#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2djm s SER 2 N 0.00 4.12 -0.42 0.00 0.01 -1.26 -5.00 113.70 111.15 2djm s SER 2 Ca 0.00 2.02 -0.12 0.00 1.31 0.00 0.00 55.95 59.16 2djm s SER 2 Cb 0.00 -2.55 0.05 0.00 0.21 0.00 0.00 66.02 63.74 2djm s SER 2 CO 0.00 -2.30 0.28 -0.63 0.41 0.00 0.00 173.24 171.00 2djm s ILE 3 N -2.63 4.70 0.40 1.44 1.09 -1.26 -5.07 121.20 119.87 2djm s ILE 3 Ca 0.65 -1.05 -0.26 0.00 -1.10 0.00 0.00 60.65 58.89 2djm s ILE 3 Cb -0.21 -3.75 -0.09 0.00 -1.06 0.00 0.00 42.46 37.36 2djm s ILE 3 CO 0.53 -0.41 1.23 -2.16 -0.10 0.00 0.00 174.94 174.03 2djm s PRO 4 N 1.55 4.02 0.00 2.79 0.04 -1.26 -4.94 135.00 137.20 2djm s PRO 4 Ca 0.03 2.00 0.00 0.00 0.04 0.00 0.00 61.00 63.07 2djm s PRO 4 Cb -0.22 -2.73 0.00 0.00 0.04 0.00 0.00 34.50 31.60 2djm s PRO 4 CO 0.06 -0.40 0.00 0.45 0.04 0.00 0.00 177.00 177.15 2djm n SER 5 N 0.12 0.96 -0.16 6.66 2.88 -1.26 -4.71 113.62 118.12 2djm n SER 5 Ca 0.04 -0.18 0.13 0.00 -1.33 0.00 0.00 58.87 57.52 2djm n SER 5 Cb 0.45 0.56 0.33 0.00 -0.75 0.00 0.00 64.21 64.80 2djm n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2djm n SER 6 N -0.66 0.83 -4.36 -3.46 7.64 -1.26 -4.90 113.62 107.45 2djm n SER 6 Ca 0.00 -0.66 -0.19 0.00 1.01 0.00 0.00 58.87 59.03 2djm n SER 6 Cb 0.00 0.17 -0.10 0.00 -1.01 0.00 0.00 64.21 63.27 2djm n SER 6 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2djm s ALA 7 N -2.68 2.08 -0.11 -0.43 0.00 -1.26 -5.03 121.76 114.32 2djm s ALA 7 Ca 0.20 -1.72 0.16 0.00 0.00 0.00 0.00 51.96 50.60 2djm s ALA 7 Cb 0.19 0.00 -0.20 0.00 0.00 0.00 0.00 23.12 23.11 2djm s ALA 7 CO 0.58 0.02 0.61 0.43 0.00 0.00 0.00 175.76 177.40 2djm n SER 8 N -0.43 0.63 -3.75 0.00 7.64 -1.26 -4.88 113.62 111.56 2djm n SER 8 Ca -0.07 0.28 -0.13 0.00 1.01 0.00 0.00 58.87 59.96 2djm n SER 8 Cb 0.61 0.41 -0.09 0.00 -1.01 0.00 0.00 64.21 64.13 2djm n SER 8 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2djm s VAL 9 N -2.80 0.04 -0.04 0.44 0.11 -1.26 -1.13 120.40 115.75 2djm s VAL 9 Ca -0.05 -0.31 0.01 0.00 -2.93 0.00 0.00 61.98 58.70 2djm s VAL 9 Cb 0.08 -0.58 0.02 0.00 -1.53 0.00 0.00 36.38 34.37 2djm s VAL 9 CO 0.83 -0.17 -0.02 -1.58 -3.33 0.00 0.00 175.10 170.82 2djm s GLN 10 N -0.82 0.62 0.16 1.54 0.74 0.25 -4.83 119.66 117.32 2djm s GLN 10 Ca -0.09 -0.02 -0.30 0.00 0.05 0.00 0.00 55.36 55.00 2djm s GLN 10 Cb -0.04 -0.72 -0.08 0.00 1.10 0.00 0.00 33.01 33.27 2djm s GLN 10 CO 0.03 -0.12 1.24 -1.17 -0.55 0.00 0.00 175.29 174.72 2djm s LEU 11 N 1.05 4.42 -0.06 3.68 2.96 -1.26 0.09 118.68 129.56 2djm s LEU 11 Ca -0.09 2.25 -0.01 0.00 -0.22 0.00 0.00 54.13 56.06 2djm s LEU 11 Cb -0.14 -3.60 -0.00 0.00 0.50 0.00 0.00 46.19 42.95 2djm s LEU 11 CO -0.01 -0.45 -0.01 -0.78 -1.32 0.00 0.00 176.35 173.77 2djm h ASP 12 N 5.69 0.00 0.00 3.68 3.58 -1.80 -3.45 116.42 124.11 2djm h ASP 12 Ca -0.44 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.01 2djm h ASP 12 Cb 1.21 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.26 2djm h ASP 12 CO 0.77 0.32 0.00 -1.54 -2.88 0.00 0.00 179.24 175.91 2djm n SER 13 N -3.66 0.00 -3.66 2.28 3.41 -1.13 -5.01 113.62 105.85 2djm n SER 13 Ca -0.01 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.51 2djm n SER 13 Cb 0.02 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.94 2djm n SER 13 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2djm s TYR 14 N -2.00 -0.26 0.17 7.33 1.13 -1.26 -0.82 117.35 121.65 2djm s TYR 14 Ca 0.00 -0.07 -0.15 0.00 -1.41 0.00 0.00 57.07 55.44 2djm s TYR 14 Cb 0.00 0.48 0.02 0.00 -1.10 0.00 0.00 41.96 41.36 2djm s TYR 14 CO 0.00 -0.94 0.44 1.21 -2.51 0.00 0.00 175.55 173.75 2djm s ASN 15 N -2.84 -0.17 0.06 -0.18 3.84 0.44 -4.96 114.94 111.13 2djm s ASN 15 Ca 0.07 -0.55 0.05 0.00 0.21 0.00 0.00 52.86 52.64 2djm s ASN 15 Cb -0.02 0.52 -0.03 0.00 -0.55 0.00 0.00 41.25 41.18 2djm s ASN 15 CO -0.05 -0.97 -0.13 -0.47 -2.79 0.00 0.00 177.10 172.69 2djm s TYR 16 N -3.88 1.13 -0.30 0.43 5.04 -1.26 -2.61 117.35 115.91 2djm s TYR 16 Ca 0.10 -0.45 -0.17 0.00 -2.44 0.00 0.00 57.07 54.11 2djm s TYR 16 Cb 0.01 -0.65 0.18 0.00 0.35 0.00 0.00 41.96 41.85 2djm s TYR 16 CO -0.04 0.03 1.14 0.34 -1.34 0.00 0.00 175.55 175.68 2djm s ASP 17 N -1.63 -0.32 0.78 4.32 2.15 -1.18 -4.97 116.67 115.82 2djm s ASP 17 Ca -0.03 0.38 0.00 0.00 0.43 0.00 0.00 52.55 53.33 2djm s ASP 17 Cb -0.10 1.34 0.00 0.00 -0.30 0.00 0.00 42.92 43.86 2djm s ASP 17 CO 0.02 -0.06 0.00 0.61 -0.17 0.00 0.00 175.17 175.57 2djm n GLY 18 N 4.91 0.65 2.53 2.66 0.00 -1.26 -2.31 105.19 112.37 2djm n GLY 18 Ca -0.08 0.50 -0.28 0.00 0.00 0.00 0.00 46.02 46.17 2djm n GLY 18 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2djm s SER 19 N -4.00 2.55 -0.12 1.61 0.15 -1.26 -5.08 113.70 107.55 2djm s SER 19 Ca 0.00 -2.95 -0.08 0.00 0.70 0.00 0.00 55.95 53.62 2djm s SER 19 Cb 0.00 -0.69 0.04 0.00 -1.71 0.00 0.00 66.02 63.66 2djm s SER 19 CO 0.00 -0.20 0.31 -0.89 1.20 0.00 0.00 173.24 173.66 2djm s THR 20 N 0.07 -0.02 -0.28 6.45 2.01 -0.98 -4.47 115.64 118.43 2djm s THR 20 Ca 0.27 0.07 -0.01 0.00 0.31 0.00 0.00 61.69 62.32 2djm s THR 20 Cb -0.07 -0.45 0.09 0.00 0.01 0.00 0.00 72.50 72.08 2djm s THR 20 CO -0.12 0.03 0.08 0.12 -0.69 0.00 0.00 174.62 174.04 2djm s PHE 21 N 0.82 1.51 0.17 4.92 5.36 0.14 -3.09 117.98 127.81 2djm s PHE 21 Ca -0.05 -1.51 -0.01 0.00 -0.96 0.00 0.00 56.93 54.40 2djm s PHE 21 Cb -0.06 -1.52 -0.04 0.00 -0.34 0.00 0.00 43.02 41.05 2djm s PHE 21 CO -0.06 -0.82 0.08 0.45 -1.46 0.00 0.00 175.22 173.42 2djm s SER 22 N 1.69 0.41 0.00 6.13 0.15 -1.07 -1.33 113.70 119.68 2djm s SER 22 Ca 0.07 -1.29 0.00 0.00 0.70 0.00 0.00 55.95 55.43 2djm s SER 22 Cb -0.17 0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.44 2djm s SER 22 CO -0.22 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 174.07 2djm n GLY 23 N -0.21 -0.50 3.71 9.45 0.00 -0.26 -0.42 105.19 116.95 2djm n GLY 23 Ca -0.02 -0.90 -0.09 0.00 0.00 0.00 0.00 46.02 45.01 2djm n GLY 23 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2djm s LYS 24 N -1.88 1.85 0.06 1.61 0.00 0.00 -0.59 119.74 120.79 2djm s LYS 24 Ca 0.00 -1.30 0.02 0.00 0.00 0.00 0.00 55.97 54.69 2djm s LYS 24 Cb 0.00 0.55 -0.03 0.00 0.00 0.00 0.00 37.83 38.35 2djm s LYS 24 CO 0.00 -0.82 -0.07 0.42 0.00 0.00 0.00 175.35 174.88 2djm s ILE 25 N -3.42 0.53 -0.31 3.79 1.01 0.19 -2.54 121.20 120.45 2djm s ILE 25 Ca 0.19 -1.35 -0.00 0.00 0.00 0.00 0.00 60.65 59.49 2djm s ILE 25 Cb -0.03 -0.93 0.10 0.00 0.01 0.00 0.00 42.46 41.61 2djm s ILE 25 CO 0.11 -0.57 0.09 -0.47 0.00 0.00 0.00 174.94 174.10 2djm s TYR 26 N -2.16 1.93 -0.00 3.97 6.14 0.11 -1.52 117.35 125.82 2djm s TYR 26 Ca -0.03 -1.86 -0.03 0.00 0.64 0.00 0.00 57.07 55.79 2djm s TYR 26 Cb -0.05 -1.83 -0.00 0.00 0.42 0.00 0.00 41.96 40.50 2djm s TYR 26 CO -0.02 -0.88 0.05 0.54 0.64 0.00 0.00 175.55 175.88 2djm s VAL 27 N 1.54 0.06 0.19 3.14 0.11 -1.10 0.84 120.40 125.17 2djm s VAL 27 Ca 0.09 -0.48 0.00 0.00 -2.93 0.00 0.00 61.98 58.67 2djm s VAL 27 Cb -0.17 -0.23 -0.04 0.00 -1.53 0.00 0.00 36.38 34.41 2djm s VAL 27 CO -0.23 -0.26 0.36 -1.59 -3.33 0.00 0.00 175.10 170.05 2djm s LYS 28 N -0.81 3.50 -0.27 1.54 -2.85 -0.28 0.06 119.74 120.62 2djm s LYS 28 Ca -0.09 -0.40 -0.29 0.00 -1.00 0.00 0.00 55.97 54.19 2djm s LYS 28 Cb -0.05 -2.87 -0.00 0.00 -2.06 0.00 0.00 37.83 32.84 2djm s LYS 28 CO 0.00 0.43 1.33 0.54 0.10 0.00 0.00 175.35 177.75 2djm s ASN 29 N -3.17 6.68 -0.10 0.03 4.22 -1.26 -4.87 114.94 116.48 2djm s ASN 29 Ca 0.37 1.32 -0.14 0.00 -2.14 0.00 0.00 52.86 52.28 2djm s ASN 29 Cb -0.11 -2.54 -0.11 0.00 1.28 0.00 0.00 41.25 39.77 2djm s ASN 29 CO 0.29 -1.05 0.45 0.40 -2.04 0.00 0.00 177.10 175.14 2djm h ILE 30 N 5.91 0.67 0.00 0.54 1.08 -1.97 -3.46 117.51 120.29 2djm h ILE 30 Ca -0.27 -1.36 0.00 0.00 -0.39 0.00 0.00 64.86 62.84 2djm h ILE 30 Cb 1.10 1.23 0.00 0.00 -3.07 0.00 0.00 36.82 36.09 2djm h ILE 30 CO 1.02 0.21 0.00 0.00 -0.69 0.00 0.00 178.15 178.69 2djm n ALA 31 N -2.68 0.10 0.03 1.87 0.00 -1.26 -5.11 120.51 113.45 2djm n ALA 31 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2djm n ALA 31 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.66 2djm n ALA 31 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2djm n TYR 32 N -0.53 -2.40 -2.72 0.00 9.36 -1.26 -5.10 117.16 114.52 2djm n TYR 32 Ca 0.00 0.21 -0.42 0.00 3.32 0.00 0.00 57.90 61.01 2djm n TYR 32 Cb 0.00 0.89 -0.03 0.00 -0.63 0.00 0.00 39.34 39.57 2djm n TYR 32 CO 0.00 0.00 0.00 -1.12 0.22 0.00 0.00 176.86 175.96 2djm s SER 33 N -1.15 7.18 0.46 2.98 0.01 -1.26 -4.92 113.70 117.00 2djm s SER 33 Ca 0.00 1.45 0.03 0.00 1.31 0.00 0.00 55.95 58.74 2djm s SER 33 Cb 0.00 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.67 2djm s SER 33 CO 0.00 -0.47 0.04 -0.54 0.41 0.00 0.00 173.24 172.67 2djm s LYS 34 N 2.21 2.07 -0.05 12.44 1.02 -1.26 -3.99 119.74 132.19 2djm s LYS 34 Ca 0.46 -2.28 0.06 0.00 0.02 0.00 0.00 55.97 54.23 2djm s LYS 34 Cb -0.17 -1.29 -0.01 0.00 -0.52 0.00 0.00 37.83 35.83 2djm s LYS 34 CO 0.15 -0.34 -0.24 0.15 -0.92 0.00 0.00 175.35 174.16 2djm s LYS 35 N -3.82 2.30 -0.19 1.68 1.02 0.15 -4.97 119.74 115.90 2djm s LYS 35 Ca 0.16 -0.86 -0.00 0.00 0.02 0.00 0.00 55.97 55.29 2djm s LYS 35 Cb 0.03 -2.01 0.05 0.00 -0.52 0.00 0.00 37.83 35.38 2djm s LYS 35 CO 0.08 0.40 -0.06 0.08 -0.92 0.00 0.00 175.35 174.94 2djm s VAL 36 N -0.24 1.28 -0.03 3.17 1.01 -1.26 -2.03 120.40 122.30 2djm s VAL 36 Ca -0.00 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.17 2djm s VAL 36 Cb -0.12 -1.47 0.00 0.00 0.00 0.00 0.00 36.38 34.79 2djm s VAL 36 CO 0.02 0.07 -0.10 0.42 0.00 0.00 0.00 175.10 175.51 2djm s THR 37 N 1.55 0.86 -0.10 3.92 -4.23 -1.10 -0.60 115.64 115.94 2djm s THR 37 Ca -0.01 -0.41 -0.16 0.00 -1.18 0.00 0.00 61.69 59.93 2djm s THR 37 Cb -0.16 -0.76 -0.05 0.00 1.34 0.00 0.00 72.50 72.87 2djm s THR 37 CO -0.07 0.26 0.41 -0.69 -0.54 0.00 0.00 174.62 173.99 2djm s VAL 38 N 0.14 5.18 -0.37 2.29 1.01 0.12 -0.15 120.40 128.62 2djm s VAL 38 Ca -0.03 0.81 -0.03 0.00 0.00 0.00 0.00 61.98 62.74 2djm s VAL 38 Cb -0.08 -3.74 0.08 0.00 0.00 0.00 0.00 36.38 32.64 2djm s VAL 38 CO 0.01 0.41 0.13 0.68 0.00 0.00 0.00 175.10 176.32 2djm s VAL 39 N 0.13 3.31 -0.16 2.92 -7.23 -1.11 -1.19 120.40 117.07 2djm s VAL 39 Ca 0.23 -1.68 0.01 0.00 -1.81 0.00 0.00 61.98 58.72 2djm s VAL 39 Cb -0.15 -3.09 0.02 0.00 0.56 0.00 0.00 36.38 33.72 2djm s VAL 39 CO 0.09 -0.43 -0.17 -0.72 -0.31 0.00 0.00 175.10 173.56 2djm s TYR 40 N 1.23 2.47 0.01 2.82 1.13 -0.93 -1.96 117.35 122.13 2djm s TYR 40 Ca 0.02 -1.40 -0.30 0.00 -1.41 0.00 0.00 57.07 53.99 2djm s TYR 40 Cb -0.21 -1.74 -0.04 0.00 -1.10 0.00 0.00 41.96 38.86 2djm s TYR 40 CO -0.02 -0.71 1.12 0.00 -2.51 0.00 0.00 175.55 173.43 2djm s ALA 41 N 1.30 3.34 1.31 9.51 0.00 0.32 -4.82 121.76 132.72 2djm s ALA 41 Ca 0.03 0.69 -0.22 0.00 0.00 0.00 0.00 51.96 52.46 2djm s ALA 41 Cb -0.13 -3.42 0.33 0.00 0.00 0.00 0.00 23.12 19.89 2djm s ALA 41 CO -0.10 -0.43 1.06 0.34 0.00 0.00 0.00 175.76 176.62 2djm s ASP 42 N 1.11 -0.03 0.00 0.00 -1.08 -1.26 0.28 116.67 115.69 2djm s ASP 42 Ca 0.56 0.57 0.13 0.00 -0.52 0.00 0.00 52.55 53.28 2djm s ASP 42 Cb -0.25 -0.74 0.76 0.00 -1.46 0.00 0.00 42.92 41.22 2djm s ASP 42 CO 0.27 -4.70 1.20 0.61 0.52 0.00 0.00 175.17 173.07 2djm n GLY 43 N -0.25 -0.41 0.27 2.66 0.00 -1.21 -1.54 105.19 104.71 2djm n GLY 43 Ca 0.15 -0.08 0.15 0.00 0.00 0.00 0.00 46.02 46.24 2djm n GLY 43 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2djm h SER 44 N 0.00 0.00 -4.15 1.61 0.02 -1.91 -3.47 113.55 105.65 2djm h SER 44 Ca 0.00 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.64 2djm h SER 44 Cb 0.01 0.00 0.08 0.00 0.14 0.00 0.00 62.40 62.62 2djm h SER 44 CO 0.00 0.09 -0.50 -0.67 -1.14 0.00 0.00 176.83 174.61 2djm n ASP 45 N -3.38 -5.24 -3.64 3.07 2.03 -0.59 -4.96 116.55 103.84 2djm n ASP 45 Ca -0.01 -0.32 -0.06 0.00 0.52 0.00 0.00 54.79 54.92 2djm n ASP 45 Cb 0.26 -3.96 -0.07 0.00 -0.72 0.00 0.00 41.12 36.63 2djm n ASP 45 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2djm s ASN 46 N -3.02 -0.23 -1.05 1.67 3.84 -1.26 -5.07 114.94 109.82 2djm s ASN 46 Ca 0.35 0.44 -0.17 0.00 0.21 0.00 0.00 52.86 53.69 2djm s ASN 46 Cb -0.15 0.44 0.15 0.00 -0.55 0.00 0.00 41.25 41.14 2djm s ASN 46 CO 0.43 -0.08 1.26 0.86 -2.79 0.00 0.00 177.10 176.78 2djm s TRP 47 N 0.08 3.27 0.22 0.43 -0.11 -1.26 -4.63 118.94 116.94 2djm s TRP 47 Ca 0.05 -1.70 -0.32 0.00 1.22 0.00 0.00 56.10 55.36 2djm s TRP 47 Cb -0.05 -4.30 -0.13 0.00 -1.50 0.00 0.00 33.47 27.49 2djm s TRP 47 CO -0.11 -1.46 1.55 -1.71 -4.62 0.00 0.00 176.95 170.60 2djm n ASN 48 N 6.22 3.28 -3.66 5.86 5.15 -1.26 -4.84 115.26 126.01 2djm n ASN 48 Ca 0.30 1.11 -0.43 0.00 -0.60 0.00 0.00 54.58 54.95 2djm n ASN 48 Cb 0.46 -1.48 -0.05 0.00 -0.53 0.00 0.00 39.78 38.19 2djm n ASN 48 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2djm n ASN 49 N 2.91 2.76 -0.00 1.20 5.15 -1.26 -3.87 115.26 122.14 2djm n ASN 49 Ca 0.14 -2.71 0.04 0.00 -0.60 0.00 0.00 54.58 51.45 2djm n ASN 49 Cb 0.32 -1.21 -0.06 0.00 -0.53 0.00 0.00 39.78 38.30 2djm n ASN 49 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2djm n ASN 50 N 7.37 2.58 0.00 1.20 5.15 -1.26 -5.03 115.26 125.27 2djm n ASN 50 Ca 0.50 -0.15 0.00 0.00 -0.60 0.00 0.00 54.58 54.33 2djm n ASN 50 Cb 0.40 1.29 0.00 0.00 -0.53 0.00 0.00 39.78 40.94 2djm n ASN 50 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2djm n GLY 51 N 1.86 2.21 2.93 8.20 0.00 -1.25 -4.76 105.19 114.39 2djm n GLY 51 Ca -0.01 -0.38 -0.05 0.00 0.00 0.00 0.00 46.02 45.58 2djm n GLY 51 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2djm n ASN 52 N 3.26 -7.89 -4.67 1.61 3.02 -1.26 -4.41 115.26 104.92 2djm n ASN 52 Ca 0.00 0.31 -0.31 0.00 -0.03 0.00 0.00 54.58 54.55 2djm n ASN 52 Cb 0.00 -5.34 -0.08 0.00 -0.61 0.00 0.00 39.78 33.74 2djm n ASN 52 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2djm s ILE 53 N -2.75 3.97 -0.00 2.41 1.10 -1.24 -2.18 121.20 122.50 2djm s ILE 53 Ca 0.16 -0.94 0.03 0.00 -0.51 0.00 0.00 60.65 59.38 2djm s ILE 53 Cb -0.04 -2.86 -0.01 0.00 0.15 0.00 0.00 42.46 39.70 2djm s ILE 53 CO 0.76 0.17 -0.09 -0.51 -2.11 0.00 0.00 174.94 