#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmj s SER 2 N 0.00 -0.55 -0.12 1.61 1.04 -1.26 -5.18 113.70 109.24 2dmj s SER 2 Ca 0.00 0.24 -0.29 0.00 0.48 0.00 0.00 55.95 56.38 2dmj s SER 2 Cb 0.00 0.55 0.08 0.00 0.10 0.00 0.00 66.02 66.75 2dmj s SER 2 CO 0.00 -0.80 0.72 -0.55 0.98 0.00 0.00 173.24 173.59 2dmj s SER 3 N -2.11 -0.65 -0.30 7.02 0.15 -1.26 -5.16 113.70 111.39 2dmj s SER 3 Ca -0.04 0.88 -0.14 0.00 0.70 0.00 0.00 55.95 57.35 2dmj s SER 3 Cb -0.01 0.76 0.15 0.00 -1.71 0.00 0.00 66.02 65.21 2dmj s SER 3 CO -0.04 -0.49 0.87 -0.83 1.20 0.00 0.00 173.24 173.96 2dmj s GLY 4 N -0.76 -0.34 -0.81 9.45 0.00 -1.26 -5.10 107.32 108.51 2dmj s GLY 4 Ca -0.07 2.83 -0.01 0.00 0.00 0.00 0.00 44.72 47.46 2dmj s GLY 4 CO 0.07 3.01 0.67 -0.56 0.00 0.00 0.00 173.10 176.29 2dmj s SER 5 N 2.31 5.66 0.88 1.64 0.01 -1.26 -5.08 113.70 117.86 2dmj s SER 5 Ca -0.05 -3.57 -0.13 0.00 1.31 0.00 0.00 55.95 53.51 2dmj s SER 5 Cb -0.07 -1.86 0.07 0.00 0.21 0.00 0.00 66.02 64.37 2dmj s SER 5 CO -0.18 -0.20 0.80 -0.24 0.41 0.00 0.00 173.24 173.83 2dmj n SER 6 N 2.51 -0.61 -3.95 2.44 2.88 -1.26 -4.94 113.62 110.69 2dmj n SER 6 Ca 0.18 0.45 -0.38 0.00 -1.33 0.00 0.00 58.87 57.79 2dmj n SER 6 Cb 0.37 -1.35 -0.03 0.00 -0.75 0.00 0.00 64.21 62.45 2dmj n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dmj n GLY 7 N 0.99 4.71 3.66 0.46 0.00 -1.26 -5.03 105.19 108.72 2dmj n GLY 7 Ca 0.10 -2.66 -0.35 0.00 0.00 0.00 0.00 46.02 43.11 2dmj n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2dmj s MET 8 N -2.19 3.97 -0.10 1.61 0.00 -1.26 -5.09 119.30 116.25 2dmj s MET 8 Ca 0.32 -0.32 0.02 0.00 0.00 0.00 0.00 55.69 55.72 2dmj s MET 8 Cb 0.02 -3.24 0.01 0.00 0.00 0.00 0.00 34.83 31.62 2dmj s MET 8 CO -0.00 0.31 -0.17 0.00 0.00 0.00 0.00 175.02 175.16 2dmj s ALA 9 N 0.28 1.72 -0.09 4.11 0.00 -1.26 -5.12 121.76 121.40 2dmj s ALA 9 Ca 0.04 -0.72 -0.04 0.00 0.00 0.00 0.00 51.96 51.24 2dmj s ALA 9 Cb -0.12 -0.77 0.04 0.00 0.00 0.00 0.00 23.12 22.27 2dmj s ALA 9 CO -0.00 0.04 0.20 -2.00 0.00 0.00 0.00 175.76 174.00 2dmj s GLU 10 N 0.78 0.16 -0.45 0.00 2.56 -1.26 -5.10 118.70 115.38 2dmj s GLU 10 Ca -0.11 0.46 -0.28 0.00 0.00 0.00 0.00 54.97 55.04 2dmj s GLU 10 Cb -0.16 -0.14 -0.02 0.00 2.00 0.00 0.00 34.13 35.81 2dmj s GLU 10 CO 0.02 -0.16 1.86 -1.54 -0.56 0.00 0.00 175.26 174.87 2dmj s SER 11 N 1.21 5.56 -0.30 -1.70 1.04 -1.26 -4.91 113.70 113.35 2dmj s SER 11 Ca -0.09 0.92 -0.06 0.00 0.48 0.00 0.00 55.95 57.20 2dmj s SER 11 Cb -0.11 -2.53 0.16 0.00 0.10 0.00 0.00 66.02 63.65 2dmj s SER 11 CO -0.07 -2.04 0.67 -0.55 0.98 0.00 0.00 173.24 172.23 2dmj s SER 12 N 7.24 -1.18 -0.31 7.02 0.15 -1.26 -5.04 113.70 120.32 2dmj s SER 12 Ca 0.76 1.11 0.10 0.00 0.70 0.00 0.00 55.95 58.62 2dmj s SER 12 Cb -0.18 2.14 0.46 0.00 -1.71 0.00 0.00 66.02 66.73 2dmj s SER 12 CO 0.28 -0.22 1.15 0.47 1.20 0.00 0.00 173.24 176.12 2dmj n ASP 13 N 5.41 4.20 -4.93 5.45 8.00 -1.26 -5.07 116.55 128.35 2dmj n ASP 13 Ca -0.06 -3.42 -0.26 0.00 0.71 0.00 0.00 54.79 51.76 2dmj n ASP 13 Cb 0.50 -0.39 -0.01 0.00 -0.02 0.00 0.00 41.12 41.20 2dmj n ASP 13 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2dmj s LYS 14 N -3.60 3.53 -0.16 -1.24 1.02 -1.26 -5.04 119.74 112.99 2dmj s LYS 14 Ca 0.46 -0.12 -0.22 0.00 0.02 0.00 0.00 55.97 56.10 2dmj s LYS 14 Cb 0.40 -2.58 -0.24 0.00 -0.52 0.00 0.00 37.83 34.89 2dmj s LYS 14 CO -0.01 0.06 0.49 -0.07 -0.92 0.00 0.00 175.35 