#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dne n SER 2 N 0.00 0.00 -4.54 1.61 2.88 -1.26 -4.97 113.62 107.33 2dne n SER 2 Ca 0.00 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.13 2dne n SER 2 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 2dne n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dne s SER 3 N 0.00 6.22 0.00 -3.46 0.01 -1.26 -4.81 113.70 110.40 2dne s SER 3 Ca 0.00 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 56.61 2dne s SER 3 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 2dne s SER 3 CO 0.00 -1.76 0.00 0.61 0.41 0.00 0.00 173.24 172.50 2dne n GLY 4 N 5.61 -0.74 2.02 3.44 0.00 -1.26 -5.06 105.19 109.21 2dne n GLY 4 Ca 0.07 -2.27 0.00 0.00 0.00 0.00 0.00 46.02 43.83 2dne n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dne n SER 5 N 0.00 -0.51 -2.85 1.61 7.64 -1.26 -4.97 113.62 113.28 2dne n SER 5 Ca 0.00 0.30 -0.10 0.00 1.01 0.00 0.00 58.87 60.08 2dne n SER 5 Cb 0.00 0.62 0.05 0.00 -1.01 0.00 0.00 64.21 63.86 2dne n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dne n SER 6 N -3.00 -5.78 -1.65 6.43 7.64 -1.26 -4.86 113.62 111.15 2dne n SER 6 Ca 0.00 -0.48 0.00 0.00 1.01 0.00 0.00 58.87 59.40 2dne n SER 6 Cb 0.00 -4.22 0.00 0.00 -1.01 0.00 0.00 64.21 58.98 2dne n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dne n GLY 7 N -1.34 4.43 2.82 0.23 0.00 -1.26 -4.52 105.19 105.55 2dne n GLY 7 Ca -0.05 -2.08 -0.17 0.00 0.00 0.00 0.00 46.02 43.73 2dne n GLY 7 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2dne s GLN 8 N -1.75 0.02 0.21 1.61 0.74 0.42 -4.92 119.66 115.98 2dne s GLN 8 Ca 0.00 0.48 -0.30 0.00 0.05 0.00 0.00 55.36 55.59 2dne s GLN 8 Cb 0.00 -0.30 -0.08 0.00 1.10 0.00 0.00 33.01 33.73 2dne s GLN 8 CO 0.00 -0.28 0.95 0.15 -0.55 0.00 0.00 175.29 175.56 2dne s LYS 9 N 2.02 4.81 -0.50 1.67 1.02 -1.26 0.21 119.74 127.72 2dne s LYS 9 Ca 0.01 1.49 -0.03 0.00 0.02 0.00 0.00 55.97 57.45 2dne s LYS 9 Cb -0.12 -3.30 0.13 0.00 -0.52 0.00 0.00 37.83 34.02 2dne s LYS 9 CO -0.05 0.43 0.31 0.08 -0.92 0.00 0.00 175.35 175.20 2dne s VAL 10 N -0.87 3.52 -0.02 3.17 1.01 0.38 -4.94 120.40 122.65 2dne s VAL 10 Ca 0.43 -2.38 -0.30 0.00 0.00 0.00 0.00 61.98 59.72 2dne s VAL 10 Cb -0.25 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 2dne s VAL 10 CO 0.32 -0.77 1.20 -2.16 0.00 0.00 0.00 175.10 173.69 2dne s PRO 11 N 0.69 4.38 -0.83 2.72 0.04 -1.26 0.17 135.00 140.91 2dne s PRO 11 Ca 0.11 1.70 -0.33 0.00 0.04 0.00 0.00 61.00 62.53 2dne s PRO 11 Cb -0.22 -3.50 -0.19 0.00 0.04 0.00 0.00 34.50 30.63 2dne s PRO 11 CO -0.04 -0.39 2.56 -0.11 0.04 0.00 0.00 177.00 179.06 2dne n LEU 12 N 4.81 0.69 -4.72 -3.56 7.94 -0.90 -4.58 117.00 116.67 2dne n LEU 12 Ca 0.10 0.19 -0.42 0.00 -1.11 0.00 0.00 56.01 54.78 2dne n LEU 12 Cb 0.46 -1.01 -0.03 0.00 0.53 0.00 0.00 43.42 43.37 2dne n LEU 12 CO 0.55 -0.83 0.83 -2.16 -1.11 0.00 0.00 177.39 174.68 2dne s PRO 13 N 8.31 4.50 -0.34 1.96 0.04 -1.26 -0.55 135.00 147.66 2dne s PRO 13 Ca 1.28 1.73 -0.28 0.00 0.04 0.00 0.00 61.00 63.76 2dne s PRO 13 Cb -1.15 -3.33 -0.02 0.00 0.04 0.00 0.00 34.50 30.04 2dne s PRO 13 CO 0.49 -0.12 1.89 -1.54 0.04 0.00 0.00 177.00 177.76 2dne s SER 14 N 0.61 5.73 -0.19 6.66 1.04 -1.26 -4.81 113.70 121.48 2dne s SER 14 Ca 0.55 1.31 0.06 0.00 0.48 0.00 0.00 55.95 58.35 2dne s SER 14 Cb -0.29 -2.52 0.46 0.00 0.10 0.00 0.00 66.02 63.77 2dne s SER 14 CO 0.31 -1.84 1.36 0.18 0.98 0.00 0.00 173.24 174.23 2dne n LEU 15 N 10.87 4.35 -3.74 2.42 4.77 -1.26 -4.88 117.00 129.53 2dne n LEU 15 