173.16 2djm s ILE 54 N -1.25 0.72 -0.32 2.00 1.10 -0.33 -4.92 121.20 118.19 2djm s ILE 54 Ca 0.24 -0.41 -0.18 0.00 -0.51 0.00 0.00 60.65 59.78 2djm s ILE 54 Cb -0.12 -0.61 -0.01 0.00 0.15 0.00 0.00 42.46 41.88 2djm s ILE 54 CO 0.16 0.19 0.53 0.00 -2.11 0.00 0.00 174.94 173.71 2djm s ALA 55 N -0.25 3.51 0.68 1.50 0.00 -1.26 0.13 121.76 126.07 2djm s ALA 55 Ca 0.03 -0.87 -0.14 0.00 0.00 0.00 0.00 51.96 50.99 2djm s ALA 55 Cb -0.04 -3.00 0.01 0.00 0.00 0.00 0.00 23.12 20.09 2djm s ALA 55 CO -0.00 -1.09 1.10 0.00 0.00 0.00 0.00 175.76 175.76 2djm s ALA 56 N 2.42 2.44 0.03 0.00 0.00 0.23 -4.88 121.76 122.00 2djm s ALA 56 Ca 0.20 0.46 0.06 0.00 0.00 0.00 0.00 51.96 52.69 2djm s ALA 56 Cb -0.15 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.64 2djm s ALA 56 CO 0.12 -1.36 -0.15 0.45 0.00 0.00 0.00 175.76 174.82 2djm s SER 57 N -2.81 4.01 0.35 0.00 0.15 -0.39 -4.77 113.70 110.22 2djm s SER 57 Ca 0.65 -0.35 -0.27 0.00 0.70 0.00 0.00 55.95 56.68 2djm s SER 57 Cb -0.19 -0.73 -0.09 0.00 -1.71 0.00 0.00 66.02 63.29 2djm s SER 57 CO 0.45 0.26 1.17 -0.36 1.20 0.00 0.00 173.24 175.96 2djm s PHE 58 N -0.94 3.24 -0.14 3.44 0.40 -1.26 -0.06 117.98 122.65 2djm s PHE 58 Ca 0.15 1.58 -0.01 0.00 -0.60 0.00 0.00 56.93 58.05 2djm s PHE 58 Cb -0.11 -3.40 -0.09 0.00 0.51 0.00 0.00 43.02 39.93 2djm s PHE 58 CO 0.06 -1.14 -0.14 0.45 0.70 0.00 0.00 175.22 175.14 2djm n SER 59 N 0.57 2.48 0.00 1.36 2.88 0.37 -4.70 113.62 116.59 2djm n SER 59 Ca 0.02 -0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2djm n SER 59 Cb 0.45 -0.27 0.00 0.00 -0.75 0.00 0.00 64.21 63.64 2djm n SER 59 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2djm n GLY 60 N 2.65 1.86 3.77 0.46 0.00 -0.81 -5.02 105.19 108.10 2djm n GLY 60 Ca -0.26 -1.30 -0.39 0.00 0.00 0.00 0.00 46.02 44.07 2djm n GLY 60 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2djm s PRO 61 N -1.95 4.23 -1.16 1.61 0.02 -1.26 -0.90 135.00 135.58 2djm s PRO 61 Ca 0.00 1.86 -0.18 0.00 0.02 0.00 0.00 61.00 62.70 2djm s PRO 61 Cb 0.00 -2.83 0.10 0.00 0.02 0.00 0.00 34.50 31.78 2djm s PRO 61 CO 0.00 -0.17 1.51 0.42 -0.33 0.00 0.00 177.00 178.43 2djm s ILE 62 N -1.34 4.37 0.04 2.83 1.01 0.78 -4.87 121.20 124.03 2djm s ILE 62 Ca 0.53 -1.77 -0.35 0.00 0.00 0.00 0.00 60.65 59.07 2djm s ILE 62 Cb -0.32 -5.04 -0.14 0.00 0.01 0.00 0.00 42.46 36.98 2djm s ILE 62 CO 0.40 -1.84 1.64 -1.20 0.00 0.00 0.00 174.94 173.94 2djm n SER 63 N 7.60 2.90 0.00 3.58 7.64 -1.26 -0.95 113.62 133.13 2djm n SER 63 Ca 0.39 1.06 0.00 0.00 1.01 0.00 0.00 58.87 61.32 2djm n SER 63 Cb 0.47 -1.35 0.00 0.00 -1.01 0.00 0.00 64.21 62.32 2djm n SER 63 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2djm n GLY 64 N 3.61 1.71 3.41 0.23 0.00 -1.26 -5.06 105.19 107.83 2djm n GLY 64 Ca 0.20 -0.26 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 2djm n GLY 64 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2djm s SER 65 N -0.25 2.50 -0.91 1.61 0.01 -0.13 -5.05 113.70 111.48 2djm s SER 65 Ca 0.00 -1.23 -0.03 0.00 1.31 0.00 0.00 55.95 56.00 2djm s SER 65 Cb 0.00 -0.12 0.22 0.00 0.21 0.00 0.00 66.02 66.33 2djm s SER 65 CO 0.00 -0.43 2.24 0.59 0.41 0.00 0.00 173.24 176.05 2djm n ASN 66 N -0.57 7.36 -4.14 2.44 3.02 -1.26 -4.56 115.26 117.54 2djm n ASN 66 Ca -0.05 -3.48 -0.10 0.00 -0.03 0.00 0.00 54.58 50.92 2djm n ASN 66 Cb 0.64 -1.20 -0.10 0.00 -0.61 0.00 0.00 39.78 38.51 2djm n ASN 66 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2djm s TYR 67 N -2.89 0.77 0.47 3.10 1.51 -1.26 -4.48 117.35 114.57 2djm