#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j55 n LYS 2 N 0.00 2.68 -3.69 -1.24 5.02 -0.01 -4.92 118.16 116.01 2j55 n LYS 2 Ca 0.00 -1.72 0.00 0.00 -2.02 0.00 0.00 58.31 54.57 2j55 n LYS 2 Cb 0.00 -1.10 -0.00 0.00 -0.02 0.00 0.00 35.03 33.90 2j55 n LYS 2 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2j55 s ALA 3 N -1.36 -2.07 0.06 7.82 0.00 -1.26 -3.40 121.76 121.55 2j55 s ALA 3 Ca 0.07 0.46 -0.01 0.00 0.00 0.00 0.00 51.96 52.47 2j55 s ALA 3 Cb 0.06 0.48 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 2j55 s ALA 3 CO 0.01 -1.06 -0.01 0.95 0.00 0.00 0.00 175.76 175.65 2j55 s THR 4 N -2.61 0.21 -0.31 0.00 -4.23 -0.17 -4.93 115.64 103.60 2j55 s THR 4 Ca 0.15 -1.77 -0.03 0.00 -1.18 0.00 0.00 61.69 58.86 2j55 s THR 4 Cb 0.03 -1.53 0.04 0.00 1.34 0.00 0.00 72.50 72.38 2j55 s THR 4 CO -0.02 -0.96 0.02 -0.63 -0.54 0.00 0.00 174.62 172.50 2j55 s ILE 5 N -3.92 3.18 0.00 2.99 1.01 -1.26 -0.72 121.20 122.48 2j55 s ILE 5 Ca 0.08 -1.29 0.00 0.00 0.00 0.00 0.00 60.65 59.44 2j55 s ILE 5 Cb 0.08 -2.80 0.00 0.00 0.01 0.00 0.00 42.46 39.75 2j55 s ILE 5 CO -0.10 -0.10 0.13 -2.65 0.00 0.00 0.00 174.94 172.23 2j55 n PRO 6 N 4.67 0.00 -2.70 2.79 -0.02 -1.26 -4.62 135.00 133.86 2j55 n PRO 6 Ca -0.13 0.10 -0.35 0.00 -2.02 0.00 0.00 63.50 61.10 2j55 n PRO 6 Cb 0.44 -0.63 -0.06 0.00 -0.02 0.00 0.00 33.50 33.23 2j55 n PRO 6 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2j55 s SER 7 N -2.71 6.87 -0.10 2.55 0.01 -1.26 -5.00 113.70 114.05 2j55 s SER 7 Ca 0.00 1.84 -0.19 0.00 1.31 0.00 0.00 55.95 58.90 2j55 s SER 7 Cb 0.00 -2.56 -0.28 0.00 0.21 0.00 0.00 66.02 63.39 2j55 s SER 7 CO 0.00 -0.41 0.65 -0.08 0.41 0.00 0.00 173.24 173.81 2j55 h GLU 8 N 2.21 0.22 -6.65 12.44 4.81 -1.95 -3.47 114.58 122.20 2j55 h GLU 8 Ca -0.48 -0.38 -0.67 0.00 -0.13 0.00 0.00 59.36 57.70 2j55 h GLU 8 Cb 1.20 0.14 -0.25 0.00 0.63 0.00 0.00 28.75 30.47 2j55 h GLU 8 CO 0.62 1.18 -0.87 -1.54 -0.73 0.00 0.00 179.01 177.67 2j55 s SER 9 N -6.93 3.06 1.07 1.04 1.04 -1.26 -4.67 113.70 107.05 2j55 s SER 9 Ca -0.19 -0.64 -0.14 0.00 0.48 0.00 0.00 55.95 55.47 2j55 s SER 9 Cb 0.03 -0.24 0.23 0.00 0.10 0.00 0.00 66.02 66.13 2j55 s SER 9 CO 0.77 0.20 1.09 -2.84 0.98 0.00 0.00 173.24 173.44 2j55 s PRO 10 N -1.53 -0.19 0.04 4.02 0.02 -1.26 -5.09 135.00 131.01 2j55 s PRO 10 Ca 0.11 0.37 -0.04 0.00 0.02 0.00 0.00 61.00 61.47 2j55 s PRO 10 Cb -0.10 -1.68 -0.02 0.00 0.02 0.00 0.00 34.50 32.72 2j55 s PRO 10 CO 0.03 -3.11 0.06 -0.59 -0.33 0.00 0.00 177.00 173.06 2j55 s PHE 11 N -2.93 0.29 0.45 6.54 -0.71 -0.50 -4.98 117.98 116.14 2j55 s PHE 11 Ca 0.67 -0.67 -0.22 0.00 -1.04 0.00 0.00 56.93 55.67 2j55 s PHE 11 Cb -0.17 -0.21 -0.11 0.00 -1.21 0.00 0.00 43.02 41.32 2j55 s PHE 11 CO 0.58 -0.37 0.74 0.00 -1.34 0.00 0.00 175.22 174.83 2j55 n ALA 12 N 0.59 -0.73 -2.71 1.99 0.00 -1.26 -1.49 120.51 116.90 2j55 n ALA 12 Ca -0.18 0.15 -0.44 0.00 0.00 0.00 0.00 53.44 52.98 2j55 n ALA 12 Cb 0.59 -1.92 -0.08 0.00 0.00 0.00 0.00 19.45 18.05 2j55 n ALA 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2j55 s ALA 13 N -1.43 3.48 0.00 0.00 0.00 -1.04 -3.77 121.76 119.00 2j55 s ALA 13 Ca 0.65 -1.83 0.00 0.00 0.00 0.00 0.00 51.96 50.77 2j55 s ALA 13 Cb -0.56 -3.12 0.00 0.00 0.00 0.00 0.00 23.12 19.44 2j55 s ALA 13 CO 0.56 -1.74 0.00 0.00 0.00 0.00 0.00 175.76 174.58 2j55 n ALA 14 N 5.54 0.00 0.00 0.00 0.00 -1.26 -4.95 120.51 119.85 2j55 n ALA 14 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2j55 n ALA 14 