Ca 0.24 -2.24 -0.09 0.00 -0.03 0.00 0.00 56.01 53.89 2dne n LEU 15 Cb 0.47 -0.65 -0.03 0.00 -2.33 0.00 0.00 43.42 40.89 2dne n LEU 15 CO 0.68 0.60 0.38 -0.55 -1.33 0.00 0.00 177.39 177.18 2dne s SER 16 N -0.43 -0.31 -0.07 -1.43 0.15 -1.26 -5.04 113.70 105.31 2dne s SER 16 Ca 0.33 -0.47 -0.18 0.00 0.70 0.00 0.00 55.95 56.33 2dne s SER 16 Cb 0.26 0.65 -0.14 0.00 -1.71 0.00 0.00 66.02 65.09 2dne s SER 16 CO 0.08 -1.18 0.68 1.55 1.20 0.00 0.00 173.24 175.58 2dne h PRO 17 N 2.07 -0.17 -1.05 5.44 0.13 -2.04 -3.29 132.00 133.08 2dne h PRO 17 Ca -0.25 0.01 -0.44 0.00 -0.87 0.00 0.00 66.00 64.45 2dne h PRO 17 Cb 1.27 0.04 -0.24 0.00 0.13 0.00 0.00 31.00 32.19 2dne h PRO 17 CO 0.31 0.24 0.56 0.25 -0.23 0.00 0.00 178.00 179.12 2dne n THR 18 N -4.88 2.87 -2.51 1.56 -2.24 -1.26 -4.92 114.28 102.91 2dne n THR 18 Ca -0.07 -1.72 -0.43 0.00 -2.27 0.00 0.00 64.05 59.56 2dne n THR 18 Cb 0.24 -0.73 -0.02 0.00 -2.10 0.00 0.00 70.33 67.72 2dne n THR 18 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 2dne s MET 19 N -2.70 3.69 -0.11 -0.78 0.00 -1.24 -4.82 119.30 113.34 2dne s MET 19 Ca 0.46 0.73 0.17 0.00 0.00 0.00 0.00 55.69 57.06 2dne s MET 19 Cb 0.38 -3.94 -0.26 0.00 0.00 0.00 0.00 34.83 31.02 2dne s MET 19 CO 0.07 -1.42 0.23 1.04 0.00 0.00 0.00 175.02 174.93 2dne n GLN 20 N 7.88 0.85 -3.56 4.11 6.02 -1.26 -4.85 117.38 126.56 2dne n GLN 20 Ca 0.14 -0.09 -0.13 0.00 -0.01 0.00 0.00 57.00 56.91 2dne n GLN 20 Cb 0.48 -1.46 -0.06 0.00 1.02 0.00 0.00 30.24 30.23 2dne n GLN 20 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2dne s ALA 21 N -2.85 -1.88 0.42 -1.58 0.00 -1.26 -3.11 121.76 111.50 2dne s ALA 21 Ca -0.08 1.52 0.04 0.00 0.00 0.00 0.00 51.96 53.44 2dne s ALA 21 Cb 0.09 -0.51 -0.01 0.00 0.00 0.00 0.00 23.12 22.68 2dne s ALA 21 CO 0.76 -0.33 0.13 0.41 0.00 0.00 0.00 175.76 176.74 2dne n GLY 22 N 0.89 3.26 2.82 0.00 0.00 0.53 -4.86 105.19 107.83 2dne n GLY 22 Ca -0.13 -2.14 -0.22 0.00 0.00 0.00 0.00 46.02 43.53 2dne n GLY 22 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dne s THR 23 N -3.07 0.46 -0.47 2.61 2.01 -1.16 -0.78 115.64 115.24 2dne s THR 23 Ca 0.19 0.01 -0.27 0.00 0.31 0.00 0.00 61.69 61.93 2dne s THR 23 Cb 0.01 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.92 2dne s THR 23 CO 0.13 0.25 2.05 -0.63 -0.69 0.00 0.00 174.62 175.73 2dne s ILE 24 N 1.56 3.24 0.01 1.82 -1.09 -1.12 -0.39 121.20 125.24 2dne s ILE 24 Ca -0.01 0.19 -0.26 0.00 -2.23 0.00 0.00 60.65 58.34 2dne s ILE 24 Cb -0.13 -3.50 -0.14 0.00 -1.58 0.00 0.00 42.46 37.11 2dne s ILE 24 CO -0.04 -0.44 1.11 0.00 -1.23 0.00 0.00 174.94 174.34 2dne h ALA 25 N 15.87 -0.97 -2.57 9.38 0.00 0.42 0.41 119.26 141.80 2dne h ALA 25 Ca -0.29 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.32 2dne h ALA 25 Cb 1.20 0.36 -0.17 0.00 0.00 0.00 0.00 17.79 19.18 2dne h ALA 25 CO 1.13 -0.91 -0.36 0.50 0.00 0.00 0.00 179.25 179.61 2dne s ARG 26 N -4.60 0.73 -1.14 0.00 3.52 -1.21 -4.14 118.95 112.10 2dne s ARG 26 Ca -0.13 -0.63 -0.09 0.00 -0.13 0.00 0.00 55.73 54.74 2dne s ARG 26 Cb 0.01 0.30 0.26 0.00 -1.56 0.00 0.00 34.95 33.96 2dne s ARG 26 CO 0.40 -0.22 1.27 0.91 -0.81 0.00 0.00 175.30 176.86 2dne n TRP 27 N 0.61 4.71 -0.53 5.12 5.03 -1.26 -1.88 117.44 129.24 2dne n TRP 27 Ca -0.18 -3.57 0.42 0.00 3.03 0.00 0.00 57.50 57.20 2dne n TRP 27 Cb 0.59 -1.77 0.69 0.00 -1.03 0.00 0.00 31.31 29.79 2dne n TRP 27 CO 0.00 0.00 0.00 -1.91 -0.03 0.00 0.00 177.69 175.75 2dne n GLU 28 N 3.19 -0.02 -4.45 -0.99 0.00 -1.02 -4.26 120.64 113.09 2dne n GLU 28 Ca 