174.89 2dmj h LEU 15 N 0.75 0.11 -9.61 3.17 3.38 -1.95 -3.47 115.31 107.68 2dmj h LEU 15 Ca -0.49 -0.76 -0.60 0.00 0.09 0.00 0.00 57.88 56.12 2dmj h LEU 15 Cb 1.21 -0.04 -0.09 0.00 0.09 0.00 0.00 40.66 41.83 2dmj h LEU 15 CO 0.62 1.37 -0.62 -0.31 0.09 0.00 0.00 178.44 179.59 2dmj s TYR 16 N -2.35 3.01 -0.27 1.13 2.02 -1.26 -2.77 117.35 116.87 2dmj s TYR 16 Ca -0.23 -0.06 -0.01 0.00 -0.37 0.00 0.00 57.07 56.40 2dmj s TYR 16 Cb 0.03 -1.48 0.16 0.00 -0.40 0.00 0.00 41.96 40.27 2dmj s TYR 16 CO 0.67 0.51 0.45 0.50 -1.57 0.00 0.00 175.55 176.11 2dmj s ARG 17 N -2.86 0.42 -0.07 -0.62 3.52 -1.18 -1.26 118.95 116.91 2dmj s ARG 17 Ca 0.29 0.56 -0.05 0.00 -0.13 0.00 0.00 55.73 56.40 2dmj s ARG 17 Cb -0.10 -0.17 -0.04 0.00 -1.56 0.00 0.00 34.95 33.08 2dmj s ARG 17 CO 0.21 -0.74 0.16 0.54 -0.81 0.00 0.00 175.30 174.65 2dmj s VAL 18 N 2.63 5.46 -0.08 7.11 0.11 -0.37 -2.46 120.40 132.80 2dmj s VAL 18 Ca 0.14 0.04 -0.32 0.00 -2.93 0.00 0.00 61.98 58.91 2dmj s VAL 18 Cb -0.14 -3.45 0.12 0.00 -1.53 0.00 0.00 36.38 31.37 2dmj s VAL 18 CO -0.21 0.49 1.06 -1.83 -3.33 0.00 0.00 175.10 171.28 2dmj s GLU 19 N -1.44 0.57 -0.37 1.54 -1.05 -1.07 -4.02 118.70 112.87 2dmj s GLU 19 Ca 0.20 -0.23 -0.29 0.00 -0.15 0.00 0.00 54.97 54.51 2dmj s GLU 19 Cb -0.12 0.26 -0.00 0.00 -0.44 0.00 0.00 34.13 33.82 2dmj s GLU 19 CO 0.11 -0.25 1.60 0.71 0.95 0.00 0.00 175.26 178.37 2dmj s TYR 20 N -2.76 2.11 -0.38 4.83 2.02 -1.26 -3.21 117.35 118.71 2dmj s TYR 20 Ca 0.08 0.64 -0.34 0.00 -0.37 0.00 0.00 57.07 57.08 2dmj s TYR 20 Cb -0.01 -4.23 -0.15 0.00 -0.40 0.00 0.00 41.96 37.18 2dmj s TYR 20 CO -0.06 -2.46 1.43 0.00 -1.57 0.00 0.00 175.55 172.89 2dmj n ALA 21 N 9.51 -0.39 -0.16 3.71 0.00 0.32 -4.67 120.51 128.83 2dmj n ALA 21 Ca 0.20 0.25 -0.03 0.00 0.00 0.00 0.00 53.44 53.86 2dmj n ALA 21 Cb 0.47 -1.52 0.17 0.00 0.00 0.00 0.00 19.45 18.58 2dmj n ALA 21 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2dmj h LYS 22 N 5.40 0.91 -3.07 0.00 1.63 -1.91 0.50 116.57 120.04 2dmj h LYS 22 Ca -0.19 -0.17 -0.08 0.00 -0.85 0.00 0.00 60.65 59.35 2dmj h LYS 22 Cb 1.06 -0.14 -0.17 0.00 -0.60 0.00 0.00 32.23 32.38 2dmj h LYS 22 CO 0.79 0.78 -0.13 -1.12 -3.45 0.00 0.00 179.45 176.32 2dmj s SER 23 N -6.53 -0.26 -1.36 4.20 0.01 -1.26 -4.66 113.70 103.84 2dmj s SER 23 Ca -0.10 -0.03 -0.10 0.00 1.31 0.00 0.00 55.95 57.03 2dmj s SER 23 Cb 0.16 0.41 -0.07 0.00 0.21 0.00 0.00 66.02 66.74 2dmj s SER 23 CO 0.81 -0.66 2.57 0.61 0.41 0.00 0.00 173.24 176.98 2dmj n GLY 24 N 0.52 3.87 2.39 3.44 0.00 -1.26 -4.32 105.19 109.83 2dmj n GLY 24 Ca -0.19 -1.33 -0.09 0.00 0.00 0.00 0.00 46.02 44.42 2dmj n GLY 24 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2dmj n ARG 25 N 4.32 2.38 -4.03 1.61 1.85 -1.26 -4.92 116.66 116.61 2dmj n ARG 25 Ca 0.64 -3.69 -0.16 0.00 -1.00 0.00 0.00 57.85 53.64 2dmj n ARG 25 Cb 0.24 -1.80 -0.15 0.00 -1.05 0.00 0.00 32.46 29.70 2dmj n ARG 25 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2dmj s ALA 26 N -3.54 0.35 0.39 2.89 0.00 -1.26 -5.07 121.76 115.51 2dmj s ALA 26 Ca 0.37 -0.02 0.08 0.00 0.00 0.00 0.00 51.96 52.39 2dmj s ALA 26 Cb 0.36 -0.21 -0.01 0.00 0.00 0.00 0.00 23.12 23.26 2dmj s ALA 26 CO -0.02 0.01 0.44 -1.12 0.00 0.00 0.00 175.76 175.08 2dmj s SER 27 N 0.45 5.42 -0.09 0.00 0.01 -1.26 0.14 113.70 118.38 2dmj s SER 27 Ca -0.05 -0.52 -0.01 0.00 1.31 0.00 0.00 55.95 56.69 2dmj s SER 27 Cb -0.08 -0.76 -0.03 0.00 0.21 