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 2j55 n ALA 14 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2j55 n GLU 15 N 0.00 0.00 -0.01 0.00 1.02 -1.25 -4.31 120.64 116.10 2j55 n GLU 15 Ca 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.13 2j55 n GLU 15 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2j55 n GLU 15 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 2j55 h VAL 16 N 0.00 0.00 0.00 2.62 3.04 -1.92 -3.51 116.25 116.48 2j55 h VAL 16 Ca 0.00 -0.61 0.00 0.00 -1.01 0.00 0.00 66.70 65.08 2j55 h VAL 16 Cb 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 31.29 29.28 2j55 h VAL 16 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.56 2j55 n ALA 17 N -2.51 0.00 0.00 3.17 0.00 -1.26 -4.84 120.51 115.07 2j55 n ALA 17 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2j55 n ALA 17 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.48 2j55 n ALA 17 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2j55 n ASP 18 N 0.00 -0.17 0.00 0.00 10.43 -1.26 -4.88 116.55 120.67 2j55 n ASP 18 Ca 0.00 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.36 2j55 n ASP 18 Cb 0.00 0.11 0.00 0.00 1.84 0.00 0.00 41.12 43.07 2j55 n ASP 18 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2j55 n GLY 19 N 2.24 0.00 3.61 0.44 0.00 -1.26 -4.92 105.19 105.30 2j55 n GLY 19 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2j55 n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j55 n ALA 20 N 0.96 0.15 -2.21 4.61 0.00 -1.26 -4.92 120.51 117.84 2j55 n ALA 20 Ca 0.00 0.26 -0.43 0.00 0.00 0.00 0.00 53.44 53.27 2j55 n ALA 20 Cb 0.13 -2.08 -0.02 0.00 0.00 0.00 0.00 19.45 17.48 2j55 n ALA 20 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2j55 s ILE 21 N -1.24 3.85 0.11 0.00 1.01 -1.26 -4.98 121.20 118.69 2j55 s ILE 21 Ca 0.62 0.96 0.09 0.00 0.00 0.00 0.00 60.65 62.32 2j55 s ILE 21 Cb -0.58 -3.84 -0.04 0.00 0.01 0.00 0.00 42.46 38.02 2j55 s ILE 21 CO 0.58 -0.32 -0.21 -0.69 0.00 0.00 0.00 174.94 174.29 2j55 s VAL 22 N 4.82 1.78 -0.24 2.92 1.01 -1.26 -1.47 120.40 127.96 2j55 s VAL 22 Ca 0.66 -1.62 0.02 0.00 0.00 0.00 0.00 61.98 61.04 2j55 s VAL 22 Cb -0.23 -1.64 0.05 0.00 0.00 0.00 0.00 36.38 34.57 2j55 s VAL 22 CO 0.27 -0.08 -0.10 -0.69 0.00 0.00 0.00 175.10 174.50 2j55 s VAL 23 N -1.27 1.93 0.37 2.92 1.01 -0.13 -4.93 120.40 120.30 2j55 s VAL 23 Ca 0.08 -1.40 -0.24 0.00 0.00 0.00 0.00 61.98 60.43 2j55 s VAL 23 Cb -0.09 -2.05 -0.10 0.00 0.00 0.00 0.00 36.38 34.13 2j55 s VAL 23 CO 0.05 0.02 0.94 -1.81 0.00 0.00 0.00 175.10 174.30 2j55 s ASP 24 N 1.23 7.16 -0.25 3.32 1.01 -1.26 -0.73 116.67 127.15 2j55 s ASP 24 Ca -0.06 1.77 -0.02 0.00 0.71 0.00 0.00 52.55 54.94 2j55 s ASP 24 Cb -0.19 -2.56 0.02 0.00 1.01 0.00 0.00 42.92 41.20 2j55 s ASP 24 CO -0.06 -0.19 -0.05 -0.63 0.21 0.00 0.00 175.17 174.45 2j55 s ILE 25 N -1.85 3.01 0.06 0.77 1.01 -0.36 -0.98 121.20 122.86 2j55 s ILE 25 Ca 0.55 -0.93 -0.11 0.00 0.00 0.00 0.00 60.65 60.15 2j55 s ILE 25 Cb -0.14 -2.51 0.01 0.00 0.01 0.00 0.00 42.46 39.83 2j55 s ILE 25 CO 0.19 0.22 0.25 0.00 0.00 0.00 0.00 174.94 175.60 2j55 s ALA 26 N 1.36 -0.50 -1.49 9.38 0.00 -1.06 -1.08 121.76 128.37 2j55 s ALA 26 Ca 0.01 -0.24 -0.09 0.00 0.00 0.00 0.00 51.96 51.64 2j55 s ALA 26 Cb -0.16 0.39 0.07 0.00 0.00 0.00 0.00 23.12 23.41 2j55 s ALA 26 CO -0.04 -0.45 0.79 1.63 0.00 0.00 0.00 175.76 177.70 2j55 n LYS 27 N 0.36 -4.63 -3.05 0.00 5.02 -1.26 -2.53 118.16 112.07 2j55 n LYS 27 Ca -0.17 0.53 -0.19 