0.28 1.11 -0.23 0.00 0.00 0.00 0.00 57.16 58.32 2dne n GLU 28 Cb 0.39 -2.32 -0.10 0.00 0.00 0.00 0.00 31.44 29.40 2dne n GLU 28 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 2dne s LYS 29 N -4.99 1.64 0.39 5.31 -0.14 -0.86 -4.97 119.74 116.12 2dne s LYS 29 Ca -0.06 -1.75 0.04 0.00 -1.36 0.00 0.00 55.97 52.84 2dne s LYS 29 Cb 0.28 -1.69 -0.04 0.00 -1.68 0.00 0.00 37.83 34.69 2dne s LYS 29 CO 0.79 0.31 0.08 0.15 -0.76 0.00 0.00 175.35 175.93 2dne s LYS 30 N -3.52 1.85 0.09 1.68 -0.14 -1.26 -5.00 119.74 113.43 2dne s LYS 30 Ca 0.29 -2.09 -0.31 0.00 -1.36 0.00 0.00 55.97 52.50 2dne s LYS 30 Cb -0.04 -0.83 -0.09 0.00 -1.68 0.00 0.00 37.83 35.18 2dne s LYS 30 CO 0.14 -0.34 1.70 -1.21 -0.76 0.00 0.00 175.35 174.88 2dne s GLU 31 N -3.80 4.18 0.00 1.68 2.02 -1.26 -2.58 118.70 118.94 2dne s GLU 31 Ca 0.27 2.41 0.00 0.00 0.02 0.00 0.00 54.97 57.67 2dne s GLU 31 Cb 0.05 -3.59 0.00 0.00 0.10 0.00 0.00 34.13 30.69 2dne s GLU 31 CO 0.14 -0.76 0.00 0.41 0.02 0.00 0.00 175.26 175.06 2dne n GLY 32 N 4.06 0.84 3.07 -1.39 0.00 -1.06 -5.00 105.19 105.71 2dne n GLY 32 Ca 0.16 -0.57 -0.26 0.00 0.00 0.00 0.00 46.02 45.36 2dne n GLY 32 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dne s ASP 33 N -2.87 2.00 0.26 1.61 1.11 -1.06 -4.96 116.67 112.76 2dne s ASP 33 Ca 0.00 -0.34 -0.29 0.00 0.18 0.00 0.00 52.55 52.09 2dne s ASP 33 Cb 0.00 -0.87 -0.09 0.00 1.07 0.00 0.00 42.92 43.03 2dne s ASP 33 CO 0.00 0.07 1.28 -0.75 1.18 0.00 0.00 175.17 176.95 2dne s LYS 34 N 0.52 4.41 0.07 8.23 2.20 -1.26 -2.89 119.74 131.03 2dne s LYS 34 Ca -0.14 2.08 0.08 0.00 -0.36 0.00 0.00 55.97 57.63 2dne s LYS 34 Cb -0.15 -3.15 -0.03 0.00 -1.51 0.00 0.00 37.83 32.99 2dne s LYS 34 CO 0.04 -0.16 -0.21 0.42 -0.36 0.00 0.00 175.35 175.08 2dne s ILE 35 N -0.55 1.74 -0.05 5.43 1.01 0.32 -5.00 121.20 124.10 2dne s ILE 35 Ca 0.52 -1.39 0.04 0.00 0.00 0.00 0.00 60.65 59.82 2dne s ILE 35 Cb -0.37 -1.54 0.00 0.00 0.01 0.00 0.00 42.46 40.56 2dne s ILE 35 CO 0.44 0.09 -0.15 0.20 0.00 0.00 0.00 174.94 175.52 2dne s ASN 36 N -1.54 1.97 -0.37 3.58 -0.87 -1.26 -2.63 114.94 113.82 2dne s ASN 36 Ca 0.08 -0.32 -0.44 0.00 -1.57 0.00 0.00 52.86 50.60 2dne s ASN 36 Cb -0.09 -0.63 -0.19 0.00 -0.02 0.00 0.00 41.25 40.32 2dne s ASN 36 CO 0.03 0.12 1.55 1.21 -2.57 0.00 0.00 177.10 177.44 2dne n GLU 37 N 3.31 0.27 0.00 -0.60 0.00 -1.26 0.46 120.64 122.82 2dne n GLU 37 Ca -0.19 0.10 0.00 0.00 0.00 0.00 0.00 57.16 57.07 2dne n GLU 37 Cb 0.53 -1.64 0.00 0.00 0.00 0.00 0.00 31.44 30.33 2dne n GLU 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2dne n GLY 38 N 3.65 3.10 3.68 8.31 0.00 -1.04 -4.93 105.19 117.95 2dne n GLY 38 Ca 0.28 -0.96 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 2dne n GLY 38 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dne n ASP 39 N 0.72 2.64 -4.76 1.61 9.92 0.17 -4.22 116.55 122.63 2dne n ASP 39 Ca 0.00 1.18 -0.41 0.00 -0.53 0.00 0.00 54.79 55.03 2dne n ASP 39 Cb 0.00 -1.45 -0.02 0.00 -0.64 0.00 0.00 41.12 39.02 2dne n ASP 39 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 2dne s LEU 40 N -0.49 4.36 -0.21 0.64 2.96 -1.26 -0.70 118.68 123.99 2dne s LEU 40 Ca 0.60 2.85 0.02 0.00 -0.22 0.00 0.00 54.13 57.38 2dne s LEU 40 Cb -0.61 -3.64 -0.14 0.00 0.50 0.00 0.00 46.19 42.30 2dne s LEU 40 CO 0.57 -0.78 -0.17 -0.38 -1.32 0.00 0.00 176.35 174.27 2dne n ILE 41 N 1.62 1.19 -3.59 6.68 5.41 0.31 -4.57 119.36 126.42 2dne n ILE 41 Ca 0.05 -0.47 -0.07 0.00 1.00 0.00 0.00 62.75 63.26 2dne n ILE 41 Cb 0.39 -1.20 -0.04 0.00 -0.71 0.00 