#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j00 n ARG 3 N 0.00 -0.99 0.00 1.61 -4.01 -1.26 -4.20 116.66 107.81 2j00 n ARG 3 Ca 0.00 0.01 0.00 0.00 -1.04 0.00 0.00 57.85 56.82 2j00 n ARG 3 Cb 0.00 -0.21 0.00 0.00 -3.04 0.00 0.00 32.46 29.21 2j00 n ARG 3 CO 0.00 0.00 0.00 0.98 -3.04 0.00 0.00 177.63 175.57 2j00 n TYR 4 N -0.97 0.00 -0.19 2.89 9.36 -1.26 -4.86 117.16 122.13 2j00 n TYR 4 Ca -0.01 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.21 2j00 n TYR 4 Cb 0.03 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.74 2j00 n TYR 4 CO 0.00 0.00 0.00 -0.89 0.22 0.00 0.00 176.86 176.19 2j00 n ILE 5 N 0.00 -0.82 0.00 2.97 5.41 -1.26 -5.11 119.36 120.55 2j00 n ILE 5 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2j00 n ILE 5 Cb 0.00 -0.82 0.00 0.00 -0.71 0.00 0.00 39.64 38.11 2j00 n ILE 5 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2j00 n GLY 6 N 1.66 0.47 3.56 7.39 0.00 -1.26 -5.06 105.19 111.94 2j00 n GLY 6 Ca 0.00 -2.29 -0.56 0.00 0.00 0.00 0.00 46.02 43.18 2j00 n GLY 6 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2j00 n PRO 7 N -0.35 0.59 0.01 1.61 -0.02 -1.26 -4.91 135.00 130.68 2j00 n PRO 7 Ca 0.00 0.21 -0.01 0.00 -2.02 0.00 0.00 63.50 61.68 2j00 n PRO 7 Cb 0.00 -1.79 -0.00 0.00 -0.02 0.00 0.00 33.50 31.69 2j00 n PRO 7 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2j00 n VAL 8 N 2.17 0.56 -1.27 -1.45 0.24 -1.26 -4.65 118.33 112.67 2j00 n VAL 8 Ca 0.20 0.15 -0.42 0.00 -2.04 0.00 0.00 64.34 62.22 2j00 n VAL 8 Cb 0.13 -1.57 -0.04 0.00 -1.47 0.00 0.00 33.84 30.89 2j00 n VAL 8 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2j00 n ARG 10 N 6.65 0.01 0.00 0.00 0.63 -1.26 -4.74 116.66 117.95 2j00 n ARG 10 Ca 0.50 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.43 2j00 n ARG 10 Cb 0.39 -0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.30 2j00 n ARG 10 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2j00 n LEU 11 N 0.00 1.56 0.13 6.15 4.77 0.43 -4.10 117.00 125.93 2j00 n LEU 11 Ca 0.00 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.01 2j00 n LEU 11 Cb 0.00 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.25 2j00 n LEU 11 CO 0.00 0.26 0.72 0.00 -1.33 0.00 0.00 177.39 177.04 2j00 n ARG 13 N -1.76 3.45 0.00 0.00 1.74 -1.26 -4.35 116.66 114.48 2j00 n ARG 13 Ca -0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2j00 n ARG 13 Cb 0.46 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.90 2j00 n ARG 13 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2j00 n ARG 14 N 0.00 0.00 0.15 5.56 3.00 -1.25 -1.22 116.66 122.89 2j00 n ARG 14 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 57.85 57.97 2j00 n ARG 14 Cb 0.00 0.00 0.30 0.00 0.00 0.00 0.00 32.46 32.76 2j00 n ARG 14 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2j00 h GLU 15 N 0.00 0.00 0.00 -0.14 3.07 -1.90 -3.44 114.58 112.17 2j00 h GLU 15 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2j00 h GLU 15 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2j00 h GLU 15 CO 0.00 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.02 2j00 n GLY 16 N -1.53 2.08 3.70 -3.84 0.00 -0.36 -4.89 105.19 100.35 2j00 n GLY 16 Ca 0.07 -0.08 -0.56 