0.00 -2.02 0.00 0.00 58.31 56.46 2j55 n LYS 27 Cb 0.60 -5.20 0.04 0.00 -0.02 0.00 0.00 35.03 30.46 2j55 n LYS 27 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2j55 n MET 28 N -4.50 -4.90 -3.75 1.97 2.81 -1.26 -4.97 117.12 102.51 2j55 n MET 28 Ca -0.09 0.74 -0.13 0.00 -1.81 0.00 0.00 57.70 56.42 2j55 n MET 28 Cb 0.58 -5.32 -0.10 0.00 -0.71 0.00 0.00 33.22 27.67 2j55 n MET 28 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2j55 s LYS 29 N -5.69 0.47 -0.22 0.03 1.02 -1.05 -4.67 119.74 109.63 2j55 s LYS 29 Ca 0.33 0.35 -0.23 0.00 0.02 0.00 0.00 55.97 56.43 2j55 s LYS 29 Cb -0.14 0.22 -0.01 0.00 -0.52 0.00 0.00 37.83 37.38 2j55 s LYS 29 CO 0.40 -0.08 0.76 0.71 -0.92 0.00 0.00 175.35 176.23 2j55 s TYR 30 N -0.14 3.34 -0.38 3.18 2.02 -1.26 -2.56 117.35 121.54 2j55 s TYR 30 Ca -0.03 1.08 0.24 0.00 -0.37 0.00 0.00 57.07 57.99 2j55 s TYR 30 Cb -0.03 -2.97 0.48 0.00 -0.40 0.00 0.00 41.96 39.05 2j55 s TYR 30 CO 0.01 -0.31 1.66 0.93 -1.57 0.00 0.00 175.55 176.27 2j55 h GLU 31 N 7.60 0.00 -3.97 -0.62 5.08 -1.40 -3.28 114.58 117.99 2j55 h GLU 31 Ca -0.26 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.45 2j55 h GLU 31 Cb 1.11 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.96 2j55 h GLU 31 CO 0.83 0.00 -0.69 0.99 -1.00 0.00 0.00 179.01 179.14 2j55 s THR 32 N -3.26 2.26 -1.60 1.13 2.01 -1.26 -4.98 115.64 109.93 2j55 s THR 32 Ca 0.06 -2.70 0.30 0.00 0.31 0.00 0.00 61.69 59.66 2j55 s THR 32 Cb 0.06 -2.62 0.55 0.00 0.01 0.00 0.00 72.50 70.50 2j55 s THR 32 CO 0.65 -0.71 2.01 -0.81 -0.69 0.00 0.00 174.62 175.07 2j55 n PRO 33 N 3.77 0.62 -3.42 4.92 -0.05 -1.24 -4.23 135.00 135.37 2j55 n PRO 33 Ca 0.04 -0.10 -0.23 0.00 -0.05 0.00 0.00 63.50 63.17 2j55 n PRO 33 Cb 0.37 -1.50 -0.10 0.00 -0.05 0.00 0.00 33.50 32.23 2j55 n PRO 33 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 175.50 173.45 2j55 s GLU 34 N -2.45 0.55 -0.15 0.54 2.12 -1.26 -2.58 118.70 115.47 2j55 s GLU 34 Ca 0.31 -0.99 -0.19 0.00 0.36 0.00 0.00 54.97 54.47 2j55 s GLU 34 Cb 0.20 -0.98 -0.04 0.00 0.26 0.00 0.00 34.13 33.58 2j55 s GLU 34 CO 0.45 -1.18 0.51 -1.17 -0.54 0.00 0.00 175.26 173.33 2j55 s LEU 35 N 1.38 4.22 -0.26 2.70 2.96 -0.89 -4.99 118.68 123.80 2j55 s LEU 35 Ca 0.16 0.77 -0.12 0.00 -0.22 0.00 0.00 54.13 54.73 2j55 s LEU 35 Cb -0.18 -2.73 -0.05 0.00 0.50 0.00 0.00 46.19 43.73 2j55 s LEU 35 CO -0.06 -0.09 0.25 -1.00 -1.32 0.00 0.00 176.35 174.13 2j55 s HIS 36 N 1.11 3.26 0.39 5.38 3.76 -1.26 -0.17 115.29 127.76 2j55 s HIS 36 Ca 0.26 0.26 0.04 0.00 -0.15 0.00 0.00 55.06 55.47 2j55 s HIS 36 Cb -0.15 -2.41 -0.03 0.00 1.11 0.00 0.00 32.58 31.10 2j55 s HIS 36 CO 0.10 -0.11 0.15 0.14 -0.85 0.00 0.00 174.74 174.18 2j55 s VAL 37 N 1.63 0.49 0.14 -0.90 -7.23 0.17 -4.96 120.40 109.73 2j55 s VAL 37 Ca 0.10 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.33 2j55 s VAL 37 Cb -0.15 -2.39 -0.04 0.00 0.56 0.00 0.00 36.38 34.35 2j55 s VAL 37 CO 0.09 0.00 0.02 -0.54 -0.31 0.00 0.00 175.10 174.36 2j55 s LYS 38 N -3.69 2.55 0.19 4.82 -0.14 -1.26 -0.98 119.74 121.23 2j55 s LYS 38 Ca 0.28 -0.96 -0.22 0.00 -1.36 0.00 0.00 55.97 53.71 2j55 s LYS 38 Cb 0.03 -2.48 -0.14 0.00 -1.68 0.00 0.00 37.83 33.56 2j55 s LYS 38 CO 0.17 0.49 0.36 0.28 -0.76 0.00 0.00 175.35 175.89 2j55 n VAL 39 N 0.11 1.43 0.00 3.17 0.31 -1.26 -0.91 118.33 121.18 2j55 n VAL 39 Ca -0.10 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 2j55 n VAL 39 Cb 0.54 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.47 