0.00 39.64 38.08 2dne n ILE 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2dne s ALA 42 N -2.42 -1.99 -0.07 -1.39 0.00 -1.09 -2.02 121.76 112.78 2dne s ALA 42 Ca -0.27 1.58 -0.02 0.00 0.00 0.00 0.00 51.96 53.25 2dne s ALA 42 Cb 0.07 -0.60 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 2dne s ALA 42 CO 0.49 -0.41 0.05 -1.21 0.00 0.00 0.00 175.76 174.68 2dne s GLU 43 N -1.66 3.07 0.05 0.00 2.02 -0.79 0.07 118.70 121.47 2dne s GLU 43 Ca 0.04 -0.39 0.08 0.00 0.02 0.00 0.00 54.97 54.72 2dne s GLU 43 Cb -0.01 -2.88 -0.03 0.00 0.10 0.00 0.00 34.13 31.32 2dne s GLU 43 CO -0.03 0.70 -0.22 0.08 0.02 0.00 0.00 175.26 175.81 2dne s VAL 44 N -1.00 1.74 -0.30 2.63 1.01 -0.07 0.11 120.40 124.52 2dne s VAL 44 Ca 0.16 -1.29 -0.11 0.00 0.00 0.00 0.00 61.98 60.75 2dne s VAL 44 Cb -0.12 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 2dne s VAL 44 CO 0.06 0.18 0.18 -1.61 0.00 0.00 0.00 175.10 173.91 2dne s GLU 45 N -1.32 3.66 0.40 2.72 2.02 0.48 0.15 118.70 126.81 2dne s GLU 45 Ca 0.08 -0.51 0.08 0.00 0.02 0.00 0.00 54.97 54.63 2dne s GLU 45 Cb -0.09 -3.63 -0.05 0.00 0.10 0.00 0.00 34.13 30.45 2dne s GLU 45 CO 0.02 -0.30 0.15 0.95 0.02 0.00 0.00 175.26 176.10 2dne s THR 46 N 1.70 2.37 0.45 3.63 -4.23 0.03 -3.01 115.64 116.58 2dne s THR 46 Ca 0.06 -1.75 0.32 0.00 -1.18 0.00 0.00 61.69 59.14 2dne s THR 46 Cb -0.16 -2.97 0.32 0.00 1.34 0.00 0.00 72.50 71.02 2dne s THR 46 CO 0.09 -0.04 1.97 -0.78 -0.54 0.00 0.00 174.62 175.32 2dne h ASP 47 N 1.50 0.00 0.00 3.99 1.82 -1.97 -0.57 116.42 121.19 2dne h ASP 47 Ca -0.43 0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.07 2dne h ASP 47 Cb 1.25 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.24 2dne h ASP 47 CO 0.70 0.00 -0.79 0.50 -1.61 0.00 0.00 179.24 178.04 2dne h LYS 48 N 0.00 0.01 0.00 0.28 3.64 -1.98 -3.51 116.57 115.01 2dne h LYS 48 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2dne h LYS 48 Cb 0.31 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 2dne h LYS 48 CO 0.00 1.01 0.00 0.00 -2.27 0.00 0.00 179.45 178.19 2dne n ALA 49 N -3.10 0.00 -2.48 5.00 0.00 -0.22 -5.10 120.51 114.61 2dne n ALA 49 Ca -0.24 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.78 2dne n ALA 49 Cb 0.61 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.04 2dne n ALA 49 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2dne s THR 50 N -2.50 4.19 0.40 0.00 2.01 -1.26 -0.79 115.64 117.68 2dne s THR 50 Ca 0.00 1.31 0.04 0.00 0.31 0.00 0.00 61.69 63.35 2dne s THR 50 Cb 0.00 -4.28 -0.00 0.00 0.01 0.00 0.00 72.50 68.23 2dne s THR 50 CO 0.00 -0.59 0.57 -0.69 -0.69 0.00 0.00 174.62 173.22 2dne s VAL 51 N 4.39 3.93 -0.25 3.82 1.01 0.40 -4.90 120.40 128.80 2dne s VAL 51 Ca 0.54 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.76 2dne s VAL 51 Cb -0.14 -3.40 0.06 0.00 0.00 0.00 0.00 36.38 32.90 2dne s VAL 51 CO 0.24 -0.21 -0.09 -0.83 0.00 0.00 0.00 175.10 174.21 2dne s GLY 52 N -4.21 1.50 -0.34 4.51 0.00 -1.26 -0.89 107.32 106.63 2dne s GLY 52 Ca 0.47 -1.58 -0.29 0.00 0.00 0.00 0.00 44.72 43.33 2dne s GLY 52 CO 0.34 0.72 1.06 -0.12 0.00 0.00 0.00 173.10 175.10 2dne s PHE 53 N 1.22 3.12 0.42 1.90 5.36 0.11 -4.95 117.98 125.16 2dne s PHE 53 Ca -0.07 1.11 -0.01 0.00 -0.96 0.00 0.00 56.93 57.00 2dne s PHE 53 Cb -0.19 -3.74 -0.02 0.00 -0.34 0.00 0.00 43.02 38.72 2dne s PHE 53 CO -0.06 -0.81 0.65 -1.21 -1.46 0.00 0.00 175.22 172.33 2dne s GLU 54 N 3.70 3.36 0.52 10.12 2.02 -1.26 0.11 118.70 137.27 2dne s GLU 54 Ca 0.45 -0.23 -0.20 0.00 0.02 0.00 0.00 54.97 