0.00 0.00 66.02 65.36 2dmj s SER 27 CO -0.01 -0.61 -0.02 0.00 0.41 0.00 0.00 173.24 173.02 2dmj n LYS 29 N 2.25 2.51 0.00 0.00 4.76 -1.25 -3.29 118.16 123.14 2dmj n LYS 29 Ca -0.18 -3.29 0.00 0.00 -2.87 0.00 0.00 58.31 51.96 2dmj n LYS 29 Cb 0.53 -2.17 0.00 0.00 -1.84 0.00 0.00 35.03 31.55 2dmj n LYS 29 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2dmj n LYS 30 N -1.00 0.00 0.00 1.97 3.00 -1.26 -4.87 118.16 115.99 2dmj n LYS 30 Ca 0.55 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.91 2dmj n LYS 30 Cb 1.08 -0.22 -0.03 0.00 0.00 0.00 0.00 35.03 35.85 2dmj n LYS 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2dmj n SER 32 N -0.77 -3.70 -4.03 0.00 2.88 -1.21 -5.05 113.62 101.75 2dmj n SER 32 Ca 0.03 -0.48 -0.23 0.00 -1.33 0.00 0.00 58.87 56.87 2dmj n SER 32 Cb 0.21 -3.86 -0.09 0.00 -0.75 0.00 0.00 64.21 59.72 2dmj n SER 32 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2dmj s GLU 33 N -4.49 1.81 -0.21 -1.46 2.02 -1.25 -4.95 118.70 110.18 2dmj s GLU 33 Ca 0.17 -2.08 -0.10 0.00 0.02 0.00 0.00 54.97 52.98 2dmj s GLU 33 Cb -0.02 -0.41 -0.05 0.00 0.10 0.00 0.00 34.13 33.75 2dmj s GLU 33 CO 0.53 -0.47 0.14 0.45 0.02 0.00 0.00 175.26 175.93 2dmj s SER 34 N -3.52 6.20 -0.03 -0.19 0.15 -1.26 -0.57 113.70 114.48 2dmj s SER 34 Ca 0.29 0.21 -0.30 0.00 0.70 0.00 0.00 55.95 56.86 2dmj s SER 34 Cb 0.04 -2.09 -0.03 0.00 -1.71 0.00 0.00 66.02 62.22 2dmj s SER 34 CO 0.17 0.16 1.10 -0.63 1.20 0.00 0.00 173.24 175.24 2dmj s ILE 35 N 0.48 4.49 0.69 6.45 1.01 0.12 -4.94 121.20 129.50 2dmj s ILE 35 Ca 0.08 1.78 -0.14 0.00 0.00 0.00 0.00 60.65 62.38 2dmj s ILE 35 Cb -0.11 -4.14 0.02 0.00 0.01 0.00 0.00 42.46 38.23 2dmj s ILE 35 CO -0.01 0.06 1.10 -2.16 0.00 0.00 0.00 174.94 173.94 2dmj s PRO 36 N 1.63 2.63 0.50 2.79 0.04 -1.26 -4.44 135.00 136.89 2dmj s PRO 36 Ca 0.54 1.32 -0.18 0.00 0.04 0.00 0.00 61.00 62.71 2dmj s PRO 36 Cb -0.23 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.29 2dmj s PRO 36 CO 0.24 -1.37 1.00 0.21 0.04 0.00 0.00 177.00 177.12 2dmj s LYS 37 N -4.35 3.87 -1.44 4.56 2.20 -1.26 -3.81 119.74 119.50 2dmj s LYS 37 Ca 0.65 1.14 -0.09 0.00 -0.36 0.00 0.00 55.97 57.31 2dmj s LYS 37 Cb -0.19 -2.12 0.05 0.00 -1.51 0.00 0.00 37.83 34.06 2dmj s LYS 37 CO 0.46 -0.35 0.93 -0.25 -0.36 0.00 0.00 175.35 175.78 2dmj n ASP 38 N -1.28 -3.91 -4.34 1.43 9.92 0.18 -4.91 116.55 113.63 2dmj n ASP 38 Ca 0.08 -0.76 -0.25 0.00 -0.53 0.00 0.00 54.79 53.34 2dmj n ASP 38 Cb 0.53 -4.12 -0.12 0.00 -0.64 0.00 0.00 41.12 36.78 2dmj n ASP 38 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 2dmj s SER 39 N -3.64 2.86 -0.37 -2.24 1.04 -1.25 -4.77 113.70 105.34 2dmj s SER 39 Ca 0.45 -0.78 -0.29 0.00 0.48 0.00 0.00 55.95 55.81 2dmj s SER 39 Cb -0.22 -0.18 0.01 0.00 0.10 0.00 0.00 66.02 65.73 2dmj s SER 39 CO 0.81 0.06 1.27 -0.22 0.98 0.00 0.00 173.24 176.14 2dmj s LEU 40 N -2.29 3.75 0.28 2.42 2.96 -1.26 -0.52 118.68 124.02 2dmj s LEU 40 Ca 0.13 0.92 0.02 0.00 -0.22 0.00 0.00 54.13 54.98 2dmj s LEU 40 Cb -0.08 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.02 2dmj s LEU 40 CO 0.06 -1.19 0.11 0.00 -1.32 0.00 0.00 176.35 174.01 2dmj s ARG 41 N 4.38 1.50 0.45 1.98 1.70 -1.20 -3.44 118.95 124.33 2dmj s ARG 41 Ca 0.54 -1.83 0.04 0.00 -0.47 0.00 0.00 55.73 54.01 2dmj s ARG 41 Cb -0.13 -0.30 -0.04 0.00 -0.57 0.00 0.00 34.95 33.91 2dmj s ARG 41 CO 0.27 -0.33 0.01 -1.64 -1.08 0.00 0.00 175.30 172.53 2dmj s