 6.30 0.00 -1.26 -4.84 121.76 122.86 2j57 s ALA 85 Ca -0.14 0.63 0.00 0.00 0.00 0.00 0.00 51.96 52.45 2j57 s ALA 85 Cb -0.07 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.67 2j57 s ALA 85 CO 0.02 -1.73 0.00 0.41 0.00 0.00 0.00 175.76 174.46 2j57 n GLY 86 N -0.21 2.94 3.67 0.00 0.00 0.38 -4.95 105.19 107.01 2j57 n GLY 86 Ca 0.11 -1.97 -0.36 0.00 0.00 0.00 0.00 46.02 43.80 2j57 n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2j57 s THR 87 N -2.13 5.36 -0.41 2.61 2.01 -1.26 -1.58 115.64 120.24 2j57 s THR 87 Ca 0.00 0.20 0.03 0.00 0.31 0.00 0.00 61.69 62.24 2j57 s THR 87 Cb 0.00 -3.51 0.11 0.00 0.01 0.00 0.00 72.50 69.12 2j57 s THR 87 CO 0.00 0.35 0.14 -0.31 -0.69 0.00 0.00 174.62 174.11 2j57 s TYR 88 N 0.97 3.57 0.46 4.92 2.02 -0.41 -4.97 117.35 123.92 2j57 s TYR 88 Ca 0.08 -2.99 -0.23 0.00 -0.37 0.00 0.00 57.07 53.55 2j57 s TYR 88 Cb -0.13 -2.94 -0.07 0.00 -0.40 0.00 0.00 41.96 38.42 2j57 s TYR 88 CO 0.04 -0.89 1.22 -0.51 -1.57 0.00 0.00 175.55 173.84 2j57 s ASP 89 N 0.64 6.04 0.31 2.29 1.01 -1.26 -2.33 116.67 123.36 2j57 s ASP 89 Ca 0.13 2.45 -0.00 0.00 0.71 0.00 0.00 52.55 55.83 2j57 s ASP 89 Cb -0.21 -2.61 -0.01 0.00 1.01 0.00 0.00 42.92 41.09 2j57 s ASP 89 CO -0.05 -1.02 0.36 -0.72 0.21 0.00 0.00 175.17 173.95 2j57 s TYR 90 N -1.45 1.21 0.29 4.23 1.13 0.75 -4.58 117.35 118.94 2j57 s TYR 90 Ca 0.64 -1.36 -0.20 0.00 -1.41 0.00 0.00 57.07 54.74 2j57 s TYR 90 Cb -0.32 -0.32 0.04 0.00 -1.10 0.00 0.00 41.96 40.26 2j57 s TYR 90 CO 0.39 -0.96 0.79 -3.38 -2.51 0.00 0.00 175.55 169.88 2j57 s HIS 91 N -3.44 -0.06 -0.17 -3.49 -3.43 -0.96 -1.37 115.29 102.37 2j57 s HIS 91 Ca 0.34 -0.45 -0.07 0.00 -0.80 0.00 0.00 55.06 54.08 2j57 s HIS 91 Cb 0.02 0.75 -0.04 0.00 -1.43 0.00 0.00 32.58 31.87 2j57 s HIS 91 CO 0.20 -1.28 0.08 0.00 -2.00 0.00 0.00 174.74 171.73 2j57 h THR 93 N 4.64 0.67 -0.00 0.00 2.02 -1.90 0.18 112.91 118.52 2j57 h THR 93 Ca -0.41 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.77 2j57 h THR 93 Cb 1.18 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 68.25 2j57 h THR 93 CO 0.68 0.00 -0.15 -0.81 0.37 0.00 0.00 175.52 175.61 2j57 n PRO 94 N -5.26 0.27 -3.30 6.66 -0.04 -1.26 -4.33 135.00 127.74 2j57 n PRO 94 Ca -0.04 -0.08 -0.26 0.00 -0.04 0.00 0.00 63.50 63.08 2j57 n PRO 94 Cb 0.18 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.07 2j57 n PRO 94 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2j57 n HIS 95 N -1.29 2.65 0.80 0.54 8.25 0.02 -4.92 115.22 121.27 2j57 n HIS 95 Ca 0.10 -3.99 0.07 0.00 -0.26 0.00 0.00 57.72 53.64 