55.01 2dne s GLU 54 Cb -0.12 -2.55 -0.07 0.00 0.10 0.00 0.00 34.13 31.50 2dne s GLU 54 CO 0.17 -0.09 1.09 0.45 0.02 0.00 0.00 175.26 176.91 2dne s SER 55 N -4.11 5.96 0.05 -0.19 0.15 0.12 -4.73 113.70 110.94 2dne s SER 55 Ca 0.45 2.07 0.23 0.00 0.70 0.00 0.00 55.95 59.39 2dne s SER 55 Cb -0.10 -2.57 0.07 0.00 -1.71 0.00 0.00 66.02 61.71 2dne s SER 55 CO 0.39 -1.05 1.05 0.18 1.20 0.00 0.00 173.24 175.02 2dne n LEU 56 N -1.19 0.62 -3.60 3.45 4.77 -1.26 -2.51 117.00 117.28 2dne n LEU 56 Ca 0.11 -0.04 0.01 0.00 -0.03 0.00 0.00 56.01 56.06 2dne n LEU 56 Cb 0.52 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.50 2dne n LEU 56 CO 0.41 0.06 1.10 -1.83 -1.33 0.00 0.00 177.39 175.80 2dne s GLU 57 N -3.17 0.28 0.11 3.23 -1.05 -1.26 -4.91 118.70 111.93 2dne s GLU 57 Ca 0.04 -0.15 -0.31 0.00 -0.15 0.00 0.00 54.97 54.40 2dne s GLU 57 Cb 0.15 0.10 -0.08 0.00 -0.44 0.00 0.00 34.13 33.86 2dne s GLU 57 CO 0.80 -0.13 1.39 -2.00 0.95 0.00 0.00 175.26 176.27 2dne s GLU 58 N -2.32 4.32 -0.01 -4.83 2.12 -1.26 -4.11 118.70 112.60 2dne s GLU 58 Ca 0.14 2.08 -0.29 0.00 0.36 0.00 0.00 54.97 57.26 2dne s GLU 58 Cb 0.04 -3.26 0.10 0.00 0.26 0.00 0.00 34.13 31.28 2dne s GLU 58 CO -0.05 -0.45 1.28 0.00 -0.54 0.00 0.00 175.26 175.51 2dne s TYR 60 N -2.13 2.12 -0.04 0.00 2.02 -1.02 -0.53 117.35 117.78 2dne s TYR 60 Ca 0.25 -0.40 -0.29 0.00 -0.37 0.00 0.00 57.07 56.26 2dne s TYR 60 Cb 0.01 -1.21 -0.07 0.00 -0.40 0.00 0.00 41.96 40.29 2dne s TYR 60 CO -0.01 0.21 1.97 1.41 -1.57 0.00 0.00 175.55 177.56 2dne s MET 61 N -1.65 3.91 -0.16 -0.62 1.75 -1.14 -0.95 119.30 120.44 2dne s MET 61 Ca 0.11 2.40 -0.16 0.00 -1.25 0.00 0.00 55.69 56.78 2dne s MET 61 Cb -0.10 -4.18 -0.13 0.00 2.84 0.00 0.00 34.83 33.26 2dne s MET 61 CO 0.04 -1.21 0.20 0.00 -0.65 0.00 0.00 175.02 173.40 2dne h ALA 62 N 11.45 0.09 -2.29 4.11 0.00 0.11 -2.80 119.26 129.94 2dne h ALA 62 Ca -0.46 -0.67 -0.09 0.00 0.00 0.00 0.00 54.91 53.69 2dne h ALA 62 Cb 1.23 0.39 -0.20 0.00 0.00 0.00 0.00 17.79 19.21 2dne h ALA 62 CO 0.95 0.38 -0.06 0.21 0.00 0.00 0.00 179.25 180.73 2dne s LYS 63 N -2.16 0.83 -0.68 0.00 2.47 -1.06 -4.22 119.74 114.92 2dne s LYS 63 Ca -0.18 0.05 0.02 0.00 -1.56 0.00 0.00 55.97 54.29 2dne s LYS 63 Cb 0.02 0.38 0.17 0.00 -1.46 0.00 0.00 37.83 36.94 2dne s LYS 63 CO 0.42 -0.24 0.49 0.42 0.16 0.00 0.00 175.35 176.59 2dne s ILE 64 N -1.19 3.30 0.12 5.43 1.01 -1.26 0.19 121.20 128.80 2dne s ILE 64 Ca -0.12 -3.69 -0.30 0.00 0.00 0.00 0.00 60.65 56.54 2dne s ILE 64 Cb -0.03 -3.16 -0.09 0.00 0.01 0.00 0.00 42.46 39.20 2dne s ILE 64 CO 0.07 -0.95 1.58 -0.07 0.00 0.00 0.00 174.94 175.57 2dne h LEU 65 N 6.13 -1.28 -9.47 2.97 3.38 -1.79 -3.39 115.31 111.85 2dne h LEU 65 Ca 0.06 0.15 -0.54 0.00 0.09 0.00 0.00 57.88 57.64 2dne h LEU 65 Cb 0.84 0.50 -0.04 0.00 0.09 0.00 0.00 40.66 42.05 2dne h LEU 65 CO 0.74 -0.47 0.20 -0.69 0.09 0.00 0.00 178.44 178.31 2dne s VAL 66 N -5.89 4.81 0.00 1.22 1.01 -0.79 -5.03 120.40 115.73 2dne s VAL 66 Ca -0.16 1.71 0.00 0.00 0.00 0.00 0.00 61.98 63.53 2dne s VAL 66 Cb 0.08 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 32.30 2dne s VAL 66 CO 0.63 0.29 0.00 0.00 0.00 0.00 0.00 175.10 176.03 2dne n ALA 67 N 3.25 0.00 -2.79 5.51 0.00 -1.26 -4.89 120.51 120.33 2dne n ALA 67 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 2dne n ALA 67 Cb 0.51 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.88 2dne n ALA 67 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2dne s GLU 68 N 0.72 3.85 0.00 0.00 2.02 -1.26 -4.11 118.70 