s TYR 67 Ca 0.51 -0.93 0.07 0.00 -1.01 0.00 0.00 57.07 55.71 2djm s TYR 67 Cb 0.30 -0.47 0.01 0.00 -0.11 0.00 0.00 41.96 41.69 2djm s TYR 67 CO -0.22 -0.21 0.42 -1.21 -1.11 0.00 0.00 175.55 173.23 2djm s GLU 68 N -3.70 2.41 -0.08 -0.62 8.01 0.11 -0.15 118.70 124.68 2djm s GLU 68 Ca 0.09 -1.71 -0.03 0.00 0.01 0.00 0.00 54.97 53.33 2djm s GLU 68 Cb 0.05 -2.31 0.05 0.00 -4.31 0.00 0.00 34.13 27.61 2djm s GLU 68 CO -0.06 -0.40 0.16 -0.47 0.01 0.00 0.00 175.26 174.51 2djm s TYR 69 N -2.59 -0.18 -0.02 1.61 5.04 -0.08 -2.72 117.35 118.40 2djm s TYR 69 Ca 0.45 0.61 0.05 0.00 -2.44 0.00 0.00 57.07 55.74 2djm s TYR 69 Cb -0.03 -0.24 -0.01 0.00 0.35 0.00 0.00 41.96 42.03 2djm s TYR 69 CO 0.27 -0.26 -0.16 -1.58 -1.34 0.00 0.00 175.55 172.48 2djm s TRP 70 N 2.20 1.44 -0.06 4.97 0.52 -0.58 -0.48 118.94 126.96 2djm s TRP 70 Ca 0.02 -0.31 0.04 0.00 0.02 0.00 0.00 56.10 55.87 2djm s TRP 70 Cb -0.12 -0.95 -0.00 0.00 -1.15 0.00 0.00 33.47 31.25 2djm s TRP 70 CO -0.06 -0.06 -0.19 0.95 0.02 0.00 0.00 176.95 177.61 2djm s THR 71 N -0.24 1.60 -0.03 2.01 -4.23 0.91 0.55 115.64 116.21 2djm s THR 71 Ca 0.03 -0.79 0.05 0.00 -1.18 0.00 0.00 61.69 59.80 2djm s THR 71 Cb -0.07 -1.39 -0.01 0.00 1.34 0.00 0.00 72.50 72.37 2djm s THR 71 CO 0.00 0.46 -0.18 0.72 -0.54 0.00 0.00 174.62 175.08 2djm s PHE 72 N 0.18 1.69 -0.02 3.99 -0.12 0.24 -1.26 117.98 122.68 2djm s PHE 72 Ca -0.09 -0.43 0.06 0.00 -0.05 0.00 0.00 56.93 56.42 2djm s PHE 72 Cb -0.14 -1.12 -0.01 0.00 -0.63 0.00 0.00 43.02 41.12 2djm s PHE 72 CO 0.04 -0.12 -0.18 -1.54 -0.05 0.00 0.00 175.22 173.37 2djm s SER 73 N -0.13 2.18 -0.21 1.98 1.04 -1.26 -1.11 113.70 116.19 2djm s SER 73 Ca 0.00 -0.34 -0.07 0.00 0.48 0.00 0.00 55.95 56.02 2djm s SER 73 Cb -0.10 -0.29 0.10 0.00 0.10 0.00 0.00 66.02 65.83 2djm s SER 73 CO 0.01 0.22 0.44 0.00 0.98 0.00 0.00 173.24 174.89 2djm s ALA 74 N -0.38 -1.26 -0.73 5.32 0.00 -0.44 -4.98 121.76 119.29 2djm s ALA 74 Ca 0.06 1.54 -0.25 0.00 0.00 0.00 0.00 51.96 53.31 2djm s ALA 74 Cb -0.08 -1.41 0.04 0.00 0.00 0.00 0.00 23.12 21.68 2djm s ALA 74 CO -0.00 -0.83 1.19 0.45 0.00 0.00 0.00 175.76 176.57 2djm s SER 75 N 2.64 6.19 -0.03 0.00 0.15 -1.26 0.25 113.70 121.64 2djm s SER 75 Ca -0.00 -0.68 -0.04 0.00 0.70 0.00 0.00 55.95 55.92 2djm s SER 75 Cb -0.12 -2.52 -0.04 0.00 -1.71 0.00 0.00 66.02 61.63 2djm s SER 75 CO -0.14 -1.69 0.19 0.68 1.20 0.00 0.00 173.24 173.48 2djm s VAL 76 N 5.16 5.42 -2.13 4.45 -7.23 -1.26 -4.97 120.40 119.84 2djm s VAL 76 Ca 0.32 -0.02 0.20 0.00 -1.81 0.00 0.00 61.98 60.66 2djm s VAL 76 Cb -0.10 -3.52 0.50 0.00 0.56 0.00 0.00 36.38 33.81 2djm s VAL 76 CO 0.12 0.39 1.44 2.29 -0.31 0.00 0.00 175.10 179.03 2djm n LYS 77 N 1.17 2.33 0.00 4.82 -0.00 -1.26 -4.57 118.16 120.66 2djm n LYS 77 Ca -0.13 -2.06 0.00 0.00 -0.00 0.00 0.00 58.31 56.13 2djm n LYS 77 Cb 0.53 -1.46 0.00 0.00 -0.00 0.00 0.00 35.03 34.10 2djm n LYS 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2djm n GLY 78 N 1.42 3.91 3.62 2.58 0.00 -1.26 -4.82 105.19 110.65 2djm n GLY 78 Ca 0.19 -0.53 -0.10 0.00 0.00 0.00 0.00 46.02 45.59 2djm n GLY 78 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2djm s ILE 79 N -1.58 0.00 0.00 -0.61 2.07 -1.26 -3.31 121.20 116.51 2djm s ILE 79 Ca 0.00 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.24 2djm s ILE 79 Cb 0.00 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.59 2djm s ILE 79 CO 0.00 0.00 0.00 0.29 -1.91 0.00 0.00 174.94 173.32 2djm n LYS 80 N 1.85 0.38 -4.13 3.50 4.76 0.14 -4.59 118.16 120.06 2djm n