2j57 n HIS 95 Cb 0.31 -0.50 0.39 0.00 1.12 0.00 0.00 29.99 31.31 2j57 n HIS 95 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 2j57 n PRO 96 N 0.81 0.37 0.05 -0.41 -0.02 -1.01 -0.43 135.00 134.35 2j57 n PRO 96 Ca 0.28 0.04 0.13 0.00 -2.02 0.00 0.00 63.50 61.93 2j57 n PRO 96 Cb 0.45 -1.50 0.34 0.00 -0.02 0.00 0.00 33.50 32.77 2j57 n PRO 96 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 2j57 n PHE 97 N -1.07 0.42 -2.79 6.00 1.16 -1.26 -4.58 117.46 115.34 2j57 n PHE 97 Ca 0.09 0.12 -0.43 0.00 -1.87 0.00 0.00 57.45 55.37 2j57 n PHE 97 Cb 0.06 -0.61 -0.04 0.00 -1.61 0.00 0.00 39.48 37.28 2j57 n PHE 97 CO 0.00 0.00 0.00 -1.64 -1.87 0.00 0.00 176.76 173.25 2j57 s MET 98 N -3.08 3.34 -0.05 3.97 -1.94 0.43 -5.03 119.30 116.93 2j57 s MET 98 Ca 0.10 -0.22 0.05 0.00 -1.71 0.00 0.00 55.69 53.91 2j57 s MET 98 Cb 0.15 -4.06 -0.02 0.00 2.01 0.00 0.00 34.83 32.91 2j57 s MET 98 CO 0.64 -1.56 -0.19 1.03 -0.01 0.00 0.00 175.02 174.94 2j57 s ARG 99 N 4.16 2.44 0.41 2.03 0.52 -1.26 -0.75 118.95 126.50 2j57 s ARG 99 Ca 0.32 -0.78 0.04 0.00 -0.52 0.00 0.00 55.73 54.78 2j57 s ARG 99 Cb -0.12 -2.27 -0.02 0.00 0.52 0.00 0.00 34.95 33.06 2j57 s ARG 99 CO 0.19 0.56 0.12 0.20 0.02 0.00 0.00 175.30 176.40 2j57 s GLY 100 N -0.58 2.63 -0.22 -3.53 0.00 -0.47 -4.79 107.32 100.36 2j57 s GLY 100 Ca 0.08 -1.21 -0.10 0.00 0.00 0.00 0.00 44.72 43.49 2j57 s GLY 100 CO 0.01 -1.85 0.51 1.25 0.00 0.00 0.00 173.10 173.02 2j57 s LYS 101 N -3.72 0.48 -0.22 2.90 2.20 0.17 -0.18 119.74 121.38 2j57 s LYS 101 Ca 0.23 1.03 -0.03 0.00 -0.36 0.00 0.00 55.97 56.85 2j57 s LYS 101 Cb 0.02 0.20 0.00 0.00 -1.51 0.00 0.00 37.83 36.55 2j57 s LYS 101 CO 0.14 -0.18 -0.07 0.08 -0.36 0.00 0.00 175.35 174.95 2j57 s VAL 102 N 1.91 3.02 -0.35 4.02 1.01 -0.98 -1.40 120.40 127.63 2j57 s VAL 102 Ca -0.07 -0.69 -0.20 0.00 0.00 0.00 0.00 61.98 61.02 2j57 s VAL 102 Cb -0.09 -2.40 -0.00 0.00 0.00 0.00 0.00 36.38 33.89 2j57 s VAL 102 CO -0.15 0.39 0.59 -0.69 0.00 0.00 0.00 175.10 175.24 2j57 s VAL 103 N 1.41 4.94 -0.41 2.92 1.01 0.32 -1.29 120.40 129.29 2j57 s VAL 103 Ca 0.04 0.54 -0.10 0.00 0.00 0.00 0.00 61.98 62.47 2j57 s VAL 103 Cb -0.15 -4.02 0.07 0.00 0.00 0.00 0.00 36.38 32.28 2j57 s VAL 103 CO -0.05 -0.25 0.25 -0.69 0.00 0.00 0.00 175.10 174.36 2j57 s VAL 104 N 2.59 4.34 -2.57 2.92 1.01 -0.62 0.87 120.40 128.94 2j57 s VAL 104 Ca 0.23 -1.27 0.27 0.00 0.00 0.00 0.00 61.98 61.21 2j57 s VAL 104 Cb -0.15 -3.60 0.50 0.00 0.00 0.00 0.00 36.38 33.12 2j57 s VAL 104 CO 0.14 -0.45 1.67 -0.62 0.00 0.00 0.00 175.10 175.84