119.92 2dne s GLU 68 Ca 0.00 -0.19 0.00 0.00 0.02 0.00 0.00 54.97 54.80 2dne s GLU 68 Cb 0.00 -3.30 0.00 0.00 0.10 0.00 0.00 34.13 30.93 2dne s GLU 68 CO 0.00 0.50 0.00 0.41 0.02 0.00 0.00 175.26 176.19 2dne n GLY 69 N 2.87 0.84 3.54 -1.39 0.00 0.14 -4.97 105.19 106.22 2dne n GLY 69 Ca -0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 2dne n GLY 69 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2dne n THR 70 N -2.00 0.02 -3.54 2.61 -1.04 -1.25 -4.78 114.28 104.30 2dne n THR 70 Ca 0.00 -0.58 -0.33 0.00 -2.04 0.00 0.00 64.05 61.10 2dne n THR 70 Cb 0.00 -2.33 -0.05 0.00 -1.82 0.00 0.00 70.33 66.12 2dne n THR 70 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2dne s ARG 71 N 7.84 3.74 0.00 -2.82 0.52 -1.26 -2.80 118.95 124.18 2dne s ARG 71 Ca 1.05 0.14 0.00 0.00 -0.52 0.00 0.00 55.73 56.40 2dne s ARG 71 Cb -0.42 -2.84 0.00 0.00 0.52 0.00 0.00 34.95 32.21 2dne s ARG 71 CO 0.33 0.45 0.00 -3.47 0.02 0.00 0.00 175.30 172.63 2dne n ASP 72 N 0.32 -1.60 -4.56 0.23 -0.08 -1.24 -5.03 116.55 104.58 2dne n ASP 72 Ca -0.03 0.00 -0.42 0.00 -1.51 0.00 0.00 54.79 52.83 2dne n ASP 72 Cb 0.52 -0.40 -0.07 0.00 2.34 0.00 0.00 41.12 43.51 2dne n ASP 72 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2dne s VAL 73 N -2.78 4.90 0.78 5.18 1.01 0.04 -4.92 120.40 124.61 2dne s VAL 73 Ca 0.00 0.48 -0.11 0.00 0.00 0.00 0.00 61.98 62.35 2dne s VAL 73 Cb 0.00 -4.07 0.06 0.00 0.00 0.00 0.00 36.38 32.37 2dne s VAL 73 CO 0.00 -0.33 1.09 -2.16 0.00 0.00 0.00 175.10 173.70 2dne s PRO 74 N 2.67 2.23 0.04 2.72 0.04 -1.26 0.20 135.00 141.63 2dne s PRO 74 Ca 0.23 0.69 -0.30 0.00 0.04 0.00 0.00 61.00 61.66 2dne s PRO 74 Cb -0.15 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 2dne s PRO 74 CO 0.15 -1.53 0.98 0.42 0.04 0.00 0.00 177.00 177.06 2dne s ILE 75 N -3.14 4.70 0.00 0.56 -1.09 -1.18 -3.02 121.20 118.03 2dne s ILE 75 Ca 0.60 2.04 0.00 0.00 -2.23 0.00 0.00 60.65 61.06 2dne s ILE 75 Cb -0.14 -4.31 0.00 0.00 -1.58 0.00 0.00 42.46 36.43 2dne s ILE 75 CO 0.54 0.22 0.00 0.61 -1.23 0.00 0.00 174.94 175.08 2dne n GLY 76 N 2.67 1.93 3.60 6.18 0.00 0.28 -4.90 105.19 114.95 2dne n GLY 76 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 2dne n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dne s ALA 77 N -2.44 2.90 -0.07 4.61 0.00 -1.17 -4.04 121.76 121.56 2dne s ALA 77 Ca 0.00 0.09 -0.41 0.00 0.00 0.00 0.00 51.96 51.64 2dne s ALA 77 Cb 0.00 -4.00 -0.19 0.00 0.00 0.00 0.00 23.12 18.92 2dne s ALA 77 CO 0.00 -2.60 1.21 -0.89 0.00 0.00 0.00 175.76 173.48 2dne n ILE 78 N 7.30 0.01 -0.10 0.00 2.08 -1.26 -2.13 119.36 125.26 2dne n ILE 78 Ca 0.21 -0.00 -0.10 0.00 0.56 0.00 0.00 62.75 63.41 2dne n ILE 78 Cb 0.47 -0.23 -0.15 0.00 -0.75 0.00 0.00 39.64 38.99 2dne n ILE 78 CO 0.00 0.00 0.00 2.30 0.56 0.00 0.00 176.55 179.41 2dne n ILE 79 N 2.12 1.32 -3.76 1.39 -5.35 0.13 -4.39 119.36 110.81 2dne n ILE 79 Ca 0.22 -0.80 -0.02 0.00 -0.27 0.00 0.00 62.75 61.88 2dne n ILE 79 Cb 0.08 -0.54 -0.00 0.00 -1.74 0.00 0.00 39.64 37.43 2dne n ILE 79 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2dne s ILE 81 N -2.70 1.92 0.07 0.00 1.01 0.50 -0.47 121.20 121.53 2dne s ILE 81 Ca 0.16 -1.96 0.05 0.00 0.00 0.00 0.00 60.65 58.90 2dne s ILE 81 Cb 0.00 -1.91 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 2dne s ILE 81 CO 0.01 -0.29 -0.13 0.42 0.00 0.00 0.00 174.94 174.95 2dne s THR 82 N -2.02 1.03 0.07 2.92 -4.23 0.13 0.15 115.64 113.69 2dne s THR 82 Ca 0.17 -1.34 0.01 0.00 -1.18 0.00 0.00 61.69 59.35 2dne s THR 82 Cb -0.06 -1.07 -0.00 0.00 1.34 0.00 0.00 72.50 72.71 2dne s THR 82 CO 0.07 -0.30 0.02 1.33 -0.54 0.00 0.00 174.62 175.21 2dne n VAL 83 N 1.17 0.00 -0.03 2.29 0.24 -0.13 0.16 118.33 122.03 2dne n VAL 83 Ca -0.20 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 61.70 2dne n VAL 83 Cb 0.55 0.14 -0.08 0.00 -1.47 0.00 0.00 33.84 32.98 2dne n VAL 83 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dne n GLY 84 N 1.89 -0.51 3.26 7.63 0.00 -1.26 -2.42 105.19 113.78 2dne n GLY 84 Ca -0.01 -0.22 -0.20 0.00 0.00 0.00 0.00 46.02 45.60 2dne n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dne s LYS 85 N -2.50 1.08 0.28 1.61 1.02 -1.26 -4.84 119.74 115.13 2dne s LYS 85 Ca -0.05 -1.25 0.26 0.00 0.02 0.00 0.00 55.97 54.95 2dne s LYS 85 Cb 0.05 -1.06 0.90 0.00 -0.52 0.00 0.00 37.83 37.19 2dne s LYS 85 CO 0.44 0.22 1.76 -1.00 -0.92 0.00 0.00 175.35 175.84 2dne h PRO 86 N 3.57 0.00 -0.08 -1.68 0.13 -1.98 -3.01 132.00 128.95 2dne h PRO 86 Ca -0.41 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.52 2dne h PRO 86 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 2dne h PRO 86 CO 0.49 0.00 -0.78 0.93 -0.23 0.00 0.00 178.00 178.41 2dne h GLU 87 N 0.00 0.48 0.00 0.86 4.39 -2.02 -2.81 114.58 115.48 2dne h GLU 87 Ca 0.00 -0.41 0.00 0.00 0.34 0.00 0.00 59.36 59.29 2dne h GLU 87 Cb 0.58 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 2dne h GLU 87 CO 0.00 1.05 0.00 -0.44 -1.16 0.00 0.00 179.01 178.46 2dne h ASP 88 N 0.31 0.00 0.28 1.42 3.32 -1.86 -3.03 116.42 116.87 2dne h ASP 88 Ca -0.04 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 2dne h ASP 88 Cb 1.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.93 2dne h ASP 88 CO 0.14 0.00 -0.14 0.40 -1.72 0.00 0.00 179.24 177.92 2dne h ILE 89 N 0.00 0.76 -1.04 0.35 2.04 -1.54 -1.95 117.51 116.13 2dne h ILE 89 Ca 0.00 -0.43 0.29 0.00 1.00 0.00 0.00 64.86 65.72 2dne h ILE 89 Cb 0.50 0.99 -0.05 0.00 -0.74 0.00 0.00 36.82 37.52 2dne h ILE 89 CO 0.00 0.09 0.73 -0.08 0.00 0.00 0.00 178.15 178.89 2dne h GLU 90 N -0.61 0.07 -0.04 2.37 4.81 -1.57 1.67 114.58 121.27 2dne h GLU 90 Ca -0.04 -0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.01 2dne h GLU 90 Cb 0.44 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 2dne h GLU 90 CO 0.06 0.05 -0.74 0.00 -0.73 0.00 0.00 179.01 177.65 2dne h ALA 91 N 1.50 0.67 0.00 2.92 0.00 -1.51 -3.07 119.26 119.78 2dne h ALA 91 Ca 0.51 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2dne h ALA 91 Cb 1.89 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.60 2dne h ALA 91 CO -0.05 0.81 -0.74 0.74 0.00 0.00 0.00 179.25 180.01 2dne h PHE 92 N 0.16 0.00 -1.36 0.00 0.04 0.24 -3.33 116.94 112.70 2dne h PHE 92 Ca -0.03 0.00 0.39 0.00 2.80 0.00 0.00 57.97 61.14 2dne h PHE 92 Cb 1.31 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 39.40 2dne h PHE 92 CO 0.03 0.00 0.97 -0.22 -0.60 0.00 0.00 178.31 178.49 2dne h LYS 93 N 0.00 0.02 -2.36 1.51 3.64 0.19 -1.22 116.57 118.36 2dne h LYS 93 Ca 0.00 -0.00 -0.60 0.00 -1.27 0.00 0.00 60.65 58.77 2dne h LYS 93 Cb 0.99 -0.00 -0.42 0.00 -0.41 0.00 0.00 32.23 32.38 2dne h LYS 93 CO 0.00 0.01 -0.58 0.09 -2.27 0.00 0.00 179.45 176.70 2dne n ASN 94 N -4.16 3.66 -4.49 4.20 4.13 -1.25 -5.06 115.26 112.29 2dne n ASN 94 Ca 0.30 -3.41 -0.25 0.00 1.68 0.00 0.00 54.58 52.90 2dne n ASN 94 Cb 1.40 -0.69 -0.10 0.00 -1.54 0.00 0.00 39.78 38.85 2dne n ASN 94 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 2dne s TYR 95 N -2.31 2.39 0.19 3.10 6.14 -0.46 -5.06 117.35 121.34 2dne s TYR 95 Ca 