0.00 0.00 0.00 0.00 46.02 45.45 2j00 n GLY 16 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2j00 n VAL 17 N 0.00 0.34 -2.01 1.61 0.31 -1.26 -4.74 118.33 112.59 2j00 n VAL 17 Ca 0.00 -0.07 -0.42 0.00 -0.01 0.00 0.00 64.34 63.84 2j00 n VAL 17 Cb 0.00 -1.33 -0.03 0.00 -0.91 0.00 0.00 33.84 31.57 2j00 n VAL 17 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2j00 s LYS 18 N 3.77 4.21 0.07 5.55 2.20 -1.26 -4.78 119.74 129.50 2j00 s LYS 18 Ca 0.98 2.22 0.06 0.00 -0.36 0.00 0.00 55.97 58.88 2j00 s LYS 18 Cb -1.01 -3.69 -0.03 0.00 -1.51 0.00 0.00 37.83 31.59 2j00 s LYS 18 CO 0.63 -0.73 -0.18 -0.48 -0.36 0.00 0.00 175.35 174.24 2j00 s LEU 19 N 2.92 2.24 -0.40 5.43 0.05 -1.26 -5.01 118.68 122.65 2j00 s LEU 19 Ca 0.72 -0.58 -0.19 0.00 0.05 0.00 0.00 54.13 54.13 2j00 s LEU 19 Cb -0.37 -0.74 0.01 0.00 -2.05 0.00 0.00 46.19 43.04 2j00 s LEU 19 CO 0.31 0.04 0.53 -0.31 -0.55 0.00 0.00 176.35 176.36 2j00 s TYR 20 N -1.04 3.14 -0.03 3.48 1.51 -1.26 -4.69 117.35 118.46 2j00 s TYR 20 Ca 0.03 -0.08 0.07 0.00 -1.01 0.00 0.00 57.07 56.09 2j00 s TYR 20 Cb -0.09 -3.05 -0.11 0.00 -0.11 0.00 0.00 41.96 38.59 2j00 s TYR 20 CO 0.03 -0.70 0.13 1.28 -1.11 0.00 0.00 175.55 175.18 2j00 n LEU 21 N 5.87 0.00 -0.05 -1.29 4.77 -1.26 -4.69 117.00 120.35 2j00 n LEU 21 Ca -0.05 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.92 2j00 n LEU 21 Cb 0.48 0.04 -0.11 0.00 -2.33 0.00 0.00 43.42 41.50 2j00 n LEU 21 CO 0.48 0.04 -0.86 0.29 -1.33 0.00 0.00 177.39 176.02 2j00 n LYS 22 N -1.89 1.22 0.00 3.23 5.02 -1.26 -4.66 118.16 119.82 2j00 n LYS 22 Ca -0.04 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.19 2j00 n LYS 22 Cb 0.33 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 33.98 2j00 n LYS 22 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2j00 n GLY 23 N 1.94 1.58 0.25 0.72 0.00 -1.26 -4.46 105.19 103.95 2j00 n GLY 23 Ca -0.15 -0.38 -0.06 0.00 0.00 0.00 0.00 46.02 45.42 2j00 n GLY 23 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2j00 n GLU 24 N 0.18 -0.26 -0.16 1.61 0.00 -1.26 0.24 120.64 120.99 2j00 n GLU 24 Ca 0.00 0.93 -0.11 0.00 0.00 0.00 0.00 57.16 57.98 2j00 n GLU 24 Cb 0.00 -1.37 0.01 0.00 0.00 0.00 0.00 31.44 30.08 2j00 n GLU 24 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.13 177.04 2j00 h ARG 25 N 0.00 0.98 -1.82 5.31 2.43 -1.99 -2.94 114.38 116.36 2j00 h ARG 25 Ca 0.09 -0.41 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 2j00 h ARG 25 Cb 0.24 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 2j00 h ARG 25 CO -0.55 1.09 0.00 0.00 -1.51 0.00 0.00 179.97 178.99 2j00 n TYR 27 N 1.22 0.00 -0.30 0.00 4.02 -1.11 -4.83 117.16 116.16 2j00 n TYR 27 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.62 2j00 n TYR 27 Cb 0.14 0.00 0.26 0.00 -0.02 0.00 0.00 39.34 39.72 2j00 n TYR 27 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 2j00 n SER 28 N -0.17 -3.87 -2.58 7.72 7.64 0.25 -4.78 113.62 117.82 2j00 n SER 28 Ca 0.00 -0.75 -0.30 0.00 1.01 0.00 0.00 58.87 58.83 2j00 n SER 28 Cb 0.00 -0.94 -0.03 0.00 -1.01 0.00 0.00 64.21 62.22 2j00 n SER 28 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2j00 n PRO 29 N -4.77 2.48 -2.56 1.43 -0.04 -1.26 -4.33 