2j55 n VAL 39 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2j55 n GLY 40 N 1.66 2.29 3.77 2.92 0.00 0.68 -4.99 105.19 111.50 2j55 n GLY 40 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 2j55 n GLY 40 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2j55 s ASP 41 N -2.89 6.32 -0.34 1.61 -0.00 -0.08 -4.68 116.67 116.61 2j55 s ASP 41 Ca 0.00 2.63 -0.09 0.00 -0.00 0.00 0.00 52.55 55.08 2j55 s ASP 41 Cb 0.00 -2.64 0.02 0.00 -0.00 0.00 0.00 42.92 40.30 2j55 s ASP 41 CO 0.00 -0.84 0.15 -0.89 -0.00 0.00 0.00 175.17 173.59 2j55 s THR 42 N -1.28 4.34 -0.07 -1.27 2.01 -1.26 -1.28 115.64 116.83 2j55 s THR 42 Ca 0.57 -0.77 -0.17 0.00 0.31 0.00 0.00 61.69 61.63 2j55 s THR 42 Cb -0.37 -3.34 -0.05 0.00 0.01 0.00 0.00 72.50 68.75 2j55 s THR 42 CO 0.48 -0.09 0.45 -0.69 -0.69 0.00 0.00 174.62 174.08 2j55 s VAL 43 N 1.53 5.11 -0.14 3.82 1.01 -0.84 -4.16 120.40 126.73 2j55 s VAL 43 Ca 0.02 0.92 -0.00 0.00 0.00 0.00 0.00 61.98 62.92 2j55 s VAL 43 Cb -0.18 -3.78 -0.01 0.00 0.00 0.00 0.00 36.38 32.40 2j55 s VAL 43 CO 0.05 0.42 -0.13 -0.89 0.00 0.00 0.00 175.10 174.54 2j55 s THR 44 N 0.01 2.91 0.12 3.92 2.01 -0.54 -1.93 115.64 122.13 2j55 s THR 44 Ca 0.25 -0.70 -0.22 0.00 0.31 0.00 0.00 61.69 61.34 2j55 s THR 44 Cb -0.16 -2.23 -0.07 0.00 0.01 0.00 0.00 72.50 70.05 2j55 s THR 44 CO 0.11 0.51 0.66 0.26 -0.69 0.00 0.00 174.62 175.47 2j55 s TRP 45 N 0.60 3.84 -0.11 4.92 0.51 0.55 -0.95 118.94 128.29 2j55 s TRP 45 Ca -0.08 1.41 0.02 0.00 -2.12 0.00 0.00 56.10 55.34 2j55 s TRP 45 Cb -0.16 -2.60 0.01 0.00 -0.81 0.00 0.00 33.47 29.91 2j55 s TRP 45 CO 0.03 0.55 -0.18 0.42 -0.51 0.00 0.00 176.95 177.26 2j55 s ILE 46 N -1.15 1.66 -0.25 2.03 1.01 0.09 -2.33 121.20 122.26 2j55 s ILE 46 Ca 0.32 -0.75 -0.26 0.00 0.00 0.00 0.00 60.65 59.96 2j55 s ILE 46 Cb -0.21 -1.49 0.00 0.00 0.01 0.00 0.00 42.46 40.78 2j55 s ILE 46 CO 0.22 0.47 0.93 0.21 0.00 0.00 0.00 174.94 176.77 2j55 s ASN 47 N 0.83 6.92 0.07 3.58 2.47 0.83 -1.22 114.94 128.43 2j55 s ASN 47 Ca -0.09 1.12 0.23 0.00 0.42 0.00 0.00 52.86 54.54 2j55 s ASN 47 Cb -0.16 -2.48 0.01 0.00 -1.45 0.00 0.00 41.25 37.17 2j55 s ASN 47 CO 0.00 -0.62 0.98 0.54 -3.72 0.00 0.00 177.10 174.29 2j55 n ARG 48 N 6.23 0.39 -4.31 0.43 5.12 -0.24 0.43 116.66 124.71 2j55 n ARG 48 Ca 0.08 0.00 -0.25 0.00 -1.93 0.00 0.00 57.85 55.76 2j55 n ARG 48 Cb 0.47 -1.64 -0.08 0.00 -1.16 0.00 0.00 32.46 30.05 2j55 n ARG 48 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 2j55 s GLU 49 N -3.26 2.11 0.48 5.56 -1.05 -1.25 -4.77 118.70 116.52 2j55 s GLU 49 Ca 0.02 -1.82 0.25 0.00 -0.15 0.00 0.00 54.97 53.26 2j55 s GLU 49 Cb 0.13 -1.91 1.19 0.00 -0.44 0.00 0.00 34.13 33.11 2j55 s GLU 49 CO 0.81 0.03 1.96 0.00 0.95 0.00 0.00 175.26 179.01 2j55 h ALA 50 N 1.69 1.18 -2.16 -0.84 0.00 -1.94 -3.32 119.26 113.86 2j55 h ALA 50 Ca -0.43 -0.17 -0.56 0.00 0.00 0.00 0.00 54.91 53.76 2j55 h ALA 50 Cb 1.25 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2j55 h ALA 50 CO 0.70 0.23 1.17 1.41 0.00 0.00 0.00 179.25 182.75 2j55 s MET 51 N -3.97 3.91 0.39 0.00 0.00 -1.26 -4.44 119.30 113.94 2j55 s MET 51 Ca -0.01 2.03 -0.27 0.00 0.00 0.00 0.00 55.69 57.44 2j55 s MET 51 Cb 0.12 -4.07 -0.11 0.00 0.00 0.00 0.00 34.83 30.77 2j55 s MET 51 CO 0.61 -1.17 1.40 -2.30 0.00 0.00 0.00 175.02 173.56 2j55 n PRO 52 N 7.57 2.34 -4.11 4.11 -0.02 -1.26 -4.87 135.00 138.76 2j55 n PRO 52 Ca 0.20 0.82 -0.08 0.00 -2.02 0.00 0.00 63.50 62.42 2j55 n PRO 52 Cb 0.44 -2.54 -0.10 0.00 -0.02 