#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 -5.59 -3.40 1.61 2.88 -1.26 -4.96 113.62 102.89 2dne n SER 2 Ca 0.00 -0.07 -0.23 0.00 -1.33 0.00 0.00 58.87 57.23 2dne n SER 2 Cb 0.00 -1.57 -0.10 0.00 -0.75 0.00 0.00 64.21 61.79 2dne n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dne s SER 3 N -1.36 2.03 0.00 -3.46 1.04 -1.26 -5.10 113.70 105.59 2dne s SER 3 Ca 0.32 -1.99 0.00 0.00 0.48 0.00 0.00 55.95 54.77 2dne s SER 3 Cb -0.03 0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.13 2dne s SER 3 CO 0.73 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 175.28 2dne n GLY 4 N 4.03 3.36 0.17 7.32 0.00 -1.26 -4.90 105.19 113.91 2dne n GLY 4 Ca 0.13 -1.87 -0.10 0.00 0.00 0.00 0.00 46.02 44.18 2dne n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dne h SER 5 N 0.00 -0.38 -2.50 1.61 0.02 -2.03 -3.48 113.55 106.79 2dne h SER 5 Ca 0.00 0.06 0.07 0.00 -0.84 0.00 0.00 61.79 61.08 2dne h SER 5 Cb 0.00 0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.69 2dne h SER 5 CO 0.00 -0.18 -0.09 -1.20 -1.14 0.00 0.00 176.83 174.23 2dne n SER 6 N -5.26 -4.19 -2.95 3.07 7.64 -1.26 -4.77 113.62 105.90 2dne n SER 6 Ca -0.05 0.26 -0.15 0.00 1.01 0.00 0.00 58.87 59.95 2dne n SER 6 Cb 0.18 -0.73 -0.04 0.00 -1.01 0.00 0.00 64.21 62.62 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 -0.80 3.68 2.84 0.23 0.00 -1.26 -4.37 105.19 105.51 2dne n GLY 7 Ca 0.00 -2.09 -0.16 0.00 0.00 0.00 0.00 46.02 43.77 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 -2.89 0.04 0.17 1.61 0.74 0.49 -4.91 119.66 114.91 2dne s GLN 8 Ca 0.09 0.51 -0.30 0.00 0.05 0.00 0.00 55.36 55.71 2dne s GLN 8 Cb 0.00 -0.27 -0.07 0.00 1.10 0.00 0.00 33.01 33.77 2dne s GLN 8 CO 0.06 -0.28 0.98 0.15 -0.55 0.00 0.00 175.29 175.65 2dne s LYS 9 N 2.06 4.74 -0.47 1.67 1.02 -1.26 0.51 119.74 128.01 2dne s LYS 9 Ca 0.01 1.52 -0.04 0.00 0.02 0.00 0.00 55.97 57.47 2dne s LYS 9 Cb -0.12 -3.32 0.12 0.00 -0.52 0.00 0.00 37.83 33.99 2dne s LYS 9 CO -0.06 0.30 0.29 0.08 -0.92 0.00 0.00 175.35 175.04 2dne s VAL 10 N -0.50 3.56 0.08 3.17 1.01 0.29 -4.94 120.40 123.06 2dne s VAL 10 Ca 0.45 -2.22 -0.30 0.00 0.00 0.00 0.00 61.98 59.91 2dne s VAL 10 Cb -0.25 -3.39 -0.06 0.00 0.00 0.00 0.00 36.38 32.68 2dne s VAL 10 CO 0.32 -0.75 1.16 -2.16 0.00 0.00 0.00 175.10 173.67 2dne s PRO 11 N 0.90 4.47 -0.66 2.72 0.04 -1.26 -0.56 135.00 140.66 2dne s PRO 11 Ca 0.10 1.73 -0.34 0.00 0.04 0.00 0.00 61.00 62.53 2dne s PRO 11 Cb -0.23 -3.34 -0.16 0.00 0.04 0.00 0.00 34.50 30.81 2dne s PRO 11 CO -0.04 -0.18 2.42 -0.11 0.04 0.00 0.00 177.00 179.14 2dne n LEU 12 N 3.63 1.19 -4.78 -3.56 7.94 -1.16 -4.66 117.00 115.59 2dne n LEU 12 Ca 0.07 0.20 -0.37 0.00 -1.11 0.00 0.00 56.01 54.81 2dne n LEU 12 Cb 0.47 -1.12 -0.04 0.00 0.53 0.00 0.00 43.42 43.26 2dne n LEU 12 CO 0.55 -0.89 0.74 -2.16 -1.11 0.00 0.00 177.39 174.52 2dne s PRO 13 N 7.64 4.20 -0.28 1.96 0.04 -1.26 -1.77 135.00 145.52 2dne s PRO 13 Ca 1.20 1.54 -0.28 0.00 0.04 0.00 0.00 61.00 63.50 2dne s PRO 13 Cb -1.01 -2.59 -0.03 0.00 0.04 0.00 0.00 34.50 30.91 2dne s PRO 13 CO 0.48 -0.12 1.97 -1.54 0.04 0.00 0.00 177.00 177.83 2dne s SER 14 N -1.50 5.73 -0.07 6.66 1.04 -1.26 -4.80 113.70 119.49 2dne s SER 14 Ca 0.57 1.56 0.17 0.00 0.48 0.00 0.00 55.95 58.73 2dne s SER 14 Cb -0.23 -2.52 0.61 0.00 0.10 0.00 0.00 66.02 63.98 2dne s SER 14 CO 0.29 -1.80 1.50 0.18 0.98 0.00 0.00 173.24 174.39 2dne n LEU 15 N 10.80 3.95 -3.94 