135.00 125.95 2j00 n PRO 29 Ca 0.12 -2.62 -0.04 0.00 -0.04 0.00 0.00 63.50 60.91 2j00 n PRO 29 Cb 0.53 -2.17 0.08 0.00 -0.04 0.00 0.00 33.50 31.90 2j00 n PRO 29 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2j00 n LYS 30 N 0.51 0.90 0.00 0.54 2.85 -1.26 -4.87 118.16 116.84 2j00 n LYS 30 Ca 0.50 -1.24 0.03 0.00 -1.05 0.00 0.00 58.31 56.55 2j00 n LYS 30 Cb 0.48 0.09 0.16 0.00 -0.65 0.00 0.00 35.03 35.11 2j00 n LYS 30 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2j00 n ALA 32 N -0.62 0.00 -0.06 0.00 0.00 -1.26 -4.46 120.51 114.11 2j00 n ALA 32 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.34 2j00 n ALA 32 Cb 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.44 2j00 n ALA 32 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 2j00 h MET 33 N 0.13 0.81 0.00 0.00 1.85 -1.85 5.98 114.93 121.84 2j00 h MET 33 Ca 0.00 -0.53 0.00 0.00 -0.61 0.00 0.00 59.70 58.56 2j00 h MET 33 Cb 0.00 0.07 0.00 0.00 0.43 0.00 0.00 31.60 32.10 2j00 h MET 33 CO 0.00 1.16 0.00 -1.91 -0.40 0.00 0.00 176.91 175.76 2j00 n GLU 34 N -3.99 0.09 -0.05 0.39 4.07 -1.26 -2.93 120.64 116.96 2j00 n GLU 34 Ca -0.04 0.31 -0.05 0.00 -0.06 0.00 0.00 57.16 57.32 2j00 n GLU 34 Cb 0.64 -1.66 -0.06 0.00 -0.06 0.00 0.00 31.44 30.30 2j00 n GLU 34 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 2j00 n ARG 35 N -1.82 1.79 -3.76 5.31 1.74 -0.38 -4.90 116.66 114.64 2j00 n ARG 35 Ca 0.03 0.02 -0.30 0.00 -0.77 0.00 0.00 57.85 56.83 2j00 n ARG 35 Cb 0.20 -1.21 -0.15 0.00 -1.02 0.00 0.00 32.46 30.28 2j00 n ARG 35 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2j00 s ARG 36 N -2.21 0.87 0.00 5.56 3.00 1.93 -4.99 118.95 123.11 2j00 s ARG 36 Ca -0.08 -1.29 0.05 0.00 0.00 0.00 0.00 55.73 54.42 2j00 s ARG 36 Cb 0.03 -2.15 0.32 0.00 0.00 0.00 0.00 34.95 33.15 2j00 s ARG 36 CO 0.31 -1.01 1.01 -0.35 0.00 0.00 0.00 175.30 175.25 2j00 n PRO 37 N 4.59 0.78 -4.38 3.54 -0.04 -1.19 -4.10 135.00 134.20 2j00 n PRO 37 Ca 0.00 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.19 2j00 n PRO 37 Cb 0.41 -1.11 -0.12 0.00 -0.04 0.00 0.00 33.50 32.64 2j00 n PRO 37 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2j00 s TYR 38 N -2.00 2.20 0.39 0.54 -0.85 -1.26 -4.95 117.35 111.42 2j00 s TYR 38 Ca 0.08 -0.39 -0.26 0.00 -0.52 0.00 0.00 57.07 55.99 2j00 s TYR 38 Cb 0.04 -1.16 -0.11 0.00 0.38 0.00 0.00 41.96 41.10 2j00 s TYR 38 CO 0.06 0.36 1.12 -2.30 -1.52 0.00 0.00 175.55 173.27 2j00 n PRO 39 N 0.73 1.62 -0.56 -3.49 -0.02 -1.26 -4.55 135.00 127.46 2j00 n PRO 39 Ca -0.16 0.58 -0.30 0.00 -2.02 0.00 0.00 63.50 61.59 2j00 n PRO 39 Cb 0.54 -2.14 0.22 0.00 -0.02 0.00 0.00 33.50 32.10 2j00 n PRO 39 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2j00 n PRO 40 N 0.27 -1.72 0.00 0.52 -0.04 -1.26 -4.08 135.00 128.70 2j00 n PRO 40 Ca 0.08 -0.46 0.00 0.00 -0.04 0.00 0.00 63.50 63.08 2j00 n PRO 40 Cb 0.38 -2.19 0.00 0.00 -0.04 0.00 0.00 33.50 31.64 2j00 n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2j00 n GLY 41 N 0.87 2.17 0.46 0.55 0.00 -1.26 -4.04 105.19 103.94 2j00 n GLY 41 Ca 0.06 -1.92 0.28 0.00 0.00 0.00 0.00 46.02 44.44 2j00 n GLY 41 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2j00 h GLN 42 N 