0.00 0.00 33.50 31.28 2j55 n PRO 52 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2j55 s HIS 53 N -1.14 0.65 0.16 6.00 3.76 -1.19 -4.95 115.29 118.57 2j55 s HIS 53 Ca 0.57 -1.13 -0.00 0.00 -0.15 0.00 0.00 55.06 54.35 2j55 s HIS 53 Cb -0.50 -0.42 0.00 0.00 1.11 0.00 0.00 32.58 32.78 2j55 s HIS 53 CO 0.61 -0.44 0.21 0.27 -0.85 0.00 0.00 174.74 174.54 2j55 n ASN 54 N 0.02 -0.58 -4.45 1.40 6.94 -1.26 -1.04 115.26 116.30 2j55 n ASN 54 Ca -0.10 -1.87 -0.31 0.00 -0.02 0.00 0.00 54.58 52.28 2j55 n ASN 54 Cb 0.62 1.10 -0.13 0.00 -2.36 0.00 0.00 39.78 39.01 2j55 n ASN 54 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 2j55 s VAL 55 N -2.60 2.74 -0.09 3.53 -7.23 -1.26 -4.13 120.40 111.36 2j55 s VAL 55 Ca 0.14 -1.21 -0.03 0.00 -1.81 0.00 0.00 61.98 59.06 2j55 s VAL 55 Cb -0.00 -2.15 0.05 0.00 0.56 0.00 0.00 36.38 34.84 2j55 s VAL 55 CO 0.10 0.33 0.15 -2.28 -0.31 0.00 0.00 175.10 173.09 2j55 s HIS 56 N -0.92 -0.15 -0.20 2.82 5.04 0.16 -1.29 115.29 120.75 2j55 s HIS 56 Ca 0.14 0.54 -0.04 0.00 -1.54 0.00 0.00 55.06 54.17 2j55 s HIS 56 Cb -0.10 -0.30 -0.02 0.00 0.04 0.00 0.00 32.58 32.20 2j55 s HIS 56 CO 0.05 -0.28 -0.02 -0.06 -2.34 0.00 0.00 174.74 172.09 2j55 s PHE 57 N 2.28 3.00 1.38 3.88 0.40 0.50 -1.43 117.98 127.99 2j55 s PHE 57 Ca 0.03 -0.58 -0.23 0.00 -0.60 0.00 0.00 56.93 55.56 2j55 s PHE 57 Cb -0.12 -2.06 0.36 0.00 0.51 0.00 0.00 43.02 41.70 2j55 s PHE 57 CO -0.06 -0.30 0.81 1.33 0.70 0.00 0.00 175.22 177.70 2j55 n VAL 58 N 4.29 0.00 -2.16 -0.44 0.24 -1.26 -0.75 118.33 118.25 2j55 n VAL 58 Ca -0.17 -0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.71 2j55 n VAL 58 Cb 0.52 -0.92 -0.03 0.00 -1.47 0.00 0.00 33.84 31.93 2j55 n VAL 58 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2j55 s ALA 59 N -2.11 3.55 0.00 2.33 0.00 -1.26 -3.60 121.76 120.67 2j55 s ALA 59 Ca 0.63 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.76 2j55 s ALA 59 Cb -0.11 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.51 2j55 s ALA 59 CO 0.53 -0.59 0.00 0.41 0.00 0.00 0.00 175.76 176.10 2j55 n GLY 60 N 2.28 0.50 0.22 0.00 0.00 -0.65 -4.90 105.19 102.64 2j55 n GLY 60 Ca 0.06 -0.66 -0.11 0.00 0.00 0.00 0.00 46.02 45.31 2j55 n GLY 60 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2j55 n VAL 61 N -2.86 1.44 -0.11 1.61 0.31 -1.24 -4.69 118.33 112.78 2j55 n VAL 61 Ca 0.00 0.09 0.12 0.00 -0.01 0.00 0.00 64.34 64.54 2j55 n VAL 61 Cb 0.00 -2.18 0.28 0.00 -0.91 0.00 0.00 33.84 31.03 2j55 n VAL 61 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2j55 n LEU 62 N -4.29 3.76 0.00 7.52 4.77 -1.26 -4.77 117.00 122.72 2j55 n LEU 62 Ca -0.18 -1.81 0.00 0.00 -0.03 0.00 0.00 56.01 53.99 2j55 n LEU 62 Cb 0.52 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2j55 n LEU 62 CO 0.16 0.89 0.00 0.61 -1.33 0.00 0.00 177.39 177.72 2j55 n GLY 63 N 1.58 1.01 0.23 -0.72 0.00 -1.26 -0.83 105.19 105.19 2j55 n GLY 63 Ca 0.22 -1.96 -0.12 0.00 0.00 0.00 0.00 46.02 44.16 2j55 n GLY 63 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2j55 h GLU 64 N 6.50 0.76 -7.13 1.61 4.81 -1.95 -1.72 114.58 117.46 2j55 h GLU 64 Ca 0.00 -0.32 -0.46 0.00 -0.13 0.00 0.00 59.36 58.45 2j55 h GLU 64 Cb 0.00 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.36 2j55 h GLU 64 CO 0.00 0.93 0.36 0.00 -0.73 0.00 0.00 179.01 179.58 2j55 s ALA 65 N -4.67 3.00 0.22 2.92 0.00 -1.26 -2.66 121.76 119.32 2j55 s ALA 65 Ca -0.12 0.33 -0.30 0.00 0.00 0.00 0.00 51.96 51.87 2j55 s ALA 65 Cb 0.10 -3.16 -0.09 