0.37 -0.31 -0.07 0.00 0.64 0.00 0.00 57.07 57.70 2dne s TYR 95 Cb 0.11 -1.12 -0.02 0.00 0.42 0.00 0.00 41.96 41.36 2dne s TYR 95 CO -0.04 0.59 0.26 0.95 0.64 0.00 0.00 175.55 177.95 2dne s THR 96 N -2.03 0.04 -1.19 4.34 -4.23 -1.26 -5.08 115.64 106.22 2dne s THR 96 Ca 0.26 -1.62 -0.12 0.00 -1.18 0.00 0.00 61.69 59.03 2dne s THR 96 Cb -0.07 -2.11 0.20 0.00 1.34 0.00 0.00 72.50 71.86 2dne s THR 96 CO 0.14 -0.18 1.40 0.18 -0.54 0.00 0.00 174.62 175.62 2dne n LEU 97 N -0.25 5.42 -3.73 4.79 4.32 -1.26 -4.92 117.00 121.37 2dne n LEU 97 Ca -0.03 -4.62 -0.12 0.00 -0.02 0.00 0.00 56.01 51.22 2dne n LEU 97 Cb 0.64 -1.57 -0.12 0.00 -1.62 0.00 0.00 43.42 40.75 2dne n LEU 97 CO 0.27 0.93 -0.06 -0.62 -1.22 0.00 0.00 177.39 176.69 2dne s ASP 98 N 2.24 -0.33 -0.13 -1.43 2.15 -1.26 -5.06 116.67 112.85 2dne s ASP 98 Ca 0.40 0.63 -0.10 0.00 0.43 0.00 0.00 52.55 53.91 2dne s ASP 98 Cb -0.03 0.55 -0.06 0.00 -0.30 0.00 0.00 42.92 43.08 2dne s ASP 98 CO -0.01 -0.15 -0.22 -1.20 -0.17 0.00 0.00 175.17 173.42 2dne n SER 99 N 3.82 1.39 -3.60 -0.34 7.64 -1.26 -5.09 113.62 116.18 2dne n SER 99 Ca -0.21 0.23 -0.12 0.00 1.01 0.00 0.00 58.87 59.79 2dne n SER 99 Cb 0.55 -0.54 -0.06 0.00 -1.01 0.00 0.00 64.21 63.15 2dne n SER 99 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dne s SER 100 N -6.30 -0.50 0.07 6.43 0.01 -1.26 -5.04 113.70 107.10 2dne s SER 100 Ca -0.22 0.81 -0.30 0.00 1.31 0.00 0.00 55.95 57.56 2dne s SER 100 Cb 0.06 0.77 -0.15 0.00 0.21 0.00 0.00 66.02 66.92 2dne s SER 100 CO 0.29 -0.28 1.46 0.00 0.41 0.00 0.00 173.24 175.12 2dne h ALA 101 N 3.72 -1.13 0.00 1.44 0.00 -2.01 -3.39 119.26 117.89 2dne h ALA 101 Ca -0.25 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2dne h ALA 101 Cb 1.16 0.61 0.00 0.00 0.00 0.00 0.00 17.79 19.56 2dne h ALA 101 CO 0.19 -1.13 -0.96 0.00 0.00 0.00 0.00 179.25 177.35 2dne n ALA 102 N -2.68 0.89 0.10 0.00 0.00 -1.26 -5.06 120.51 112.49 2dne n ALA 102 Ca -0.11 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.54 2dne n ALA 102 Cb 0.39 0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.88 2dne n ALA 102 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2dne n SER 103 N -4.39 -1.79 0.00 0.00 2.88 -1.26 -5.15 113.62 103.91 2dne n SER 103 Ca -0.13 0.59 0.00 0.00 -1.33 0.00 0.00 58.87 58.00 2dne n SER 103 Cb 0.50 1.90 0.00 0.00 -0.75 0.00 0.00 64.21 65.86 2dne n SER 103 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dne n GLY 104 N -1.24 1.54 3.82 0.46 0.00 -1.26 -4.65 105.19 103.85 2dne n GLY 104 Ca 0.00 -0.48 -0.31 0.00 0.00 0.00 0.00 46.02 45.23 2dne n GLY 104 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dne s PRO 105 N 0.00 3.04 0.00 1.61 0.04 -1.26 -5.05 135.00 133.37 2dne s PRO 105 Ca 0.00 1.01 0.00 0.00 0.04 0.00 0.00 61.00 62.05 2dne s PRO 105 Cb 0.00 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.54 2dne s PRO 105 CO 0.00 -1.02 0.00 0.45 0.04 0.00 0.00 177.00 176.47 2dne n SER 106 N -2.87 0.00 0.32 6.66 2.88 -1.26 -4.99 113.62 114.36 2dne n SER 106 Ca 0.08 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.47 2dne n SER 106 Cb 0.53 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.92 2dne n SER 106 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2dne h SER 107 N 0.00 -0.70 0.00 -3.46 0.02 -2.00 -3.56 113.55 103.85 2dne h SER 107 Ca 0.00 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2dne h SER 107 Cb 0.00 0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.72 2dne h SER 107 CO 0.00 -0.34 0.00 0.61 -1.14 0.00 0.00 176.83 175.96