0.00 0.19 0.00 1.61 4.15 -2.04 -3.30 115.11 115.72 2j00 h GLN 42 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 2j00 h GLN 42 Cb 0.00 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.65 2j00 h GLN 42 CO 0.00 0.12 0.00 0.72 -1.93 0.00 0.00 178.83 177.74 2j00 n HIS 43 N -4.41 0.00 0.00 3.99 8.25 -1.26 -4.80 115.22 116.99 2j00 n HIS 43 Ca 0.24 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.70 2j00 n HIS 43 Cb 1.01 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.12 2j00 n HIS 43 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2j00 n GLY 44 N 2.85 -0.17 2.81 -1.41 0.00 -1.24 -4.07 105.19 103.95 2j00 n GLY 44 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2j00 n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j00 n GLN 45 N 0.00 3.52 -3.85 1.61 10.64 -1.26 -4.52 117.38 123.52 2j00 n GLN 45 Ca 0.00 -3.32 -0.11 0.00 -1.83 0.00 0.00 57.00 51.74 2j00 n GLN 45 Cb 0.00 -2.98 -0.09 0.00 -0.86 0.00 0.00 30.24 26.31 2j00 n GLN 45 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 2j00 s LYS 46 N 0.87 0.65 -0.44 2.61 1.02 -1.26 -5.09 119.74 118.11 2j00 s LYS 46 Ca 0.42 -0.57 -0.43 0.00 0.02 0.00 0.00 55.97 55.41 2j00 s LYS 46 Cb 0.11 0.27 -0.18 0.00 -0.52 0.00 0.00 37.83 37.52 2j00 s LYS 46 CO -0.02 -0.18 1.91 -2.13 -0.92 0.00 0.00 175.35 174.00 2j00 n ARG 47 N 0.85 0.37 -3.53 1.68 0.63 -1.26 -4.88 116.66 110.53 2j00 n ARG 47 Ca -0.20 0.12 -0.37 0.00 -0.92 0.00 0.00 57.85 56.49 2j00 n ARG 47 Cb 0.58 -1.75 -0.08 0.00 0.45 0.00 0.00 32.46 31.66 2j00 n ARG 47 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2j00 s ALA 48 N 4.80 3.59 0.68 5.13 0.00 -1.26 -5.07 121.76 129.62 2j00 s ALA 48 Ca 1.10 -0.61 -0.16 0.00 0.00 0.00 0.00 51.96 52.28 2j00 s ALA 48 Cb -1.33 -2.45 0.01 0.00 0.00 0.00 0.00 23.12 19.36 2j00 s ALA 48 CO 0.69 -0.13 1.20 1.03 0.00 0.00 0.00 175.76 178.55 2j00 s ARG 49 N 0.93 2.48 -0.22 0.00 1.81 -1.26 -4.89 118.95 117.81 2j00 s ARG 49 Ca 0.14 1.75 -0.28 0.00 -1.72 0.00 0.00 55.73 55.62 2j00 s ARG 49 Cb -0.14 -1.88 -0.05 0.00 -0.45 0.00 0.00 34.95 32.44 2j00 s ARG 49 CO 0.05 -1.57 2.22 -2.13 -0.68 0.00 0.00 175.30 173.19 2j00 n ARG 50 N -2.33 1.96 -1.66 3.54 0.00 -1.26 -4.90 116.66 112.02 2j00 n ARG 50 Ca 0.13 0.54 -0.45 0.00 -0.00 0.00 0.00 57.85 58.07 2j00 n ARG 50 Cb 0.50 -3.22 -0.02 0.00 0.00 0.00 0.00 32.46 29.71 2j00 n ARG 50 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 2j00 n PRO 51 N 8.74 1.91 -2.24 -0.14 -0.02 -1.26 -4.93 135.00 137.06 2j00 n PRO 51 Ca 0.30 0.68 -0.37 0.00 -2.02 0.00 0.00 63.50 62.09 2j00 n PRO 51 Cb 0.44 -2.29 -0.00 0.00 -0.02 0.00 0.00 33.50 31.63 2j00 n PRO 51 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2j00 s SER 52 N 0.10 6.04 0.00 2.55 1.04 -1.26 -4.78 113.70 117.39 2j00 s SER 52 Ca 0.66 2.29 0.00 0.00 0.48 0.00 0.00 55.95 59.38 2j00 s SER 52 Cb -0.66 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 62.86 2j00 s SER 52 CO 0.53 -1.01 0.51 0.47 0.98 0.00 0.00 173.24 174.72 2j00 n ASP 53 N -0.69 0.00 -0.13 7.02 9.92 -1.26 0.74 116.55 132.16 2j00 n ASP 53 Ca 0.08 0.10 -0.24 0.00 -0.53 0.00 0.00 54.79 54.20 2j00 n ASP 53 Cb 0.49 -0.10 -0.11 0.00 -0.64 0.00 0.00 41.12 40.76 2j00 n ASP 