2.42 4.77 -1.26 -4.93 117.00 128.81 2dne n LEU 15 Ca 0.26 -1.99 -0.08 0.00 -0.03 0.00 0.00 56.01 54.17 2dne n LEU 15 Cb 0.46 -0.50 -0.04 0.00 -2.33 0.00 0.00 43.42 41.01 2dne n LEU 15 CO 0.67 0.75 0.31 -0.55 -1.33 0.00 0.00 177.39 177.24 2dne s SER 16 N -0.88 -0.16 -0.03 -1.43 0.15 -1.26 -5.05 113.70 105.03 2dne s SER 16 Ca 0.44 -0.79 -0.05 0.00 0.70 0.00 0.00 55.95 56.24 2dne s SER 16 Cb 0.27 0.65 -0.03 0.00 -1.71 0.00 0.00 66.02 65.20 2dne s SER 16 CO 0.23 -1.23 0.33 1.55 1.20 0.00 0.00 173.24 175.32 2dne h PRO 17 N 2.14 -0.18 -1.10 5.44 0.13 -2.04 -3.32 132.00 133.06 2dne h PRO 17 Ca -0.23 0.01 -0.34 0.00 -0.87 0.00 0.00 66.00 64.57 2dne h PRO 17 Cb 1.25 0.04 -0.19 0.00 0.13 0.00 0.00 31.00 32.24 2dne h PRO 17 CO 0.30 -0.12 0.44 0.25 -0.23 0.00 0.00 178.00 178.64 2dne n THR 18 N -3.67 2.52 -2.13 1.56 -2.24 -1.26 -4.95 114.28 104.12 2dne n THR 18 Ca -0.02 -1.39 -0.42 0.00 -2.27 0.00 0.00 64.05 59.95 2dne n THR 18 Cb 0.08 -0.84 -0.03 0.00 -2.10 0.00 0.00 70.33 67.43 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 -2.10 4.31 -0.01 -0.78 0.00 -1.25 -4.89 119.30 114.58 2dne s MET 19 Ca 0.36 2.13 0.01 0.00 0.00 0.00 0.00 55.69 58.18 2dne s MET 19 Cb 0.30 -3.21 -0.01 0.00 0.00 0.00 0.00 34.83 31.90 2dne s MET 19 CO 0.05 -0.42 -0.00 1.04 0.00 0.00 0.00 175.02 175.68 2dne n GLN 20 N 3.57 1.85 -3.56 4.11 6.02 -1.26 -5.00 117.38 123.11 2dne n GLN 20 Ca 0.10 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.95 2dne n GLN 20 Cb 0.42 -1.03 -0.06 0.00 1.02 0.00 0.00 30.24 30.59 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 -2.03 -1.83 0.16 -1.58 0.00 -1.26 -3.55 121.76 111.66 2dne s ALA 21 Ca -0.01 1.54 0.01 0.00 0.00 0.00 0.00 51.96 53.50 2dne s ALA 21 Cb 0.00 -0.48 -0.01 0.00 0.00 0.00 0.00 23.12 22.63 2dne s ALA 21 CO 0.04 -0.34 0.05 0.41 0.00 0.00 0.00 175.76 175.92 2dne n GLY 22 N 1.22 3.80 2.92 0.00 0.00 0.12 -4.84 105.19 108.40 2dne n GLY 22 Ca -0.15 -2.01 -0.16 0.00 0.00 0.00 0.00 46.02 43.70 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 -2.08 0.32 -1.01 2.61 2.01 -1.04 -0.41 115.64 116.05 2dne s THR 23 Ca 0.07 -0.14 -0.23 0.00 0.31 0.00 0.00 61.69 61.70 2dne s THR 23 Cb 0.00 -0.30 -0.02 0.00 0.01 0.00 0.00 72.50 72.20 2dne s THR 23 CO 0.05 0.11 1.79 -0.63 -0.69 0.00 0.00 174.62 175.24 2dne s ILE 24 N 0.12 3.65 0.05 1.82 -1.09 -1.20 -0.80 121.20 123.76 2dne s ILE 24 Ca -0.01 -0.68 -0.18 0.00 -2.23 0.00 0.00 60.65 57.56 2dne s ILE 24 Cb -0.04 -4.48 -0.07 0.00 -1.58 0.00 0.00 42.46 36.29 2dne s ILE 24 CO -0.00 -1.32 1.28 0.00 -1.23 0.00 0.00 174.94 173.66 2dne h ALA 25 N 10.36 -0.78 -2.53 9.38 0.00 -1.78 1.55 119.26 135.46 2dne h ALA 25 Ca 0.17 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2dne h ALA 25 Cb 0.99 0.68 -0.17 0.00 0.00 0.00 0.00 17.79 19.29 2dne h ALA 25 CO 1.29 -0.84 -0.19 0.50 0.00 0.00 0.00 179.25 180.01 2dne s ARG 26 N -4.39 0.84 -1.09 0.00 6.06 -1.25 -4.12 118.95 114.99 2dne s ARG 26 Ca -0.08 -0.40 -0.09 0.00 -2.50 0.00 0.00 55.73 52.66 2dne s ARG 26 Cb 0.03 0.37 0.27 0.00 0.06 0.00 0.00 34.95 35.68 2dne s ARG 26 CO 0.31 -0.27 1.08 -1.58 -2.50 0.00 0.00 175.30 172.33 2dne s TRP 27 N -2.36 4.24 0.38 5.12 0.52 -1.26 -1.60 118.94 123.98 2dne s TRP 27 Ca -0.06 -2.70 0.27 0.00 0.02 0.00 0.00 56.10 53.63 2dne s TRP 27 Cb -0.01 -3.80 1.30 0.00 -1.15 0.00 0.00 33.47 29.81 2dne s TRP 27 CO -0.02 -0.94 1.39 -1.91 0.02 0.00 0.00 176.95 175.49 2dne n GLU 28 N 2.71 -0.04 -3.88 4.98 0.00 -1.10 -4.30 120.64 119.02 2dne n GLU 28 Ca 0.23 1.13 -0.23 0.00 0.00 0.00 0.00 57.16 58.29 2dne n GLU 28 Cb 0.39 -2.19 -0.05 0.00 0.00 0.00 0.00 31.44 29.59 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 -5.11 2.35 0.36 5.31 -0.14 -0.96 -5.02 119.74 116.53 2dne s LYS 29 Ca -0.07 -1.75 0.05 0.00 -1.36 0.00 0.00 55.97 52.84 2dne s LYS 29 Cb 0.28 -2.15 -0.03 0.00 -1.68 0.00 0.00 37.83 34.25 2dne s LYS 29 CO 0.72 -0.21 0.18 0.15 -0.76 0.00 0.00 175.35 175.43 2dne s LYS 30 N -4.04 1.79 0.17 1.68 -0.14 -1.26 -5.02 119.74 112.92 2dne s LYS 30 Ca 0.43 -2.06 -0.31 0.00 -1.36 0.00 0.00 55.97 52.67 2dne s LYS 30 Cb 0.00 -0.18 -0.09 0.00 -1.68 0.00 0.00 37.83 35.88 2dne s LYS 30 CO 0.24 -0.53 1.42 -1.21 -0.76 0.00 0.00 175.35 174.51 2dne s GLU 31 N -3.66 4.30 -0.24 1.68 2.02 -1.26 -2.68 118.70 118.87 2dne s GLU 31 Ca 0.32 2.18 -0.01 0.00 0.02 0.00 0.00 54.97 57.48 2dne s GLU 31 Cb 0.03 -3.19 0.00 0.00 0.10 0.00 0.00 34.13 31.08 2dne s GLU 31 CO 0.19 -0.42 0.08 0.41 0.02 0.00 0.00 175.26 175.54 2dne n GLY 32 N 3.00 0.47 3.63 -1.39 0.00 -1.05 -4.99 105.19 104.85 2dne n GLY 32 Ca 0.10 -0.66 -0.24 0.00 0.00 0.00 0.00 46.02 45.22 2dne n GLY 32 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dne s ASP 33 N -2.95 4.47 -0.10 1.61 -1.08 -1.09 -4.94 116.67 112.59 2dne s ASP 33 Ca 0.04 -0.64 -0.14 0.00 -0.52 0.00 0.00 52.55 51.29 2dne s ASP 33 Cb -0.02 -0.81 -0.05 0.00 -1.46 0.00 0.00 42.92 40.58 2dne s ASP 33 CO 0.05 0.02 0.33 -0.75 0.52 0.00 0.00 175.17 175.34 2dne s LYS 34 N -3.51 4.04 -0.07 4.34 2.20 -1.26 -2.42 119.74 123.06 2dne s LYS 34 Ca 0.30 0.20 0.04 0.00 -0.36 0.00 0.00 55.97 56.15 2dne s LYS 34 Cb -0.07 -3.33 0.00 0.00 -1.51 0.00 0.00 37.83 32.93 2dne s LYS 34 CO 0.19 0.45 -0.20 0.42 -0.36 0.00 0.00 175.35 175.86 2dne s ILE 35 N -0.22 1.68 -0.10 5.43 1.01 0.37 -4.99 121.20 124.36 2dne s ILE 35 Ca 0.20 -0.82 0.01 0.00 0.00 0.00 0.00 60.65 60.04 2dne s ILE 35 Cb -0.14 -1.46 -0.02 0.00 0.01 0.00 0.00 42.46 40.85 2dne s ILE 35 CO 0.08 0.47 -0.13 0.20 0.00 0.00 0.00 174.94 175.56 2dne s ASN 36 N 0.29 4.10 -0.42 3.58 0.01 -1.26 -2.33 114.94 118.90 2dne s ASN 36 Ca -0.12 -0.26 -0.43 0.00 -0.71 0.00 0.00 52.86 51.34 2dne s ASN 36 Cb -0.15 -1.35 -0.19 0.00 0.41 0.00 0.00 41.25 39.97 2dne s ASN 36 CO 0.05 0.23 1.45 1.21 -1.51 0.00 0.00 177.10 178.53 2dne n GLU 37 N 3.06 0.00 0.00 -0.60 0.00 -1.25 0.10 120.64 121.95 2dne n GLU 37 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 57.16 56.98 2dne n GLU 37 Cb 0.53 -1.40 0.00 0.00 0.00 0.00 0.00 31.44 30.57 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 3.52 2.52 3.34 8.31 0.00 -1.07 -4.96 105.19 116.85 2dne n GLY 38 Ca 0.28 -0.42 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 2dne n GLY 38 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dne n ASP 39 N 0.28 -2.64 -4.55 1.61 5.75 0.28 -4.34 116.55 112.95 2dne n ASP 39 Ca 0.00 0.26 -0.42 0.00 -0.01 0.00 0.00 54.79 54.62 2dne n ASP 39 Cb 0.00 -1.11 -0.08 0.00 -1.03 0.00 0.00 41.12 38.90 2dne n ASP 39 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 2dne s LEU 40 N 0.18 4.41 -0.07 -2.12 2.96 -1.26 -0.98 118.68 121.80 2dne s LEU 40 Ca 0.54 -0.11 -0.27 0.00 -0.22 0.00 0.00 54.13 54.07 2dne s LEU 40 Cb -0.19 -2.62 -0.22 0.00 0.50 0.00 0.00 46.19 43.66 2dne s LEU 40 CO 0.69 -0.56 1.06 0.40 -1.32 0.00 0.00 176.35 176.62 2dne h ILE 41 N 5.68 1.51 -2.05 6.68 2.04 0.36 -3.39 117.51 