MET 42 N -3.96 2.06 0.02 3.89 -1.94 -0.93 -2.58 119.30 115.85 2dmj s MET 42 Ca 0.37 -2.25 -0.03 0.00 -1.71 0.00 0.00 55.69 52.07 2dmj s MET 42 Cb 0.07 -1.49 -0.01 0.00 2.01 0.00 0.00 34.83 35.40 2dmj s MET 42 CO 0.15 -0.23 0.03 0.00 -0.01 0.00 0.00 175.02 174.95 2dmj s ALA 43 N -2.85 -0.02 -0.02 3.03 0.00 -1.03 -2.16 121.76 118.72 2dmj s ALA 43 Ca 0.20 -0.46 0.01 0.00 0.00 0.00 0.00 51.96 51.71 2dmj s ALA 43 Cb 0.05 0.14 0.01 0.00 0.00 0.00 0.00 23.12 23.33 2dmj s ALA 43 CO 0.10 -0.19 -0.03 0.42 0.00 0.00 0.00 175.76 176.07 2dmj s ILE 44 N -1.53 0.28 -0.76 0.00 1.01 0.80 -3.13 121.20 117.87 2dmj s ILE 44 Ca -0.15 -0.07 -0.18 0.00 0.00 0.00 0.00 60.65 60.25 2dmj s ILE 44 Cb -0.09 -0.29 0.13 0.00 0.01 0.00 0.00 42.46 42.23 2dmj s ILE 44 CO -0.00 0.12 0.89 -0.04 0.00 0.00 0.00 174.94 175.90 2dmj s MET 45 N 0.39 3.34 0.40 2.79 -1.94 -1.11 -0.16 119.30 123.00 2dmj s MET 45 Ca -0.04 -1.63 0.08 0.00 -1.71 0.00 0.00 55.69 52.39 2dmj s MET 45 Cb -0.07 -4.51 -0.06 0.00 2.01 0.00 0.00 34.83 32.20 2dmj s MET 45 CO -0.01 -1.61 0.11 0.14 -0.01 0.00 0.00 175.02 173.65 2dmj s VAL 46 N 2.37 2.31 0.08 -6.03 -7.23 -1.16 -4.93 120.40 105.81 2dmj s VAL 46 Ca 0.21 -1.81 0.02 0.00 -1.81 0.00 0.00 61.98 58.59 2dmj s VAL 46 Cb -0.14 -2.97 -0.04 0.00 0.56 0.00 0.00 36.38 33.79 2dmj s VAL 46 CO -0.02 -0.04 0.15 -1.58 -0.31 0.00 0.00 175.10 173.31 2dmj s GLN 47 N -3.83 3.17 0.05 4.82 0.74 -1.26 -0.14 119.66 123.21 2dmj s GLN 47 Ca 0.39 -0.58 0.08 0.00 0.05 0.00 0.00 55.36 55.30 2dmj s GLN 47 Cb 0.04 -2.88 -0.03 0.00 1.10 0.00 0.00 33.01 31.25 2dmj s GLN 47 CO 0.21 0.58 -0.23 0.45 -0.55 0.00 0.00 175.29 175.75 2dmj s SER 48 N -2.53 3.44 0.07 6.67 0.15 0.11 -4.91 113.70 116.70 2dmj s SER 48 Ca 0.32 -0.53 -0.17 0.00 0.70 0.00 0.00 55.95 56.27 2dmj s SER 48 Cb -0.12 -0.42 -0.11 0.00 -1.71 0.00 0.00 66.02 63.66 2dmj s SER 48 CO 0.25 0.25 1.39 1.55 1.20 0.00 0.00 173.24 177.88 2dmj h PRO 49 N 4.63 0.55 0.12 5.44 0.13 -1.97 -1.43 132.00 139.47 2dmj h PRO 49 Ca -0.47 -0.29 -0.22 0.00 -0.87 0.00 0.00 66.00 64.15 2dmj h PRO 49 Cb 1.15 0.01 0.02 0.00 0.13 0.00 0.00 31.00 32.31 2dmj h PRO 49 CO 0.45 0.87 -0.92 0.52 -0.23 0.00 0.00 178.00 178.69 2dmj h MET 50 N 0.24 0.41 0.00 0.86 2.86 -1.97 -3.20 114.93 114.14 2dmj h MET 50 Ca 0.04 -0.60 0.00 0.00 -2.06 0.00 0.00 59.70 57.07 2dmj h MET 50 Cb 0.77 0.21 0.00 0.00 0.06 0.00 0.00 31.60 32.64 2dmj h MET 50 CO 0.05 1.26 0.00 0.34 1.06 0.00 0.00 176.91 179.63 2dmj n PHE 51 N -4.04 0.00 -2.84 -0.22 7.35 -1.25 -4.84 117.46 111.62 2dmj n PHE 51 Ca -0.13 0.00 -0.17 0.00 -0.76 0.00 0.00 57.45 56.38 2dmj n PHE 51 Cb 0.85 -0.08 -0.03 0.00 0.35 0.00 0.00 39.48 40.57 2dmj n PHE 51 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 2dmj n ASP 52 N -1.08 -0.99 -0.36 -2.13 8.00 -0.54 -4.70 116.55 114.75 2dmj n ASP 52 Ca 0.16 -0.36 0.00 0.00 0.71 0.00 0.00 54.79 55.29 2dmj n ASP 52 Cb 0.11 -0.90 0.00 0.00 -0.02 0.00 0.00 41.12 40.31 2dmj n ASP 52 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dmj n GLY 53 N -0.65 2.73 3.81 0.44 0.00 -1.20 -4.96 105.19 105.36 2dmj n GLY 53 Ca 0.05 -0.88 -0.36 0.00 0.00 0.00 0.00 46.02 44.83 2dmj n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dmj s LYS 54 N -0.09 3.43 -0.01 1.61 1.02 -1.26 0.06 119.74 124.51 2dmj s LYS 54 Ca 0.00 -0.21 0.01 0.00 0.02 0.00 0.00 55.97 55.80 2dmj s LYS 54 Cb 0.00 -3.13 0.00 0.00 -0.52 0.00 0.00 37.83 34.19 2dmj s LYS 54 CO 0.00 