53 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2j00 n TYR 54 N -1.01 0.12 -0.27 1.24 9.36 -1.26 -3.96 117.16 121.38 2j00 n TYR 54 Ca 0.00 0.04 0.04 0.00 3.32 0.00 0.00 57.90 61.30 2j00 n TYR 54 Cb 0.29 -1.01 0.18 0.00 -0.63 0.00 0.00 39.34 38.16 2j00 n TYR 54 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2j00 h ALA 55 N -0.45 1.13 -1.83 2.98 0.00 -0.01 0.23 119.26 121.31 2j00 h ALA 55 Ca -0.62 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2j00 h ALA 55 Cb 1.76 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.52 2j00 h ALA 55 CO -0.23 -0.07 0.00 0.28 0.00 0.00 0.00 179.25 179.23 2j00 n VAL 56 N -4.87 0.00 -0.32 0.00 0.31 -0.92 0.58 118.33 113.10 2j00 n VAL 56 Ca 0.14 1.19 0.33 0.00 -0.01 0.00 0.00 64.34 66.00 2j00 n VAL 56 Cb 0.36 -2.08 0.51 0.00 -0.91 0.00 0.00 33.84 31.72 2j00 n VAL 56 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2j00 n ARG 57 N -1.25 0.01 0.00 5.55 1.74 -1.07 -1.16 116.66 120.48 2j00 n ARG 57 Ca 0.00 1.02 0.00 0.00 -0.77 0.00 0.00 57.85 58.10 2j00 n ARG 57 Cb 0.00 -2.50 0.00 0.00 -1.02 0.00 0.00 32.46 28.94 2j00 n ARG 57 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2j00 n LEU 58 N -3.37 1.04 -0.58 0.55 -0.00 0.05 -3.51 117.00 111.18 2j00 n LEU 58 Ca 0.28 0.33 0.46 0.00 -0.00 0.00 0.00 56.01 57.08 2j00 n LEU 58 Cb 1.63 -0.33 0.75 0.00 -0.00 0.00 0.00 43.42 45.47 2j00 n LEU 58 CO 0.28 -0.33 1.35 0.03 -0.00 0.00 0.00 177.39 178.72 2j00 h ARG 59 N 0.00 0.01 0.56 1.96 2.47 0.17 0.38 114.38 119.93 2j00 h ARG 59 Ca 0.00 -0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.69 2j00 h ARG 59 Cb 0.00 -0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.32 2j00 h ARG 59 CO 0.00 0.00 -0.27 1.49 0.56 0.00 0.00 179.97 181.75 2j00 h GLU 60 N 0.01 -0.73 -0.35 0.04 4.57 -1.44 -2.19 114.58 114.49 2j00 h GLU 60 Ca 0.90 0.05 0.04 0.00 -1.18 0.00 0.00 59.36 59.17 2j00 h GLU 60 Cb 3.25 0.17 -0.05 0.00 -0.16 0.00 0.00 28.75 31.95 2j00 h GLU 60 CO -0.26 -0.49 -0.31 -0.22 -1.18 0.00 0.00 179.01 176.56 2j00 h LYS 61 N -1.03 -0.12 -1.40 1.92 3.64 -0.32 0.45 116.57 119.71 2j00 h LYS 61 Ca -0.08 0.01 0.42 0.00 -1.27 0.00 0.00 60.65 59.73 2j00 h LYS 61 Cb 0.58 0.03 -0.10 0.00 -0.41 0.00 0.00 32.23 32.33 2j00 h LYS 61 CO 0.13 -0.08 0.95 1.96 -2.27 0.00 0.00 179.45 180.13 2j00 h GLN 62 N -0.13 0.09 0.00 1.90 1.08 -1.38 -1.32 115.11 115.36 2j00 h GLN 62 Ca 0.06 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 2j00 h GLN 62 Cb 0.28 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.69 2j00 h GLN 62 CO -0.40 0.06 0.00 1.17 -0.95 0.00 0.00 178.83 178.71 2j00 n LYS 63 N -4.43 0.00 -0.20 1.46 4.81 0.15 -1.02 118.16 118.93 2j00 n LYS 63 Ca 0.35 0.00 0.03 0.00 -0.87 0.00 0.00 58.31 57.82 2j00 n LYS 63 Cb 1.44 -0.80 0.08 0.00 0.02 0.00 0.00 35.03 35.77 2j00 n LYS 63 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2j00 n LEU 64 N -0.34 -0.20 0.14 3.14 7.94 -0.86 0.12 117.00 126.93 2j00 n LEU 64 Ca 0.00 0.96 -0.14 0.00 -1.11 0.00 0.00 56.01 55.73 2j00 n LEU 64 Cb 0.00 -0.29 -0.07 0.00 0.53 0.00 0.00 43.42 43.59 2j00 n LEU 64 CO 0.00 -0.93 0.80 -0.09 -1.11 0.00 0.00 177.39 176.06 2j00 h ARG 65 N 0.00 -0.28 -0.18 1.96 2.43 -1.31 -2.17 