128.33 2dne h ILE 41 Ca -0.27 -1.59 0.22 0.00 1.00 0.00 0.00 64.86 64.22 2dne h ILE 41 Cb 1.12 2.58 -0.10 0.00 -0.74 0.00 0.00 36.82 39.68 2dne h ILE 41 CO 0.80 0.41 0.59 0.00 0.00 0.00 0.00 178.15 179.96 2dne s ALA 42 N -3.46 -1.84 0.23 1.87 0.00 -1.09 -2.27 121.76 115.20 2dne s ALA 42 Ca -0.17 0.33 0.07 0.00 0.00 0.00 0.00 51.96 52.20 2dne s ALA 42 Cb -0.00 0.54 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 2dne s ALA 42 CO 0.67 -1.03 0.11 -1.21 0.00 0.00 0.00 175.76 174.29 2dne s GLU 43 N -3.01 2.68 -0.02 0.00 2.02 -0.63 0.13 118.70 119.87 2dne s GLU 43 Ca 0.13 -1.13 0.01 0.00 0.02 0.00 0.00 54.97 54.00 2dne s GLU 43 Cb 0.01 -2.44 0.01 0.00 0.10 0.00 0.00 34.13 31.81 2dne s GLU 43 CO 0.00 0.41 -0.03 0.08 0.02 0.00 0.00 175.26 175.74 2dne s VAL 44 N -2.06 0.34 -0.25 2.63 1.01 0.50 -2.20 120.40 120.37 2dne s VAL 44 Ca 0.31 -0.09 -0.14 0.00 0.00 0.00 0.00 61.98 62.06 2dne s VAL 44 Cb -0.08 -0.35 -0.04 0.00 0.00 0.00 0.00 36.38 35.91 2dne s VAL 44 CO 0.22 0.14 0.33 -1.61 0.00 0.00 0.00 175.10 174.19 2dne s GLU 45 N 0.46 4.05 0.34 2.72 2.02 0.02 0.17 118.70 128.48 2dne s GLU 45 Ca -0.05 0.00 0.06 0.00 0.02 0.00 0.00 54.97 55.00 2dne s GLU 45 Cb -0.08 -3.61 -0.07 0.00 0.10 0.00 0.00 34.13 30.47 2dne s GLU 45 CO -0.01 -0.16 0.01 0.95 0.02 0.00 0.00 175.26 176.07 2dne s THR 46 N 1.72 1.56 0.62 3.63 -4.23 -0.51 -2.50 115.64 115.94 2dne s THR 46 Ca 0.14 -2.04 0.27 0.00 -1.18 0.00 0.00 61.69 58.88 2dne s THR 46 Cb -0.15 -2.75 0.33 0.00 1.34 0.00 0.00 72.50 71.27 2dne s THR 46 CO 0.09 -0.09 1.80 -0.78 -0.54 0.00 0.00 174.62 175.10 2dne h ASP 47 N 2.06 0.00 0.00 3.99 3.58 -1.98 -0.67 116.42 123.41 2dne h ASP 47 Ca -0.41 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.03 2dne h ASP 47 Cb 1.24 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.29 2dne h ASP 47 CO 0.72 0.00 -0.05 0.11 -2.88 0.00 0.00 179.24 177.14 2dne h LYS 48 N 0.00 0.00 0.00 0.28 1.79 -1.99 -3.51 116.57 113.14 2dne h LYS 48 Ca 0.16 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.63 2dne h LYS 48 Cb 1.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 2dne h LYS 48 CO -0.00 0.05 0.00 0.00 -1.08 0.00 0.00 179.45 178.41 2dne n ALA 49 N -2.85 0.00 -2.51 3.86 0.00 -0.26 -5.11 120.51 113.65 2dne n ALA 49 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.00 2dne n ALA 49 Cb 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.47 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 -2.51 4.31 0.38 0.00 2.01 -1.26 -1.42 115.64 117.16 2dne s THR 50 Ca 0.00 1.52 0.05 0.00 0.31 0.00 0.00 61.69 63.57 2dne s THR 50 Cb 0.00 -4.23 -0.00 0.00 0.01 0.00 0.00 72.50 68.28 2dne s THR 50 CO 0.00 -0.41 0.54 -0.69 -0.69 0.00 0.00 174.62 173.37 2dne s VAL 51 N 3.93 3.82 -0.22 3.82 1.01 0.45 -4.86 120.40 128.34 2dne s VAL 51 Ca 0.52 -0.89 0.02 0.00 0.00 0.00 0.00 61.98 61.62 2dne s VAL 51 Cb -0.16 -3.34 0.04 0.00 0.00 0.00 0.00 36.38 32.93 2dne s VAL 51 CO 0.18 -0.15 -0.15 -0.83 0.00 0.00 0.00 175.10 174.15 2dne s GLY 52 N -4.22 1.53 -0.35 4.51 0.00 -1.26 -0.37 107.32 107.16 2dne s GLY 52 Ca 0.48 -1.49 -0.26 0.00 0.00 0.00 0.00 44.72 43.45 2dne s GLY 52 CO 0.33 0.45 0.92 -0.12 0.00 0.00 0.00 173.10 174.68 2dne s PHE 53 N 1.20 3.11 0.39 1.90 5.36 0.34 -4.98 117.98 125.31 2dne s PHE 53 Ca -0.02 0.84 0.01 0.00 -0.96 0.00 0.00 56.93 56.80 2dne s PHE 53 Cb -0.17 -3.56 -0.02 0.00 -0.34 0.00 0.00 43.02 38.93 2dne s PHE 53 CO -0.09 -0.76 0.60 -1.21 -1.46 0.00 0.00 175.22 172.30 2dne s GLU 54 N 3.39 3.25 0.46 10.12 8.01 -1.26 0.10 118.70 142.77 2dne s GLU 54 Ca 0.38 -0.48 -0.16 0.00 0.01 0.00 0.00 54.97 54.72 2dne s GLU 54 Cb -0.12 -2.63 -0.08 0.00 -4.31 0.00 0.00 34.13 26.98 2dne s GLU 54 CO 0.17 -0.06 0.92 0.45 0.01 0.00 0.00 175.26 176.74 2dne s SER 55 N -4.14 6.68 -0.11 -0.19 0.15 -0.15 -4.74 113.70 111.20 2dne s SER 55 Ca 0.44 1.49 0.18 0.00 0.70 0.00 0.00 55.95 58.76 2dne s SER 55 Cb -0.10 -2.47 -0.27 0.00 -1.71 0.00 0.00 66.02 61.48 2dne s SER 55 CO 0.36 -0.47 0.23 0.18 1.20 0.00 0.00 173.24 174.74 2dne n LEU 56 N -1.23 0.00 -4.14 3.45 4.77 -1.26 -2.61 117.00 115.98 2dne n LEU 56 Ca 0.06 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.91 2dne n LEU 56 Cb 0.54 0.26 -0.07 0.00 -2.33 0.00 0.00 43.42 41.81 2dne n LEU 56 CO 0.44 0.26 -0.04 -1.61 -1.33 0.00 0.00 177.39 175.11 2dne s GLU 57 N -2.87 1.52 -0.21 3.23 2.02 -1.26 -4.89 118.70 116.24 2dne s GLU 57 Ca -0.08 -1.62 -0.20 0.00 0.02 0.00 0.00 54.97 53.08 2dne s GLU 57 Cb 0.09 0.36 -0.03 0.00 0.10 0.00 0.00 34.13 34.66 2dne s GLU 57 CO 0.80 -0.58 0.61 -2.00 0.02 0.00 0.00 175.26 174.11 2dne s GLU 58 N -3.79 4.19 0.03 1.61 2.12 -1.26 -3.96 118.70 117.64 2dne s GLU 58 Ca 0.33 0.57 -0.04 0.00 0.36 0.00 0.00 54.97 56.19 2dne s GLU 58 Cb 0.03 -3.59 0.02 0.00 0.26 0.00 0.00 34.13 30.85 2dne s GLU 58 CO 0.15 -0.26 0.21 0.00 -0.54 0.00 0.00 175.26 174.83 2dne s TYR 60 N -4.80 2.06 -0.14 0.00 1.51 -1.26 -0.48 117.35 114.24 2dne s TYR 60 Ca 0.05 -0.53 -0.29 0.00 -1.01 0.00 0.00 57.07 55.28 2dne s TYR 60 Cb -0.00 -1.04 -0.03 0.00 -0.11 0.00 0.00 41.96 40.77 2dne s TYR 60 CO 0.01 0.47 1.49 1.41 -1.11 0.00 0.00 175.55 177.82 2dne s MET 61 N -3.63 4.11 -0.08 -0.62 -2.45 -1.02 -3.06 119.30 112.56 2dne s MET 61 Ca 0.28 1.84 -0.02 0.00 -1.25 0.00 0.00 55.69 56.54 2dne s MET 61 Cb -0.00 -3.91 -0.01 0.00 1.25 0.00 0.00 34.83 32.16 2dne s MET 61 CO 0.12 -0.90 -0.04 0.00 1.05 0.00 0.00 175.02 175.24 2dne h ALA 62 N 9.29 0.00 -2.59 4.11 0.00 0.38 -2.79 119.26 127.66 2dne h ALA 62 Ca -0.33 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.30 2dne h ALA 62 Cb 1.14 0.12 -0.21 0.00 0.00 0.00 0.00 17.79 18.85 2dne h ALA 62 CO 0.97 0.12 -0.30 0.21 0.00 0.00 0.00 179.25 180.26 2dne s LYS 63 N -1.53 0.61 -0.83 0.00 2.47 -1.01 -4.45 119.74 115.01 2dne s LYS 63 Ca -0.04 -0.13 0.01 0.00 -1.56 0.00 0.00 55.97 54.26 2dne s LYS 63 Cb 0.00 0.27 0.23 0.00 -1.46 0.00 0.00 37.83 36.88 2dne s LYS 63 CO 0.05 -0.16 0.82 -0.89 0.16 0.00 0.00 175.35 175.33 2dne n ILE 64 N 1.50 2.93 -0.18 5.43 5.41 -1.26 0.14 119.36 133.33 2dne n ILE 64 Ca -0.21 -5.20 -0.13 0.00 1.00 0.00 0.00 62.75 58.20 2dne n ILE 64 Cb 0.56 -2.24 -0.10 0.00 -0.71 0.00 0.00 39.64 37.15 2dne n ILE 64 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2dne h LEU 65 N 5.38 -1.92 -9.00 1.39 3.38 -1.79 -3.35 115.31 109.40 2dne h LEU 65 Ca 0.17 0.26 -0.62 0.00 0.09 0.00 0.00 57.88 57.79 2dne h LEU 65 Cb 0.74 0.80 -0.13 0.00 0.09 0.00 0.00 40.66 42.15 2dne h LEU 65 CO 0.89 -0.38 -0.15 -0.69 0.09 0.00 0.00 178.44 178.20 2dne s VAL 66 N -5.62 5.14 0.66 1.22 1.01 -0.76 -5.02 120.40 117.03 2dne s VAL 66 Ca -0.14 0.72 -0.09 0.00 0.00 0.00 0.00 61.98 62.47 2dne s VAL 66 Cb 0.09 -3.75 0.15 0.00 0.00 0.00 0.00 36.38 32.86 2dne s VAL 66 CO 0.62 0.16 0.90 0.00 0.00 0.00 0.00 175.10 176.77 2dne n ALA 67 N 5.18 -0.76 -2.71 5.51 0.00 -1.26 -4.82 120.51 121.64 2dne n ALA 67 Ca -0.07 -1.30 -0.41 0.00 0.00 0.00 0.00 53.44 51.67 2dne n ALA 67 Cb 0.50 0.02 -0.04 0.00 0.00 0.00 0.00 19.45 19.93 2dne n ALA 67 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2dne s GLU 68 N -4.89 4.48 0.00 0.00 -1.05 -1.26 -3.58 118.70 112.40 2dne s GLU 68 Ca 0.53 1.08 0.00 0.00 -0.15 0.00 0.00 54.97 56.43 2dne s GLU 68 Cb -0.02 -3.46 0.00 0.00 -0.44 0.00 0.00 34.13 30.21 2dne s GLU 68 CO 0.36 0.01 0.00 0.41 0.95 0.00 0.00 175.26 176.99 2dne n GLY 69 N 3.04 1.86 3.52 -3.83 0.00 0.53 -4.98 105.19 105.34 2dne n GLY 69 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.28 0.02 -3.37 2.61 -1.04 -1.23 -4.76 114.28 106.22 2dne n THR 70 Ca 0.00 -0.51 -0.32 0.00 -2.04 0.00 0.00 64.05 61.18 2dne n THR 70 Cb 0.00 -2.09 -0.05 0.00 -1.82 0.00 0.00 70.33 66.37 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 7.91 3.83 0.00 -2.82 0.52 -1.26 -3.22 118.95 123.91 2dne s ARG 71 Ca 1.09 0.33 0.00 0.00 -0.52 0.00 0.00 55.73 56.63 2dne s ARG 71 Cb -0.54 -2.61 0.00 0.00 0.52 0.00 0.00 34.95 32.31 2dne s ARG 71 CO 0.36 0.29 0.00 -3.47 0.02 0.00 0.00 175.30 172.50 2dne n ASP 72 N -0.17 -1.63 -4.59 0.23 2.03 -1.23 -5.02 116.55 106.16 2dne n ASP 72 Ca 0.01 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.90 2dne n ASP 72 Cb 0.52 -0.41 -0.04 0.00 -0.72 0.00 0.00 41.12 40.47 2dne n ASP 72 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2dne s VAL 73 N -2.80 4.67 0.63 5.18 1.01 0.45 -4.91 120.40 124.63 2dne s VAL 73 Ca 0.00 1.03 -0.14 0.00 0.00 0.00 0.00 61.98 62.88 2dne s VAL 73 Cb 0.00 -4.26 -0.02 0.00 0.00 0.00 0.00 36.38 32.10 2dne s VAL 73 CO 0.00 -0.47 1.05 -2.16 0.00 0.00 0.00 175.10 173.52 2dne s PRO 74 N 3.26 3.19 0.20 2.72 0.04 -1.26 0.11 135.00 143.26 2dne s PRO 74 Ca 0.34 1.08 -0.30 0.00 0.04 0.00 0.00 61.00 62.16 2dne s PRO 74 Cb -0.13 -2.02 -0.08 0.00 0.04 0.00 0.00 34.50 32.31 2dne s PRO 74 CO 0.17 -0.90 1.11 0.42 0.04 0.00 0.00 177.00 177.84 2dne s ILE 75 N -2.73 3.76 0.00 0.56 1.01 -1.23 -2.76 121.20 119.81 2dne s ILE 75 Ca 0.61 1.56 0.00 0.00 0.00 0.00 0.00 60.65 62.82 2dne s ILE 75 Cb -0.15 -4.00 0.00 0.00 0.01 0.00 0.00 42.46 38.33 2dne s ILE 75 CO 0.45 0.29 0.00 0.61 0.00 0.00 0.00 174.94 176.29 2dne n GLY 76 N 1.88 2.45 3.59 6.18 0.00 -0.73 -4.90 105.19 113.67 2dne n GLY 76 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.35 2.79 -0.33 4.61 0.00 -1.11 -4.20 121.76 121.18 2dne s ALA 77 Ca 0.00 -0.04 -0.44 0.00 0.00 0.00 0.00 51.96 51.48 2dne s ALA 77 Cb 0.00 -4.05 -0.20 0.00 0.00 0.00 0.00 23.12 18.87 2dne s ALA 77 CO 0.00 -2.80 1.43 -0.89 0.00 0.00 0.00 175.76 173.50 2dne n ILE 78 N 7.27 0.01 -0.07 0.00 2.08 -1.26 -2.96 119.36 124.43 2dne n ILE 78 Ca 0.20 -0.00 -0.08 0.00 0.56 0.00 0.00 62.75 63.43 2dne n ILE 78 Cb 0.48 -0.36 -0.15 0.00 -0.75 0.00 0.00 39.64 38.86 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 3.20 1.39 -3.83 1.39 -5.35 0.28 -4.29 119.36 112.14 2dne n ILE 79 Ca 0.27 -0.82 -0.04 0.00 -0.27 0.00 0.00 62.75 61.90 2dne n ILE 79 Cb -0.01 -0.64 0.01 0.00 -1.74 0.00 0.00 39.64 37.27 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 -2.53 1.29 0.18 0.00 1.01 0.37 -0.55 121.20 120.98 2dne s ILE 81 Ca 0.18 -1.75 0.06 0.00 0.00 0.00 0.00 60.65 59.14 2dne s ILE 81 Cb -0.02 -1.55 -0.05 0.00 0.01 0.00 0.00 42.46 40.85 2dne s ILE 81 CO 0.05 -0.46 -0.12 0.42 0.00 0.00 0.00 174.94 174.83 2dne s THR 82 N -2.29 1.49 0.01 2.92 -4.23 0.18 0.10 115.64 113.82 2dne s THR 82 Ca 0.10 -2.15 0.00 0.00 -1.18 0.00 0.00 61.69 58.46 2dne s THR 82 Cb -0.04 -1.98 -0.00 0.00 1.34 0.00 0.00 72.50 71.82 2dne s THR 82 CO 0.03 -0.64 0.00 1.33 -0.54 0.00 0.00 174.62 174.80 2dne n VAL 83 N -0.31 0.00 0.09 2.29 0.24 -1.17 0.18 118.33 119.65 2dne n VAL 83 Ca -0.09 -0.05 0.06 0.00 -2.04 0.00 0.00 64.34 62.23 2dne n VAL 83 Cb 0.61 0.02 -0.10 0.00 -1.47 0.00 0.00 33.84 32.90 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 1.56 -0.53 3.14 7.63 0.00 -1.26 -4.04 105.19 111.69 2dne n GLY 84 Ca -0.00 -0.32 -0.09 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.79 0.68 0.15 1.61 1.02 -1.26 -4.91 119.74 114.24 2dne s LYS 85 Ca -0.03 -0.95 0.24 0.00 0.02 0.00 0.00 55.97 55.25 2dne s LYS 85 Cb 0.09 0.26 0.91 0.00 -0.52 0.00 0.00 37.83 38.57 2dne s LYS 85 CO 0.54 -0.18 1.73 -0.35 -0.92 0.00 0.00 175.35 176.17 2dne n PRO 86 N 0.32 0.15 0.11 -1.68 -0.04 -1.26 -2.64 135.00 129.96 2dne n PRO 86 Ca -0.16 0.25 -0.02 0.00 -0.04 0.00 0.00 63.50 63.53 2dne n PRO 86 Cb 0.60 -1.72 0.07 0.00 -0.04 0.00 0.00 33.50 32.41 2dne n PRO 86 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2dne h GLU 87 N 0.00 0.00 -0.00 0.54 5.08 -2.02 -2.80 114.58 115.38 2dne h GLU 87 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2dne h GLU 87 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2dne h GLU 87 CO 0.00 0.72 -0.11 -0.25 -1.00 0.00 0.00 179.01 178.37 2dne n ASP 88 N -3.54 0.13 0.08 1.42 9.92 -1.08 -3.67 116.55 119.81 2dne n ASP 88 Ca -0.00 0.24 -0.12 0.00 -0.53 0.00 0.00 54.79 54.37 2dne n ASP 88 Cb 0.74 -0.30 -0.08 0.00 -0.64 0.00 0.00 41.12 40.83 2dne n ASP 88 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 2dne h ILE 89 N 0.03 0.90 -0.78 0.53 2.04 -1.54 -2.07 117.51 116.63 2dne h ILE 89 Ca 0.00 -0.92 0.17 0.00 1.00 0.00 0.00 64.86 65.11 2dne h ILE 89 Cb 0.48 1.41 -0.05 0.00 -0.74 0.00 0.00 36.82 37.92 2dne h ILE 89 CO 0.00 0.19 0.53 -0.08 0.00 0.00 0.00 178.15 178.79 2dne h GLU 90 N -0.74 0.33 -0.03 2.37 4.57 -1.64 1.11 114.58 120.55 2dne h GLU 90 Ca -0.03 -0.02 -0.12 0.00 -1.18 0.00 0.00 59.36 58.01 2dne h GLU 90 Cb 0.51 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.01 2dne h GLU 90 CO 0.04 0.22 -0.55 0.00 -1.18 0.00 0.00 179.01 177.54 2dne h ALA 91 N 1.64 1.03 -0.01 2.92 0.00 -1.64 -2.64 119.26 120.56 2dne h ALA 91 Ca 0.39 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2dne h ALA 91 Cb 1.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2dne h ALA 91 CO -0.11 0.69 -0.45 1.19 0.00 0.00 0.00 179.25 180.56 2dne n PHE 92 N -3.90 0.00 0.29 0.00 3.72 0.21 -4.03 117.46 113.76 2dne n PHE 92 Ca -0.02 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.55 2dne n PHE 92 Cb 0.56 -0.13 0.81 0.00 -0.94 0.00 0.00 39.48 39.79 2dne n PHE 92 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 2dne h LYS 93 N 0.89 0.00 -2.20 -1.08 3.64 0.13 -0.94 116.57 117.01 2dne h LYS 93 Ca 0.00 0.00 -0.56 0.00 -1.27 0.00 0.00 60.65 58.82 2dne h LYS 93 Cb 0.54 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 31.95 2dne h LYS 93 CO 0.00 0.00 -0.81 0.09 -2.27 0.00 0.00 179.45 176.46 2dne n ASN 94 N -3.05 3.36 -4.86 4.20 3.02 -1.26 -5.07 115.26 111.60 2dne n ASN 94 Ca -0.00 -3.48 -0.32 0.00 -0.03 0.00 0.00 54.58 50.75 2dne n ASN 94 Cb 0.42 -0.58 -0.05 0.00 -0.61 0.00 0.00 39.78 38.95 2dne n ASN 94 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2dne s TYR 95 N -3.14 3.42 0.17 3.10 6.14 -0.36 -5.11 117.35 