0.00 0.00 0.00 0.00 23.12 19.98 2j55 s ALA 65 CO 0.82 -0.17 1.16 0.00 0.00 0.00 0.00 175.76 177.57 2j55 s ALA 66 N -2.38 3.42 -0.58 0.00 0.00 -1.25 -4.34 121.76 116.64 2j55 s ALA 66 Ca 0.61 0.94 -0.22 0.00 0.00 0.00 0.00 51.96 53.29 2j55 s ALA 66 Cb -0.11 -3.38 0.06 0.00 0.00 0.00 0.00 23.12 19.69 2j55 s ALA 66 CO 0.24 -0.30 0.85 -1.17 0.00 0.00 0.00 175.76 175.38 2j55 s LEU 67 N -0.76 4.55 -0.79 0.00 0.20 0.07 -4.92 118.68 117.04 2j55 s LEU 67 Ca 0.49 -0.82 -0.16 0.00 0.69 0.00 0.00 54.13 54.33 2j55 s LEU 67 Cb -0.32 -2.54 0.18 0.00 -0.43 0.00 0.00 46.19 43.07 2j55 s LEU 67 CO 0.39 -1.20 0.81 -0.54 -0.29 0.00 0.00 176.35 175.51 2j55 s LYS 68 N 3.53 3.46 0.97 1.98 1.02 -1.26 -0.37 119.74 129.07 2j55 s LYS 68 Ca 0.22 -2.08 -0.11 0.00 0.02 0.00 0.00 55.97 54.02 2j55 s LYS 68 Cb -0.17 -4.50 0.17 0.00 -0.52 0.00 0.00 37.83 32.82 2j55 s LYS 68 CO 0.13 -1.43 1.12 0.20 -0.92 0.00 0.00 175.35 174.45 2j55 s GLY 69 N 2.82 1.66 0.38 -3.33 0.00 -0.41 -5.00 107.32 103.44 2j55 s GLY 69 Ca 0.19 0.44 -0.08 0.00 0.00 0.00 0.00 44.72 45.27 2j55 s GLY 69 CO -0.06 0.92 0.70 2.56 0.00 0.00 0.00 173.10 177.23 2j55 s PRO 70 N -4.61 3.71 0.15 2.90 0.05 -1.26 -4.71 135.00 131.22 2j55 s PRO 70 Ca 0.67 0.29 -0.31 0.00 0.05 0.00 0.00 61.00 61.71 2j55 s PRO 70 Cb -0.23 -2.47 -0.08 0.00 0.05 0.00 0.00 34.50 31.77 2j55 s PRO 70 CO 0.59 0.02 1.31 -1.64 0.05 0.00 0.00 177.00 177.34 2j55 s MET 71 N -3.85 4.38 -0.31 4.56 -1.94 -1.26 -4.62 119.30 116.25 2j55 s MET 71 Ca 0.48 2.01 -0.13 0.00 -1.71 0.00 0.00 55.69 56.34 2j55 s MET 71 Cb -0.10 -3.24 -0.03 0.00 2.01 0.00 0.00 34.83 33.47 2j55 s MET 71 CO 0.32 -0.31 0.25 -1.64 -0.01 0.00 0.00 175.02 173.63 2j55 s MET 72 N 0.51 3.71 0.81 2.03 -1.94 -0.20 -4.90 119.30 119.30 2j55 s MET 72 Ca 0.60 -0.44 -0.14 0.00 -1.71 0.00 0.00 55.69 54.00 2j55 s MET 72 Cb -0.35 -3.74 0.20 0.00 2.01 0.00 0.00 34.83 32.94 2j55 s MET 72 CO 0.34 -0.35 0.74 1.63 -0.01 0.00 0.00 175.02 177.36 2j55 n LYS 73 N 5.15 -2.32 -1.81 2.03 5.02 -1.26 -3.20 118.16 121.77 2j55 n LYS 73 Ca -0.12 -1.18 -0.42 0.00 -2.02 0.00 0.00 58.31 54.57 2j55 n LYS 73 Cb 0.51 -1.08 -0.03 0.00 -0.02 0.00 0.00 35.03 34.41 2j55 n LYS 73 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2j55 s LYS 74 N -4.67 4.11 -0.39 1.97 2.20 -1.25 -2.50 119.74 119.23 2j55 s LYS 74 Ca 0.47 2.41 0.00 0.00 -0.36 0.00 0.00 55.97 58.50 2j55 s LYS 74 Cb -0.04 -4.10 0.00 0.00 -1.51 0.00 0.00 37.83 32.17 2j55 s LYS 74 CO 0.36 -0.96 0.00 0.39 -0.36 0.00 0.00 175.35 174.78 2j55 n GLU 75 N 7.43 -0.31 -3.46 4.03 -0.58 0.17 -5.03 120.64 122.89 2j55 n GLU 75 Ca 0.19 0.37 -0.23 0.00 -0.42 0.00 0.00 57.16 57.07 2j55 n GLU 75 Cb 0.42 -4.08 -0.01 0.00 -0.57 0.00 0.00 31.44 27.20 2j55 n GLU 75 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2j55 s GLN 76 N -3.51 3.47 0.13 3.49 -0.21 -1.04 -2.48 119.66 119.52 2j55 s GLN 76 Ca 0.00 -0.40 0.02 0.00 0.02 0.00 0.00 55.36 55.00 2j55 s GLN 76 Cb 0.00 -2.70 -0.04 0.00 1.00 0.00 0.00 33.01 31.27 2j55 s GLN 76 CO 0.00 0.19 -0.03 0.00 -2.12 0.00 0.00 175.29 173.33 2j55 s ALA 77 N -2.27 1.14 -0.01 6.09 0.00 -0.55 -0.12 121.76 126.03 2j55 s ALA 77 Ca 0.39 -1.46 -0.12 0.00 0.00 0.00 0.00 51.96 50.77 2j55 s ALA 77 Cb -0.09 0.36 0.02 0.00 0.00 0.00 0.00 23.12 23.40 2j55 s ALA 77 CO 0.35 -0.28 0.25 -0.47 0.00 0.00 0.00 175.76 175.61 2j55 s TYR 78 N -3.65 -0.11 0.20 0.00 5.04 -0.98 -1.41 117.35 116.43 2j55 s TYR 78 Ca 0.18 0.16 0.03 0.00 -2.44 0.00 0.00 57.07 54.99 2j55 s TYR 78 