0.70 -0.04 0.14 -0.92 0.00 0.00 175.35 175.23 2dmj s VAL 55 N -0.82 0.38 -0.09 3.17 -7.23 0.80 -4.95 120.40 111.66 2dmj s VAL 55 Ca 0.13 -0.17 -0.30 0.00 -1.81 0.00 0.00 61.98 59.84 2dmj s VAL 55 Cb -0.12 -0.35 -0.04 0.00 0.56 0.00 0.00 36.38 36.43 2dmj s VAL 55 CO 0.03 0.13 1.52 -2.16 -0.31 0.00 0.00 175.10 174.30 2dmj s PRO 56 N 0.10 4.19 -0.30 4.82 0.04 -1.26 -2.97 135.00 139.62 2dmj s PRO 56 Ca -0.01 2.00 -0.09 0.00 0.04 0.00 0.00 61.00 62.95 2dmj s PRO 56 Cb -0.04 -3.91 -0.00 0.00 0.04 0.00 0.00 34.50 30.58 2dmj s PRO 56 CO -0.00 -0.80 0.12 -1.01 0.04 0.00 0.00 177.00 175.35 2dmj s HIS 57 N 3.87 3.16 -0.08 0.56 3.76 0.77 -4.87 115.29 122.45 2dmj s HIS 57 Ca 0.67 -0.73 -0.15 0.00 -0.15 0.00 0.00 55.06 54.70 2dmj s HIS 57 Cb -0.29 -2.31 -0.05 0.00 1.11 0.00 0.00 32.58 31.03 2dmj s HIS 57 CO 0.24 -0.50 0.39 -1.58 -0.85 0.00 0.00 174.74 172.44 2dmj s TRP 58 N 1.57 3.58 0.14 1.40 0.52 -1.26 -0.14 118.94 124.75 2dmj s TRP 58 Ca 0.04 0.84 0.07 0.00 0.02 0.00 0.00 56.10 57.07 2dmj s TRP 58 Cb -0.17 -2.38 -0.04 0.00 -1.15 0.00 0.00 33.47 29.73 2dmj s TRP 58 CO 0.05 0.38 -0.15 0.71 0.02 0.00 0.00 176.95 177.96 2dmj s TYR 59 N -0.11 1.55 0.33 -1.98 1.51 -0.92 -3.92 117.35 113.81 2dmj s TYR 59 Ca 0.22 -0.54 -0.28 0.00 -1.01 0.00 0.00 57.07 55.46 2dmj s TYR 59 Cb -0.15 -0.79 -0.10 0.00 -0.11 0.00 0.00 41.96 40.81 2dmj s TYR 59 CO 0.10 0.21 1.27 -1.01 -1.11 0.00 0.00 175.55 175.00 2dmj s HIS 60 N -2.19 3.11 0.28 2.71 3.76 -1.26 -2.19 115.29 119.51 2dmj s HIS 60 Ca 0.12 1.47 0.19 0.00 -0.15 0.00 0.00 55.06 56.69 2dmj s HIS 60 Cb -0.05 -3.60 0.98 0.00 1.11 0.00 0.00 32.58 31.02 2dmj s HIS 60 CO 0.04 -1.64 1.08 0.34 -0.85 0.00 0.00 174.74 173.71 2dmj n PHE 61 N 0.76 0.63 -0.08 1.40 7.35 -1.22 -0.09 117.46 126.21 2dmj n PHE 61 Ca 0.00 0.64 -0.11 0.00 -0.76 0.00 0.00 57.45 57.23 2dmj n PHE 61 Cb 0.43 -1.05 -0.06 0.00 0.35 0.00 0.00 39.48 39.15 2dmj n PHE 61 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 2dmj h SER 62 N 0.00 0.00 -0.68 -2.13 4.64 -1.89 -3.38 113.55 110.11 2dmj h SER 62 Ca 0.60 -0.25 0.13 0.00 -0.47 0.00 0.00 61.79 61.79 2dmj h SER 62 Cb 1.77 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.73 2dmj h SER 62 CO -0.42 0.99 -0.28 0.00 -0.87 0.00 0.00 176.83 176.25 2dmj h PHE 64 N -0.09 0.47 0.04 0.00 3.04 -0.70 0.91 116.94 120.61 2dmj h PHE 64 Ca 0.29 0.02 -0.27 0.00 3.98 0.00 0.00 57.97 61.98 2dmj h PHE 64 Cb 0.55 -0.12 -0.03 0.00 2.56 0.00 0.00 35.95 38.91 2dmj h PHE 64 CO -0.64 -0.12 -1.46 -1.49 -2.02 0.00 0.00 178.31 172.58 2dmj h TRP 65 N 0.14 0.14 -0.18 0.41 -0.00 -0.22 -3.33 115.95 112.90 2dmj h TRP 65 Ca 0.76 -0.10 0.05 0.00 -0.00 0.00 0.00 58.89 59.60 2dmj h TRP 65 Cb 2.42 -0.01 -0.05 0.00 -0.00 0.00 0.00 29.16 31.52 2dmj h TRP 65 CO -0.00 1.13 -0.15 0.87 -0.00 0.00 0.00 178.44 180.29 2dmj h LYS 66 N 0.02 -0.16 -0.82 0.49 1.57 0.25 -1.84 116.57 116.10 2dmj h LYS 66 Ca -0.20 0.01 0.18 0.00 -1.87 0.00 0.00 60.65 58.77 2dmj h LYS 66 Cb 1.94 0.04 -0.11 0.00 0.08 0.00 0.00 32.23 34.18 2dmj h LYS 66 CO 0.12 -0.10 0.32 -0.39 -0.57 0.00 0.00 179.45 178.82 2dmj h VAL 67 N -0.16 0.56 0.00 0.50 -1.51 -1.56 -3.46 116.25 110.62 2dmj h VAL 67 Ca 0.11 -0.14 0.00 0.00 -1.23 0.00 0.00 66.70 65.44 2dmj h VAL 67 Cb 0.33 0.12 0.00 0.00 -2.13 0.00 0.00 31.29 29.61 2dmj h VAL 67 CO -0.28 0.07 0.00 0.61 -1.23 0.00 0.00 177.57 176.74 2dmj n GLY 68 N -1.34 0.93 3.31 5.19 0.00 -0.69 -5.09 105.19 107.50 