121.57 2dne s TYR 95 Ca 0.46 0.24 -0.00 0.00 0.64 0.00 0.00 57.07 58.41 2dne s TYR 95 Cb 0.30 -1.75 -0.04 0.00 0.42 0.00 0.00 41.96 40.89 2dne s TYR 95 CO -0.12 0.59 0.07 0.99 0.64 0.00 0.00 175.55 177.71 2dne s THR 96 N -1.36 0.27 -0.24 4.34 2.01 -1.26 -5.04 115.64 114.35 2dne s THR 96 Ca 0.29 -1.96 -0.19 0.00 0.31 0.00 0.00 61.69 60.14 2dne s THR 96 Cb -0.13 -2.25 -0.03 0.00 0.01 0.00 0.00 72.50 70.10 2dne s THR 96 CO 0.21 -0.29 0.56 -0.76 -0.69 0.00 0.00 174.62 173.65 2dne s LEU 97 N -3.14 4.08 -0.13 4.42 1.02 -1.26 -5.05 118.68 118.62 2dne s LEU 97 Ca 0.30 0.63 0.01 0.00 0.02 0.00 0.00 54.13 55.09 2dne s LEU 97 Cb 0.07 -2.74 -0.00 0.00 0.02 0.00 0.00 46.19 43.53 2dne s LEU 97 CO 0.06 -0.29 -0.18 -1.81 0.02 0.00 0.00 176.35 174.16 2dne s ASP 98 N 1.42 3.52 0.02 2.29 1.01 -1.26 -5.04 116.67 118.64 2dne s ASP 98 Ca 0.24 -0.48 -0.24 0.00 0.71 0.00 0.00 52.55 52.78 2dne s ASP 98 Cb -0.16 -1.52 -0.13 0.00 1.01 0.00 0.00 42.92 42.12 2dne s ASP 98 CO 0.09 0.12 1.16 -1.28 0.21 0.00 0.00 175.17 175.48 2dne h SER 99 N 7.00 -0.73 -1.95 0.27 0.87 -2.07 -3.40 113.55 113.54 2dne h SER 99 Ca -0.27 0.03 -0.53 0.00 -1.23 0.00 0.00 61.79 59.79 2dne h SER 99 Cb 1.21 0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 63.35 2dne h SER 99 CO 0.54 -0.45 1.50 -0.44 -0.53 0.00 0.00 176.83 177.45 2dne s SER 100 N -3.85 5.10 -0.25 6.23 0.01 -1.26 -4.84 113.70 114.84 2dne s SER 100 Ca -0.13 1.31 -0.42 0.00 1.31 0.00 0.00 55.95 58.02 2dne s SER 100 Cb 0.01 -2.51 -0.19 0.00 0.21 0.00 0.00 66.02 63.55 2dne s SER 100 CO 0.38 -2.33 1.47 0.00 0.41 0.00 0.00 173.24 173.17 2dne n ALA 101 N 13.24 -1.61 0.42 1.44 0.00 -1.26 -4.84 120.51 127.90 2dne n ALA 101 Ca 0.30 0.50 -0.19 0.00 0.00 0.00 0.00 53.44 54.05 2dne n ALA 101 Cb 0.50 -1.97 -0.10 0.00 0.00 0.00 0.00 19.45 17.88 2dne n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dne h ALA 102 N 4.96 -1.26 0.00 0.00 0.00 -1.88 -3.47 119.26 117.61 2dne h ALA 102 Ca -0.47 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.20 2dne h ALA 102 Cb 1.37 0.60 0.00 0.00 0.00 0.00 0.00 17.79 19.76 2dne h ALA 102 CO 0.87 -1.22 0.00 0.45 0.00 0.00 0.00 179.25 179.35 2dne n SER 103 N -5.47 -2.61 -1.45 0.00 2.88 -1.26 -5.17 113.62 100.53 2dne n SER 103 Ca -0.14 0.68 0.18 0.00 -1.33 0.00 0.00 58.87 58.25 2dne n SER 103 Cb 0.49 2.59 -0.09 0.00 -0.75 0.00 0.00 64.21 66.45 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 -1.35 -3.23 3.80 0.46 0.00 -1.26 -4.85 105.19 98.76 2dne n GLY 104 Ca 0.00 -1.06 -0.34 0.00 0.00 0.00 0.00 46.02 44.63 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 -4.07 3.72 -0.57 1.61 0.04 -1.26 -4.94 135.00 129.54 2dne s PRO 105 Ca 0.00 1.32 0.04 0.00 0.04 0.00 0.00 61.00 62.40 2dne s PRO 105 Cb 0.00 -2.09 0.16 0.00 0.04 0.00 0.00 34.50 32.62 2dne s PRO 105 CO 0.00 -0.49 0.39 -1.12 0.04 0.00 0.00 177.00 175.82 2dne s SER 106 N -2.15 3.66 -0.13 6.66 0.01 -1.26 -4.93 113.70 115.55 2dne s SER 106 Ca 0.66 -3.37 -0.08 0.00 1.31 0.00 0.00 55.95 54.47 2dne s SER 106 Cb -0.16 -1.20 -0.05 0.00 0.21 0.00 0.00 66.02 64.82 2dne s SER 106 CO 0.23 -0.15 -0.03 0.28 0.41 0.00 0.00 173.24 173.98 2dne h SER 107 N 5.77 0.00 0.00 2.44 0.02 -2.02 -3.49 113.55 116.27 2dne h SER 107 Ca 0.14 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 2dne h SER 107 Cb 0.84 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.38 2dne h SER 107 CO 0.58 0.75 0.00 0.61 -1.14 0.00 0.00 176.83 177.63