114.38 114.83 2j00 h ARG 65 Ca 0.27 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.51 2j00 h ARG 65 Cb 0.41 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 2j00 h ARG 65 CO -0.58 -0.18 0.14 0.00 -1.51 0.00 0.00 179.97 177.83 2j00 h ARG 66 N -0.29 0.00 0.10 0.20 3.08 0.27 -1.88 114.38 115.87 2j00 h ARG 66 Ca -0.02 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.05 2j00 h ARG 66 Cb 0.23 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.24 2j00 h ARG 66 CO 0.03 0.00 -0.40 0.82 -1.07 0.00 0.00 179.97 179.34 2j00 h ILE 67 N 0.00 0.18 0.00 2.04 2.04 -0.52 -1.75 117.51 119.50 2j00 h ILE 67 Ca 0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.95 2j00 h ILE 67 Cb 0.36 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 2j00 h ILE 67 CO -0.00 0.00 0.00 -1.22 0.00 0.00 0.00 178.15 176.93 2j00 n TYR 68 N -5.46 0.00 -3.59 1.37 4.02 -0.87 -4.94 117.16 107.69 2j00 n TYR 68 Ca -0.07 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.59 2j00 n TYR 68 Cb 0.37 -0.16 0.02 0.00 -0.02 0.00 0.00 39.34 39.55 2j00 n TYR 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2j00 n GLY 69 N 1.06 -1.14 2.95 2.72 0.00 -0.66 -4.97 105.19 105.15 2j00 n GLY 69 Ca 0.18 0.50 -0.18 0.00 0.00 0.00 0.00 46.02 46.52 2j00 n GLY 69 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2j00 s ILE 70 N -3.22 0.51 0.50 -0.61 2.07 -1.24 -4.42 121.20 114.79 2j00 s ILE 70 Ca 0.23 -0.22 -0.22 0.00 -1.41 0.00 0.00 60.65 59.03 2j00 s ILE 70 Cb -0.09 -0.47 -0.08 0.00 0.13 0.00 0.00 42.46 41.96 2j00 s ILE 70 CO 0.85 0.17 1.05 -1.54 -1.91 0.00 0.00 174.94 173.56 2j00 n SER 71 N 3.27 1.36 -0.00 4.50 3.41 -1.26 -4.66 113.62 120.25 2j00 n SER 71 Ca -0.17 0.96 -0.11 0.00 -0.26 0.00 0.00 58.87 59.29 2j00 n SER 71 Cb 0.55 -1.40 -0.04 0.00 -0.26 0.00 0.00 64.21 63.06 2j00 n SER 71 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2j00 h GLU 72 N 1.23 -0.39 -0.38 4.33 4.57 -1.99 0.77 114.58 122.71 2j00 h GLU 72 Ca -0.47 0.03 0.03 0.00 -1.18 0.00 0.00 59.36 57.77 2j00 h GLU 72 Cb 1.34 0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 29.97 2j00 h GLU 72 CO 0.55 -0.26 -0.23 -0.09 -1.18 0.00 0.00 179.01 177.80 2j00 h ARG 73 N -0.41 -0.01 -0.27 1.92 9.65 -1.99 1.03 114.38 124.32 2j00 h ARG 73 Ca 0.09 0.00 0.05 0.00 -1.10 0.00 0.00 59.98 59.03 2j00 h ARG 73 Cb 0.56 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 29.09 2j00 h ARG 73 CO -0.36 -0.00 -0.08 1.96 2.80 0.00 0.00 179.97 184.29 2j00 h GLN 74 N -0.01 -0.02 0.00 0.20 4.20 -1.72 -0.88 115.11 116.88 2j00 h GLN 74 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 2j00 h GLN 74 Cb 0.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.95 2j00 h GLN 74 CO -0.36 -0.01 0.00 0.34 -0.67 0.00 0.00 178.83 178.12 2j00 n PHE 75 N -5.25 0.00 -0.33 2.96 7.35 0.26 -2.24 117.46 120.22 2j00 n PHE 75 Ca -0.01 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.64 2j00 n PHE 75 Cb 0.17 -0.38 -0.02 0.00 0.35 0.00 0.00 39.48 39.60 2j00 n PHE 75 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 2j00 n ARG 76 N -2.16 -0.27 -0.30 -4.13 3.00 0.34 0.14 116.66 113.29 2j00 n ARG 76 Ca 0.00 1.27 0.13 0.00 -0.00 0.00 0.00 57.85 59.25 2j00 n ARG 76 Cb 0.00 -1.88 0.31 0.00 0.00 0.00 0.00 32.46 30.89 2j00 n ARG 76 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.63 176.72 2j00 h ASN 77 N 0.00 0.32 0.82 6.15 2.35 -0.79 -0.11 115.58 124.32 2j00 h ASN 77 Ca 0.22 0.16 -0.04 0.00 -0.55 0.00 0.00 56.30 56.09 2j00 h ASN 77 Cb 0.43 0.14 0.01 0.00 0.05 0.00 0.00 38.32 38.95 2j00 h ASN 77 CO -0.81 -0.01 -0.40 -0.07 -1.65 0.00 0.00 177.43 174.50 2j00 h LEU 78 N 0.39 -0.94 -0.57 1.61 3.38 0.17 -1.20 115.31 118.15 2j00 h LEU 78 Ca 0.56 0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.61 2j00 h LEU 78 Cb 1.07 0.24 -0.07 0.00 0.09 0.00 0.00 40.66 41.99 2j00 h LEU 78 CO -0.53 -0.64 -0.33 0.33 0.09 0.00 0.00 178.44 177.35 2j00 n PHE 79 N -5.15 -0.25 -0.03 1.13 7.35 -0.44 0.60 117.46 120.67 2j00 n PHE 79 Ca -0.14 0.71 -0.04 0.00 -0.76 0.00 0.00 57.45 57.22 2j00 n PHE 79 Cb 0.44 -0.53 -0.03 0.00 0.35 0.00 0.00 39.48 39.71 2j00 n PHE 79 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 2j00 h GLU 80 N 0.00 -0.12 -0.86 -4.13 4.39 -1.02 0.89 114.58 113.72 2j00 h GLU 80 Ca 0.09 0.01 0.22 0.00 0.34 0.00 0.00 59.36 60.02 2j00 h GLU 80 Cb 0.23 0.03 -0.16 0.00 -0.10 0.00 0.00 28.75 28.75 2j00 h GLU 80 CO -0.53 -0.08 -0.05 -1.91 -1.16 0.00 0.00 179.01 175.28 2j00 n GLU 81 N -3.47 -0.07 -0.16 2.33 2.13 0.08 0.23 120.64 121.71 2j00 n GLU 81 Ca -0.01 1.31 -0.09 0.00 0.66 0.00 0.00 57.16 59.03 2j00 n GLU 81 Cb 0.10 -2.04 0.00 0.00 0.27 0.00 0.00 31.44 29.77 2j00 n GLU 81 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2j00 h ALA 82 N 1.72 0.59 0.00 4.31 0.00 0.26 0.14 119.26 126.28 2j00 h ALA 82 Ca 0.49 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2j00 h ALA 82 Cb 0.95 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 2j00 h ALA 82 CO -0.83 0.21 -0.02 0.77 0.00 0.00 0.00 179.25 179.37 2j00 h SER 83 N 0.59 0.00 0.02 0.00 0.02 1.01 -2.92 113.55 112.27 2j00 h SER 83 Ca 0.15 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2j00 h SER 83 Cb 0.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.76 2j00 h SER 83 CO -0.01 0.02 -0.01 0.11 -1.14 0.00 0.00 176.83 175.81 2j00 h LYS 84 N 0.00 -0.03 -6.59 3.45 1.79 0.98 -3.46 116.57 112.71 2j00 h LYS 84 Ca -0.00 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.91 2j00 h LYS 84 Cb 0.05 0.01 0.07 0.00 -1.58 0.00 0.00 32.23 30.77 2j00 h LYS 84 CO 0.00 0.71 0.83 1.17 -1.08 0.00 0.00 179.45 181.08 2j00 n LYS 85 N -4.70 2.35 -1.66 3.15 4.81 0.37 -4.89 118.16 117.59 2j00 n LYS 85 Ca -0.08 0.84 -0.42 0.00 -0.87 0.00 0.00 58.31 57.78 2j00 n LYS 85 Cb 0.36 -2.61 0.00 0.00 0.02 0.00 0.00 35.03 32.81 2j00 n LYS 85 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2j00 n LYS 86 N 3.13 1.71 0.00 1.64 4.76 -1.26 -4.76 118.16 123.38 2j00 n LYS 86 Ca 0.15 0.61 0.00 0.00 -2.87 0.00 0.00 58.31 56.19 2j00 n LYS 86 Cb 0.32 -2.19 0.00 0.00 -1.84 0.00 0.00 35.03 31.32 2j00 n LYS 86 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2j00 n GLY 87 N 0.97 0.03 3.56 0.72 0.00 -1.26 -4.94 105.19 104.27 2j00 n GLY 87 Ca 0.07 -2.28 -0.31 0.00 0.00 0.00 0.00 46.02 43.50 2j00 n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2j00 s VAL 88 N -0.35 3.51 0.29 1.61 1.01 -1.26 -4.85 120.40 120.36 2j00 s