LYS 80 Ca -0.12 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.22 2djm n LYS 80 Cb 0.56 -0.86 -0.09 0.00 -1.84 0.00 0.00 35.03 32.80 2djm n LYS 80 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2djm s GLU 81 N -1.73 1.09 0.06 1.97 2.02 -1.14 0.20 118.70 121.17 2djm s GLU 81 Ca 0.00 -1.46 -0.28 0.00 0.02 0.00 0.00 54.97 53.25 2djm s GLU 81 Cb 0.00 0.28 0.10 0.00 0.10 0.00 0.00 34.13 34.61 2djm s GLU 81 CO 0.00 -0.35 1.15 -0.59 0.02 0.00 0.00 175.26 175.50 2djm s PHE 82 N -4.08 -0.07 -0.08 1.61 -0.71 -0.93 0.12 117.98 113.84 2djm s PHE 82 Ca 0.28 -0.12 -0.29 0.00 -1.04 0.00 0.00 56.93 55.76 2djm s PHE 82 Cb 0.06 0.59 0.07 0.00 -1.21 0.00 0.00 43.02 42.53 2djm s PHE 82 CO 0.06 -0.51 0.67 1.52 -1.34 0.00 0.00 175.22 175.61 2djm s TYR 83 N -2.75 -0.65 -0.02 3.49 1.13 -0.83 -1.96 117.35 115.77 2djm s TYR 83 Ca 0.14 1.20 -0.12 0.00 -1.41 0.00 0.00 57.07 56.88 2djm s TYR 83 Cb 0.02 0.37 -0.05 0.00 -1.10 0.00 0.00 41.96 41.20 2djm s TYR 83 CO -0.01 -0.57 0.34 0.42 -2.51 0.00 0.00 175.55 173.23 2djm s ILE 84 N -0.97 5.15 -0.37 -3.49 -1.09 -0.66 -2.75 121.20 117.02 2djm s ILE 84 Ca -0.10 0.63 -0.21 0.00 -2.23 0.00 0.00 60.65 58.75 2djm s ILE 84 Cb -0.01 -3.63 0.01 0.00 -1.58 0.00 0.00 42.46 37.24 2djm s ILE 84 CO 0.08 0.55 0.65 -0.54 -1.23 0.00 0.00 174.94 174.45 2djm s LYS 85 N -1.19 3.64 -0.63 2.79 1.02 0.78 -0.92 119.74 125.23 2djm s LYS 85 Ca 0.23 0.02 -0.20 0.00 0.02 0.00 0.00 55.97 56.04 2djm s LYS 85 Cb -0.15 -3.83 0.09 0.00 -0.52 0.00 0.00 37.83 33.42 2djm s LYS 85 CO 0.12 -0.78 0.82 -0.47 -0.92 0.00 0.00 175.35 174.12 2djm s TYR 86 N 2.75 2.87 -0.36 3.18 5.04 -0.58 -2.73 117.35 127.53 2djm s TYR 86 Ca 0.25 -0.81 -0.06 0.00 -2.44 0.00 0.00 57.07 54.00 2djm s TYR 86 Cb -0.14 -4.14 0.06 0.00 0.35 0.00 0.00 41.96 38.09 2djm s TYR 86 CO 0.16 -1.44 0.14 -2.00 -1.34 0.00 0.00 175.55 171.06 2djm s GLU 87 N 3.23 2.54 0.56 4.97 2.12 -0.86 0.31 118.70 131.57 2djm s GLU 87 Ca 0.16 -1.31 -0.05 0.00 0.36 0.00 0.00 54.97 54.13 2djm s GLU 87 Cb -0.21 -3.52 0.00 0.00 0.26 0.00 0.00 34.13 30.66 2djm s GLU 87 CO 0.07 -0.77 0.86 0.08 -0.54 0.00 0.00 175.26 174.96 2djm s VAL 88 N 1.37 3.88 0.34 3.70 1.01 0.70 0.29 120.40 131.69 2djm s VAL 88 Ca 0.00 -0.02 0.14 0.00 0.00 0.00 0.00 61.98 62.10 2djm s VAL 88 Cb -0.21 -3.52 0.34 0.00 0.00 0.00 0.00 36.38 32.99 2djm s VAL 88 CO 0.02 -0.51 1.64 0.28 0.00 0.00 0.00 175.10 176.52 2djm h SER 89 N -0.05 0.36 0.00 3.32 0.02 -1.94 -2.53 113.55 112.73 2djm h SER 89 Ca -0.46 0.21 -0.05 0.00 -0.84 0.00 0.00 61.79 60.65 2djm h SER 89 Cb 1.25 0.20 -0.12 0.00 0.14 0.00 0.00 62.40 63.87 2djm h SER 89 CO 0.60 -0.22 -0.60 0.61 -1.14 0.00 0.00 176.83 176.08 2djm n GLY 90 N -1.30 1.46 3.30 -3.77 0.00 -1.26 -5.09 105.19 98.52 2djm n GLY 90 Ca 0.32 -0.47 -0.16 0.00 0.00 0.00 0.00 46.02 45.71 2djm n GLY 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2djm s LYS 91 N -0.55 1.57 -0.13 1.61 -0.14 -0.96 -5.17 119.74 115.99 2djm s LYS 91 Ca 0.16 -1.81 -0.11 0.00 -1.36 0.00 0.00 55.97 52.86 2djm s LYS 91 Cb 0.17 0.33 0.03 0.00 -1.68 0.00 0.00 37.83 36.69 2djm s LYS 91 CO -0.05 -0.58 0.33 0.99 -0.76 0.00 0.00 175.35 175.28 2djm s THR 92 N -3.67 -0.00 0.00 2.17 2.01 -1.26 -0.22 115.64 114.67 2djm s THR 92 Ca 0.38 0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.39 2djm s THR 92 Cb 0.03 -0.47 0.00 0.00 0.01 0.00 0.00 72.50 72.08 2djm s THR 92 CO 0.20 0.01 0.00 -1.22 -0.69 0.00 0.00 174.62 172.92 2djm n TYR 93 N 3.06 -0.03 -3.78 4.92 4.01 0.15 -4.98 117.16 120.50 2djm n TYR 93 Ca -0.14 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.47 2djm n TYR 93 Cb 0.57 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.50 2djm n TYR 93 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2djm s TYR 94 N -2.12 -0.20 -0.52 -0.72 2.02 -1.26 -1.52 117.35 113.02 2djm s TYR 94 Ca 0.00 0.43 -0.08 0.00 -0.37 0.00 0.00 57.07 57.05 2djm s TYR 94 Cb 0.00 0.08 0.13 0.00 -0.40 0.00 0.00 41.96 41.77 2djm s TYR 94 CO 0.00 -0.27 0.38 0.34 -1.57 0.00 0.00 175.55 174.44 2djm s ASP 95 N -0.67 5.68 -0.05 2.29 2.15 -0.10 -4.90 116.67 121.06 2djm s ASP 95 Ca -0.08 -2.14 0.21 0.00 0.43 0.00 0.00 52.55 50.97 2djm s ASP 95 Cb -0.04 -1.99 0.37 0.00 -0.30 0.00 0.00 42.92 40.97 2djm s ASP 95 CO 0.02 -0.62 1.15 -0.46 -0.17 0.00 0.00 175.17 175.09 2djm n ASN 96 N 4.57 0.67 0.00 -0.34 0.23 -1.26 -1.66 115.26 117.47 2djm n ASN 96 Ca -0.03 -2.01 0.00 0.00 -0.53 0.00 0.00 54.58 52.01 2djm n ASN 96 Cb 0.41 -0.19 0.00 0.00 -2.08 0.00 0.00 39.78 37.92 2djm n ASN 96 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 2djm n ASN 97 N 0.16 0.00 -2.01 0.53 2.85 -1.26 -0.34 115.26 115.20 2djm n ASN 97 Ca -0.00 0.00 -0.01 0.00 -0.11 0.00 0.00 54.58 54.46 2djm n ASN 97 Cb 1.01 0.00 0.05 0.00 1.24 0.00 0.00 39.78 42.08 2djm n ASN 97 CO 0.00 0.00 0.00 -0.46 -2.11 0.00 0.00 177.26 174.69 2djm n ASN 98 N 1.58 -0.63 -3.00 1.20 6.94 -1.26 -4.90 115.26 115.18 2djm n ASN 98 Ca 0.00 -1.52 -0.16 0.00 -0.02 0.00 0.00 54.58 52.88 2djm n ASN 98 Cb 0.00 0.31 0.07 0.00 -2.36 0.00 0.00 39.78 37.80 2djm n ASN 98 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 2djm n SER 99 N -0.65 -3.25 -0.11 0.53 2.88 -0.77 -4.97 113.62 107.28 2djm n SER 99 Ca -0.08 -0.48 -0.15 0.00 -1.33 0.00 0.00 58.87 56.83 2djm n SER 99 Cb 0.66 -4.26 -0.11 0.00 -0.75 0.00 0.00 64.21 59.75 2djm n SER 99 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2djm n ALA 100 N -3.90 1.51 -1.65 -1.46 0.00 0.54 -5.11 120.51 110.44 2djm n ALA 100 Ca -0.15 -1.01 0.00 0.00 0.00 0.00 0.00 53.44 52.27 2djm n ALA 100 Cb 0.61 -0.05 0.00 0.00 0.00 0.00 0.00 19.45 20.01 2djm n ALA 100 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2djm n ASN 101 N -3.10 -6.52 -4.73 0.00 4.13 -1.18 -4.94 115.26 98.93 2djm n ASN 101 Ca -0.39 1.00 -0.41 0.00 1.68 0.00 0.00 54.58 56.46 2djm n ASN 101 Cb 0.96 -3.58 -0.04 0.00 -1.54 0.00 0.00 39.78 35.58 2djm n ASN 101 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 2djm s TYR 102 N -0.35 3.63 0.00 3.10 2.02 -0.83 -4.77 117.35 120.15 2djm s TYR 102 Ca 0.00 1.60 -0.30 0.00 -0.37 0.00 0.00 57.07 58.00 2djm s TYR 102 Cb 0.00 -3.22 -0.03 0.00 -0.40 0.00 0.00 41.96 38.30 2djm s TYR 102 CO 0.00 -0.45 1.01 -0.65 -1.57 0.00 0.00 175.55 173.90 2djm s GLN 103 N 0.28 4.53 0.10 -0.62 1.11 -1.26 -2.19 119.66 121.61 2djm s GLN 103 Ca 0.51 1.47 -0.30 0.00 0.01 0.00 0.00 55.36 57.05 2djm s GLN 103 Cb -0.26 -3.45 -0.06 0.00 -1.01 0.00 0.00 33.01 28.23 2djm s GLN 103 CO 0.31 -0.10 0.99 0.08 0.01 0.00 0.00 175.29 176.58 2djm s VAL 104 N 1.10 4.47 -1.26 1.09 1.01 0.13 -4.95 120.40 121.98 2djm s VAL 104 Ca 0.53 1.99 -0.18 0.00 0.00 0.00 0.00 61.98 64.32 2djm s VAL 104 Cb -0.22 -4.27 0.01 0.00 0.00 0.00 0.00 36.38 31.90 2djm s VAL 104 CO 0.27 0.28 1.90 -1.54 0.00 0.00 0.00 175.10 176.01 2djm n SER 105 N 2.96 4.14 -0.33 3.32 3.41 -1.26 -4.90 113.62 120.96 2djm n SER 105 Ca 0.03 -2.84 0.15 0.00 -0.26 0.00 0.00 58.87 55.95 2djm n SER 105 Cb 0.49 -1.67 0.66 0.00 -0.26 0.00 0.00 64.21 63.43 2djm n SER 105 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23