2dmj n GLY 68 Ca 0.17 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.73 2dmj n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2dmj s HIS 69 N -0.53 3.45 0.20 1.61 3.76 -1.25 -5.05 115.29 117.48 2dmj s HIS 69 Ca 0.00 -1.59 -0.28 0.00 -0.15 0.00 0.00 55.06 53.04 2dmj s HIS 69 Cb 0.00 -3.79 -0.08 0.00 1.11 0.00 0.00 32.58 29.82 2dmj s HIS 69 CO 0.00 -1.01 0.87 -1.12 -0.85 0.00 0.00 174.74 172.64 2dmj s SER 70 N 3.00 7.53 -0.30 1.40 0.01 -1.26 -4.87 113.70 119.20 2dmj s SER 70 Ca 0.09 1.81 -0.02 0.00 1.31 0.00 0.00 55.95 59.14 2dmj s SER 70 Cb -0.22 -2.56 0.10 0.00 0.21 0.00 0.00 66.02 63.54 2dmj s SER 70 CO -0.02 0.16 0.11 -0.63 0.41 0.00 0.00 173.24 173.26 2dmj s ILE 71 N -1.03 0.65 0.09 1.44 1.01 -1.26 -5.03 121.20 117.07 2dmj s ILE 71 Ca 0.39 -1.24 -0.26 0.00 0.00 0.00 0.00 60.65 59.54 2dmj s ILE 71 Cb -0.25 -1.50 -0.09 0.00 0.01 0.00 0.00 42.46 40.63 2dmj s ILE 71 CO 0.29 -0.69 1.42 0.03 0.00 0.00 0.00 174.94 176.00 2dmj h ARG 72 N 8.17 -0.38 -3.57 2.79 2.47 -1.96 -3.36 114.38 118.53 2dmj h ARG 72 Ca -0.15 0.03 -0.62 0.00 -1.26 0.00 0.00 59.98 57.98 2dmj h ARG 72 Cb 1.01 0.09 -0.40 0.00 -1.65 0.00 0.00 29.97 29.02 2dmj h ARG 72 CO 0.46 -0.26 -0.72 -1.01 0.56 0.00 0.00 179.97 179.01 2dmj s HIS 73 N -5.06 2.51 0.15 3.04 3.76 -1.26 -4.83 115.29 113.61 2dmj s HIS 73 Ca -0.12 -2.51 0.32 0.00 -0.15 0.00 0.00 55.06 52.60 2dmj s HIS 73 Cb 0.06 -2.24 1.33 0.00 1.11 0.00 0.00 32.58 32.84 2dmj s HIS 73 CO 0.47 -0.83 1.98 -1.00 -0.85 0.00 0.00 174.74 174.50 2dmj h PRO 74 N 7.22 0.00 -0.85 8.40 0.13 -1.92 0.10 132.00 145.08 2dmj h PRO 74 Ca -0.06 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 65.13 2dmj h PRO 74 Cb 0.96 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.04 2dmj h PRO 74 CO 0.53 0.05 0.56 0.38 -0.23 0.00 0.00 178.00 179.28 2dmj h ASP 75 N 0.00 0.84 0.00 1.44 2.03 -1.93 -1.60 116.42 117.20 2dmj h ASP 75 Ca -0.00 0.00 -0.20 0.00 -0.73 0.00 0.00 57.03 56.11 2dmj h ASP 75 Cb 0.53 -0.18 -0.03 0.00 -0.83 0.00 0.00 39.33 38.82 2dmj h ASP 75 CO 0.01 0.54 -1.69 1.33 -1.03 0.00 0.00 179.24 178.40 2dmj n VAL 76 N -4.48 0.68 -0.10 4.15 0.24 -1.15 -4.47 118.33 113.19 2dmj n VAL 76 Ca 0.13 -0.21 -0.06 0.00 -2.04 0.00 0.00 64.34 62.15 2dmj n VAL 76 Cb 0.20 -1.36 0.01 0.00 -1.47 0.00 0.00 33.84 31.22 2dmj n VAL 76 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 2dmj h GLU 77 N -0.27 0.26 -5.49 7.34 5.08 -0.90 -3.40 114.58 117.21 2dmj h GLU 77 Ca -0.29 -0.02 -0.59 0.00 -1.00 0.00 0.00 59.36 57.46 2dmj h GLU 77 Cb 1.33 -0.06 -0.10 0.00 0.50 0.00 0.00 28.75 30.42 2dmj h GLU 77 CO -0.13 0.17 -0.33 0.08 -1.00 0.00 0.00 179.01 177.80 2dmj s VAL 78 N -6.16 5.31 0.77 3.13 1.01 -0.60 -4.24 120.40 119.62 2dmj s VAL 78 Ca -0.13 0.54 -0.12 0.00 0.00 0.00 0.00 61.98 62.27 2dmj s VAL 78 Cb 0.12 -3.63 0.05 0.00 0.00 0.00 0.00 36.38 32.93 2dmj s VAL 78 CO 0.71 0.39 1.11 -0.62 0.00 0.00 0.00 175.10 176.69 2dmj s ASP 79 N 0.44 4.81 0.00 3.32 -1.08 -0.39 -3.88 116.67 119.89 2dmj s ASP 79 Ca 0.16 1.18 0.00 0.00 -0.52 0.00 0.00 52.55 53.37 2dmj s ASP 79 Cb -0.13 -1.91 0.00 0.00 -1.46 0.00 0.00 42.92 39.42 2dmj s ASP 79 CO 0.04 -1.75 0.00 0.61 0.52 0.00 0.00 175.17 174.58 2dmj n GLY 80 N -2.55 1.60 0.36 2.66 0.00 -1.26 -1.23 105.19 104.77 2dmj n GLY 80 Ca 0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 2dmj n GLY 80 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2dmj n PHE 81 N 0.00 -0.04 -0.27 1.61 -0.00 -1.25 0.11 117.46 117.62 2dmj n PHE 81 Ca 0.00 1.13 0.02 0.00 -0.00 0.00 0.00 57.45 58.60 2dmj n PHE 81 Cb 0.00 -0.80 0.15 0.00 -0.00 0.00 0.00 39.48 38.83 2dmj n PHE 81 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 2dmj h SER 82 N 0.00 0.60 -0.76 -2.13 0.87 -1.85 -1.54 113.55 108.74 2dmj h SER 82 Ca 0.29 0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.90 2dmj h SER 82 Cb 0.52 -0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 62.38 2dmj h SER 82 CO -0.90 0.34 0.44 -0.33 -0.53 0.00 0.00 176.83 175.85 2dmj h GLU 83 N 0.72 1.04 -6.59 2.24 5.08 0.43 -3.44 114.58 114.06 2dmj h GLU 83 Ca 0.38 -0.10 -0.47 0.00 -1.00 0.00 0.00 59.36 58.17 2dmj h GLU 83 Cb 0.36 -0.21 0.24 0.00 0.50 0.00 0.00 28.75 29.63 2dmj h GLU 83 CO -0.25 0.75 -1.27 1.28 -1.00 0.00 0.00 179.01 178.52 2dmj n LEU 84 N -4.48 -2.31 -4.91 1.33 4.77 0.02 -4.98 117.00 106.45 2dmj n LEU 84 Ca 0.07 -0.07 -0.27 0.00 -0.03 0.00 0.00 56.01 55.70 2dmj n LEU 84 Cb 0.07 -0.91 0.02 0.00 -2.33 0.00 0.00 43.42 40.26 2dmj n LEU 84 CO 0.37 -3.10 0.53 -0.13 -1.33 0.00 0.00 177.39 173.73 2dmj s ARG 85 N -3.26 3.16 0.20 3.23 1.81 -1.26 -4.81 118.95 118.02 2dmj s ARG 85 Ca 0.53 0.13 -0.18 0.00 -1.72 0.00 0.00 55.73 54.49 2dmj s ARG 85 Cb -0.10 -2.28 0.17 0.00 -0.45 0.00 0.00 34.95 32.29 2dmj s ARG 85 CO 0.66 -0.55 1.59 2.35 -0.68 0.00 0.00 175.30 178.68 2dmj h TRP 86 N -0.08 -0.79 0.11 -0.53 7.01 -1.94 0.72 115.95 120.45 2dmj h TRP 86 Ca -0.46 0.07 0.01 0.00 2.11 0.00 0.00 58.89 60.62 2dmj h TRP 86 Cb 1.24 0.44 -0.04 0.00 -2.10 0.00 0.00 29.16 28.70 2dmj h TRP 86 CO 0.52 -0.36 -0.45 -0.44 -2.79 0.00 0.00 178.44 174.92 2dmj h ASP 87 N -0.11 -1.34 -0.20 2.65 3.32 -2.00 -2.50 116.42 116.23 2dmj h ASP 87 Ca 0.27 0.14 0.05 0.00 0.02 0.00 0.00 57.03 57.51 2dmj h ASP 87 Cb 0.55 0.49 -0.07 0.00 0.22 0.00 0.00 39.33 40.52 2dmj h ASP 87 CO -0.71 -0.47 -0.41 0.44 -1.72 0.00 0.00 179.24 176.37 2dmj h ASP 88 N -0.64 -1.30 -0.95 6.45 5.19 -1.73 -0.51 116.42 122.92 2dmj h ASP 88 Ca -0.01 0.18 0.32 0.00 -0.62 0.00 0.00 57.03 56.90 2dmj h ASP 88 Cb 0.64 0.54 -0.17 0.00 0.18 0.00 0.00 39.33 40.52 2dmj h ASP 88 CO -0.24 -0.40 0.23 0.00 -3.12 0.00 0.00 179.24 175.71 2dmj n GLN 89 N -5.43 -0.07 0.13 3.56 6.02 0.17 -0.46 117.38 121.31 2dmj n GLN 89 Ca -0.03 1.37 -0.11 0.00 -0.01 0.00 0.00 57.00 58.22 2dmj n GLN 89 Cb 0.36 -2.30 -0.07 0.00 1.02 0.00 0.00 30.24 29.25 2dmj n GLN 89 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 2dmj h GLN 90 N 0.00 -0.38 -0.97 -1.09 1.08 -0.70 -2.17 115.11 110.88 2dmj h GLN 90 Ca 0.67 0.03 0.18 0.00 -1.45 0.00 0.00 58.65 58.08 2dmj h GLN 90 Cb 1.59 0.09 -0.17 0.00 -0.05 0.00 0.00 27.48 28.93 2dmj h GLN 90 CO -0.82 -0.05 -0.31 -0.22 -0.95 0.00 0.00 178.83 176.48 2dmj h LYS 91 N -0.93 -0.01 -0.33 1.46 3.64 0.28 0.89 116.57 121.57 2dmj h LYS 91 Ca -0.04 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.25 2dmj h LYS 91 Cb 0.51 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.31 2dmj h LYS 91 CO 0.07 -0.00 -0.19 0.28 -2.27 0.00 0.00 179.45 177.34 2dmj h VAL 92 N -0.01 1.26 0.31 2.00 2.07 -1.30 -2.41 116.25 118.17 2dmj h VAL 92 Ca 0.41 -1.