Cb 0.06 0.05 -0.05 0.00 0.35 0.00 0.00 41.96 42.37 2j55 s TYR 78 CO -0.01 -0.34 -0.00 -1.54 -1.34 0.00 0.00 175.55 172.32 2j55 s SER 79 N -1.27 1.47 -0.03 4.32 1.04 -1.26 -0.33 113.70 117.64 2j55 s SER 79 Ca -0.13 -1.19 -0.01 0.00 0.48 0.00 0.00 55.95 55.10 2j55 s SER 79 Cb -0.06 0.07 0.02 0.00 0.10 0.00 0.00 66.02 66.16 2j55 s SER 79 CO 0.03 -0.54 0.06 -0.76 0.98 0.00 0.00 173.24 173.01 2j55 s LEU 80 N -3.23 1.22 -0.33 2.42 1.43 -0.81 -4.13 118.68 115.26 2j55 s LEU 80 Ca 0.26 0.11 -0.15 0.00 -1.03 0.00 0.00 54.13 53.32 2j55 s LEU 80 Cb 0.06 0.09 -0.02 0.00 0.03 0.00 0.00 46.19 46.35 2j55 s LEU 80 CO 0.06 -0.10 0.34 -0.89 0.23 0.00 0.00 176.35 175.98 2j55 s THR 81 N 0.79 5.19 0.25 5.49 2.01 0.10 -1.98 115.64 127.49 2j55 s THR 81 Ca -0.06 0.10 -0.24 0.00 0.31 0.00 0.00 61.69 61.80 2j55 s THR 81 Cb -0.09 -3.77 -0.09 0.00 0.01 0.00 0.00 72.50 68.56 2j55 s THR 81 CO -0.03 -0.02 0.83 -0.36 -0.69 0.00 0.00 174.62 174.35 2j55 s PHE 82 N 1.97 3.74 -0.03 4.92 0.40 -0.40 -1.00 117.98 127.58 2j55 s PHE 82 Ca 0.11 1.62 0.06 0.00 -0.60 0.00 0.00 56.93 58.12 2j55 s PHE 82 Cb -0.16 -2.79 0.09 0.00 0.51 0.00 0.00 43.02 40.67 2j55 s PHE 82 CO 0.11 0.34 1.04 0.25 0.70 0.00 0.00 175.22 177.66 2j55 n THR 83 N 0.90 0.46 -3.64 0.64 -2.24 -1.22 -0.23 114.28 108.94 2j55 n THR 83 Ca -0.01 -0.60 -0.05 0.00 -2.27 0.00 0.00 64.05 61.11 2j55 n THR 83 Cb 0.50 0.35 -0.07 0.00 -2.10 0.00 0.00 70.33 69.01 2j55 n THR 83 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2j55 s GLU 84 N -0.69 0.34 0.26 -0.78 2.12 -1.26 -4.87 118.70 113.82 2j55 s GLU 84 Ca 0.09 0.46 -0.30 0.00 0.36 0.00 0.00 54.97 55.59 2j55 s GLU 84 Cb 0.09 0.14 -0.10 0.00 0.26 0.00 0.00 34.13 34.51 2j55 s GLU 84 CO -0.00 -0.05 1.42 0.00 -0.54 0.00 0.00 175.26 176.09 2j55 s ALA 85 N 0.54 3.61 0.00 6.30 0.00 -1.26 -4.80 121.76 126.14 2j55 s ALA 85 Ca 0.00 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.28 2j55 s ALA 85 Cb -0.04 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.53 2j55 s ALA 85 CO -0.11 -0.74 0.00 0.41 0.00 0.00 0.00 175.76 175.33 2j55 n GLY 86 N 2.02 0.32 3.38 0.00 0.00 -0.70 -5.02 105.19 105.20 2j55 n GLY 86 Ca 0.06 -1.51 -0.33 0.00 0.00 0.00 0.00 46.02 44.24 2j55 n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2j55 s THR 87 N -1.71 3.26 -0.21 2.61 2.01 -1.26 -1.37 115.64 118.96 2j55 s THR 87 Ca 0.00 -0.58 0.01 0.00 0.31 0.00 0.00 61.69 61.43 2j55 s THR 87 Cb 0.00 -2.40 0.03 0.00 0.01 0.00 0.00 72.50 70.14 2j55 s THR 87 CO 0.00 0.50 -0.15 -0.31 -0.69 0.00 0.00 174.62 173.97 2j55 s TYR 88 N 0.58 2.95 0.14 4.92 2.02 -0.54 -5.00 117.35 122.42 2j55 s TYR 88 Ca -0.06 -1.77 -0.15 0.00 -0.37 0.00 0.00 57.07 54.72 2j55 s TYR 88 Cb -0.15 -1.95 -0.07 0.00 -0.40 0.00 0.00 41.96 39.39 2j55 s TYR 88 CO 0.03 -0.80 0.56 -0.51 -1.57 0.00 0.00 175.55 173.26 2j55 s ASP 89 N 1.26 6.87 0.31 2.29 1.01 -1.26 -0.83 116.67 126.32 2j55 s ASP 89 Ca 0.01 1.12 0.07 0.00 0.71 0.00 0.00 52.55 54.46 2j55 s ASP 89 Cb -0.15 -2.30 -0.03 0.00 1.01 0.00 0.00 42.92 41.45 2j55 s ASP 89 CO -0.09 0.13 0.26 0.00 0.21 0.00 0.00 175.17 175.68 2j55 n TYR 90 N 0.95 -0.72 -3.64 4.23 4.11 -0.09 -4.46 117.16 117.54 2j55 n TYR 90 Ca -0.06 -2.64 -0.06 0.00 -0.00 0.00 0.00 57.90 55.14 2j55 n TYR 90 Cb 0.52 0.27 -0.02 0.00 -0.00 0.00 0.00 39.34 40.11 2j55 n TYR 90 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.86 173.48 2j55 s HIS 91 N -3.27 -0.23 0.03 -3.48 -3.43 -0.51 -2.29 115.29 102.11 2j55 s HIS 91 Ca 0.37 0.00 -0.16 