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.71 2dmj h VAL 92 Cb 0.66 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 2dmj h VAL 92 CO -0.99 0.40 -0.15 0.11 0.02 0.00 0.00 177.57 176.96 2dmj h LYS 93 N 0.55 -0.40 -0.40 1.57 1.57 0.14 0.18 116.57 119.78 2dmj h LYS 93 Ca 0.09 0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.98 2dmj h LYS 93 Cb 0.63 0.09 -0.09 0.00 0.08 0.00 0.00 32.23 32.94 2dmj h LYS 93 CO 0.04 -0.27 -0.25 1.57 -0.57 0.00 0.00 179.45 179.98 2dmj h LYS 94 N -0.42 -0.17 0.19 3.15 2.10 -1.09 -2.19 116.57 118.14 2dmj h LYS 94 Ca -0.04 0.01 0.01 0.00 -2.00 0.00 0.00 60.65 58.63 2dmj h LYS 94 Cb 0.32 0.04 -0.04 0.00 -0.90 0.00 0.00 32.23 31.65 2dmj h LYS 94 CO 0.07 -0.11 -0.40 1.15 -2.00 0.00 0.00 179.45 178.16 2dmj h THR 95 N -0.18 0.19 -0.81 0.07 2.02 -1.44 -2.83 112.91 109.93 2dmj h THR 95 Ca 0.19 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.45 2dmj h THR 95 Cb 0.48 0.19 -0.11 0.00 -1.74 0.00 0.00 68.15 66.97 2dmj h THR 95 CO -0.50 0.00 -0.55 0.00 0.37 0.00 0.00 175.52 174.83 2dmj h ALA 96 N -0.19 -0.54 -0.92 6.16 0.00 -0.08 0.33 119.26 124.03 2dmj h ALA 96 Ca 0.01 0.10 0.25 0.00 0.00 0.00 0.00 54.91 55.27 2dmj h ALA 96 Cb 0.67 1.25 -0.16 0.00 0.00 0.00 0.00 17.79 19.56 2dmj h ALA 96 CO -0.19 -0.95 0.14 0.93 0.00 0.00 0.00 179.25 179.17 2dmj h GLU 97 N -0.12 0.09 -0.35 0.00 5.08 -1.18 0.36 114.58 118.46 2dmj h GLU 97 Ca 0.15 -0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.43 2dmj h GLU 97 Cb 0.49 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2dmj h GLU 97 CO -0.83 0.06 -0.09 0.00 -1.00 0.00 0.00 179.01 177.15 2dmj h ALA 98 N 1.87 0.49 0.00 3.43 0.00 -0.28 -3.48 119.26 121.29 2dmj h ALA 98 Ca 0.57 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2dmj h ALA 98 Cb 1.19 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2dmj h ALA 98 CO -0.78 0.34 0.00 0.41 0.00 0.00 0.00 179.25 179.22 2dmj n GLY 99 N -0.17 2.65 3.49 0.00 0.00 0.13 -4.91 105.19 106.38 2dmj n GLY 99 Ca -0.02 -0.61 -0.07 0.00 0.00 0.00 0.00 46.02 45.32 2dmj n GLY 99 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dmj s GLY 100 N 0.00 -0.53 -0.27 -0.02 0.00 -1.26 -4.68 107.32 100.56 2dmj s GLY 100 Ca 0.00 2.06 -0.13 0.00 0.00 0.00 0.00 44.72 46.65 2dmj s GLY 100 CO 0.00 2.29 0.28 -0.45 0.00 0.00 0.00 173.10 175.22 2dmj s SER 101 N 1.84 6.16 0.00 1.64 0.15 -1.26 -5.04 113.70 117.19 2dmj s SER 101 Ca -0.08 0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.73 2dmj s SER 101 Cb -0.08 -2.17 0.00 0.00 -1.71 0.00 0.00 66.02 62.07 2dmj s SER 101 CO -0.17 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 174.78 2dmj n GLY 102 N 4.76 -1.28 3.56 9.45 0.00 -1.26 -4.49 105.19 115.92 2dmj n GLY 102 Ca -0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.63 2dmj n GLY 102 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dmj s PRO 103 N 0.00 2.56 0.06 1.61 0.04 -1.26 -4.92 135.00 133.09 2dmj s PRO 103 Ca 0.00 -0.19 0.01 0.00 0.04 0.00 0.00 61.00 60.86 2dmj s PRO 103 Cb 0.00 -4.98 -0.03 0.00 0.04 0.00 0.00 34.50 29.52 2dmj s PRO 103 CO 0.00 -3.30 -0.05 -1.54 0.04 0.00 0.00 177.00 172.14 2dmj s SER 104 N 8.05 0.72 0.18 6.66 1.04 -1.26 -5.06 113.70 124.03 2dmj s SER 104 Ca 0.70 -0.81 -0.22 0.00 0.48 0.00 0.00 55.95 56.10 2dmj s SER 104 Cb -0.07 0.11 0.10 0.00 0.10 0.00 0.00 66.02 66.26 2dmj s SER 104 CO 0.02 -0.42 1.58 -1.28 0.98 0.00 0.00 173.24 174.12 2dmj h SER 105 N 3.67 -1.22 0.00 7.02 0.87 -1.97 -3.54 113.55 118.39 2dmj h SER 105 Ca -0.34 0.23 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2dmj h SER 105 Cb 1.17 0.59 0.00 0.00 -0.44 0.00 0.00 62.40 63.72 2dmj h SER 105 CO 0.55 -0.31 0.00 0.61 -0.53 0.00 0.00 176.83 177.15