0.00 -0.80 0.00 0.00 55.06 54.48 2j55 s HIS 91 Cb 0.02 0.59 -0.06 0.00 -1.43 0.00 0.00 32.58 31.70 2j55 s HIS 91 CO 0.26 -0.70 0.46 0.00 -2.00 0.00 0.00 174.74 172.77 2j55 h THR 93 N 3.56 0.24 0.00 0.00 2.02 -1.90 -2.32 112.91 114.50 2j55 h THR 93 Ca -0.51 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 66.34 2j55 h THR 93 Cb 1.22 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.95 2j55 h THR 93 CO 0.62 0.03 0.00 1.55 0.37 0.00 0.00 175.52 178.10 2j55 h PRO 94 N -1.07 0.00 -2.17 6.66 0.13 -1.96 -3.38 132.00 130.20 2j55 h PRO 94 Ca -0.08 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.46 2j55 h PRO 94 Cb 0.67 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.39 2j55 h PRO 94 CO 0.14 0.00 -0.72 0.72 -0.23 0.00 0.00 178.00 177.90 2j55 n HIS 95 N -3.01 2.60 0.68 1.56 8.25 -0.88 -4.96 115.22 119.47 2j55 n HIS 95 Ca -0.00 -4.01 0.07 0.00 -0.26 0.00 0.00 57.72 53.52 2j55 n HIS 95 Cb 0.23 -0.50 0.36 0.00 1.12 0.00 0.00 29.99 31.20 2j55 n HIS 95 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2j55 n PRO 96 N 1.04 0.21 0.23 -0.41 -0.04 -1.18 -0.59 135.00 134.25 2j55 n PRO 96 Ca 0.27 0.15 0.11 0.00 -0.04 0.00 0.00 63.50 64.00 2j55 n PRO 96 Cb 0.44 -1.50 0.48 0.00 -0.04 0.00 0.00 33.50 32.88 2j55 n PRO 96 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2j55 h PHE 97 N 0.00 0.00 -2.43 0.54 -5.15 -1.93 -3.41 116.94 104.57 2j55 h PHE 97 Ca 0.00 0.00 -0.60 0.00 -0.20 0.00 0.00 57.97 57.17 2j55 h PHE 97 Cb 0.13 0.00 -0.12 0.00 0.22 0.00 0.00 35.95 36.18 2j55 h PHE 97 CO 0.00 0.17 0.82 -1.64 -2.00 0.00 0.00 178.31 175.66 2j55 s MET 98 N -3.61 3.20 -0.06 6.09 -1.94 0.24 -5.02 119.30 118.20 2j55 s MET 98 Ca 0.01 -0.68 0.05 0.00 -1.71 0.00 0.00 55.69 53.36 2j55 s MET 98 Cb 0.10 -4.32 -0.02 0.00 2.01 0.00 0.00 34.83 32.60 2j55 s MET 98 CO 0.62 -1.97 -0.21 1.03 -0.01 0.00 0.00 175.02 174.48 2j55 s ARG 99 N 4.68 2.59 0.16 2.03 0.52 -1.26 -2.10 118.95 125.56 2j55 s ARG 99 Ca 0.29 -0.83 0.02 0.00 -0.52 0.00 0.00 55.73 54.69 2j55 s ARG 99 Cb -0.12 -2.26 -0.01 0.00 0.52 0.00 0.00 34.95 33.09 2j55 s ARG 99 CO 0.10 0.44 0.07 0.41 0.02 0.00 0.00 175.30 176.34 2j55 n GLY 100 N 2.79 3.73 3.41 -3.53 0.00 -0.97 -4.82 105.19 105.80 2j55 n GLY 100 Ca -0.17 -1.95 0.02 0.00 0.00 0.00 0.00 46.02 43.92 2j55 n GLY 100 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2j55 s LYS 101 N -2.60 0.50 -0.39 1.61 2.20 -1.07 -0.92 119.74 119.08 2j55 s LYS 101 Ca 0.10 1.10 -0.15 0.00 -0.36 0.00 0.00 55.97 56.66 2j55 s LYS 101 Cb 0.00 0.65 0.01 0.00 -1.51 0.00 0.00 37.83 36.98 2j55 s LYS 101 CO 0.07 -0.32 0.30 0.08 -0.36 0.00 0.00 175.35 175.12 2j55 s VAL 102 N 2.82 5.25 -0.34 4.02 1.01 -0.01 -2.10 120.40 131.06 2j55 s VAL 102 Ca 0.04 -0.46 -0.21 0.00 0.00 0.00 0.00 61.98 61.35 2j55 s VAL 102 Cb -0.12 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.40 2j55 s VAL 102 CO -0.19 -0.21 0.68 -0.69 0.00 0.00 0.00 175.10 174.69 2j55 s VAL 103 N 1.75 4.86 -0.29 2.92 1.01 0.76 -1.47 120.40 129.94 2j55 s VAL 103 Ca 0.06 0.78 -0.10 0.00 0.00 0.00 0.00 61.98 62.73 2j55 s VAL 103 Cb -0.18 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 2j55 s VAL 103 CO 0.11 -0.28 0.15 -0.69 0.00 0.00 0.00 175.10 174.39 2j55 s VAL 104 N 2.78 4.78 -2.90 2.92 1.01 -0.47 0.41 120.40 128.93 2j55 s VAL 104 Ca 0.27 -0.21 0.25 0.00 0.00 0.00 0.00 61.98 62.28 2j55 s VAL 104 Cb -0.14 -3.36 0.26 0.00 0.00 0.00 0.00 36.38 33.13 2j55 s VAL 104 CO 0.14 0.15 1.36 -0.62 0.00 0.00 0.00 175.10 176.13