VAL 88 Ca 0.00 -0.32 -0.03 0.00 0.00 0.00 0.00 61.98 61.63 2j00 s VAL 88 Cb 0.00 -4.17 0.40 0.00 0.00 0.00 0.00 36.38 32.60 2j00 s VAL 88 CO 0.00 -1.11 1.58 0.74 0.00 0.00 0.00 175.10 176.31 2j00 h THR 89 N 7.10 0.08 -0.47 3.92 2.02 -1.86 -1.64 112.91 122.07 2j00 h THR 89 Ca 0.05 -0.01 0.05 0.00 0.77 0.00 0.00 66.41 67.26 2j00 h THR 89 Cb 1.03 0.06 -0.06 0.00 -1.74 0.00 0.00 68.15 67.43 2j00 h THR 89 CO 1.24 0.00 -0.36 1.23 0.37 0.00 0.00 175.52 178.01 2j00 h GLY 90 N 0.02 -1.49 0.00 2.16 0.00 -1.93 -2.38 103.07 99.45 2j00 h GLY 90 Ca 0.52 0.88 0.00 0.00 0.00 0.00 0.00 47.33 48.73 2j00 h GLY 90 CO -0.90 -0.37 0.00 1.44 0.00 0.00 0.00 176.54 176.72 2j00 n SER 91 N -4.37 0.00 0.00 0.19 7.64 -0.66 -3.65 113.62 112.76 2j00 n SER 91 Ca -0.00 0.74 0.00 0.00 1.01 0.00 0.00 58.87 60.62 2j00 n SER 91 Cb 0.18 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.14 2j00 n SER 91 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2j00 n VAL 92 N -1.33 0.00 -0.03 0.44 0.31 -0.93 -0.01 118.33 116.78 2j00 n VAL 92 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 2j00 n VAL 92 Cb 0.00 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 32.92 2j00 n VAL 92 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 2j00 n PHE 93 N -1.54 -0.03 -0.19 3.52 -0.00 -0.90 0.20 117.46 118.52 2j00 n PHE 93 Ca 0.00 0.08 -0.05 0.00 -0.00 0.00 0.00 57.45 57.48 2j00 n PHE 93 Cb 0.00 -0.23 0.01 0.00 -0.00 0.00 0.00 39.48 39.26 2j00 n PHE 93 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 2j00 h LEU 94 N 0.00 -1.10 -0.66 -2.13 3.38 -0.58 0.21 115.31 114.43 2j00 h LEU 94 Ca 0.01 0.22 0.06 0.00 0.09 0.00 0.00 57.88 58.26 2j00 h LEU 94 Cb 0.03 0.55 -0.09 0.00 0.09 0.00 0.00 40.66 41.24 2j00 h LEU 94 CO -0.06 -0.30 -0.45 1.23 0.09 0.00 0.00 178.44 178.95 2j00 h GLY 95 N -0.16 -1.26 1.45 0.83 0.00 0.22 1.55 103.07 105.71 2j00 h GLY 95 Ca 0.23 0.85 0.04 0.00 0.00 0.00 0.00 47.33 48.46 2j00 h GLY 95 CO -0.66 -0.21 0.27 1.41 0.00 0.00 0.00 176.54 177.34 2j00 h LEU 96 N -0.08 0.32 -0.83 3.11 -0.00 -0.92 0.41 115.31 117.34 2j00 h LEU 96 Ca 0.11 -0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.98 2j00 h LEU 96 Cb 0.35 -0.07 0.00 0.00 -0.00 0.00 0.00 40.66 40.94 2j00 h LEU 96 CO -0.66 0.22 0.00 0.25 -0.00 0.00 0.00 178.44 178.25 2j00 h LEU 97 N 0.37 0.00 0.00 1.67 6.46 0.39 -3.12 115.31 121.08 2j00 h LEU 97 Ca 0.17 0.00 -0.30 0.00 -0.12 0.00 0.00 57.88 57.63 2j00 h LEU 97 Cb 0.21 0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 40.08 2j00 h LEU 97 CO -0.04 0.00 -2.01 1.21 -0.62 0.00 0.00 178.44 176.98 2j00 n GLU 98 N -3.09 0.66 0.00 1.25 4.07 0.46 -4.18 120.64 119.80 2j00 n GLU 98 Ca 0.02 0.12 0.04 0.00 -0.06 0.00 0.00 57.16 57.28 2j00 n GLU 98 Cb 0.40 -1.65 0.20 0.00 -0.06 0.00 0.00 31.44 30.33 2j00 n GLU 98 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 2j00 n SER 99 N -2.85 0.00 -4.71 4.31 7.64 0.97 -4.03 113.62 114.95 2j00 n SER 99 Ca -0.23 0.23 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 2j00 n SER 99 Cb 1.06 -0.33 -0.03 0.00 -1.01 0.00 0.00 64.21 63.90 2j00 n SER 99 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2j00 s ARG 100 N -2.65 4.17 0.11 1.43 0.52 -1.25 -0.54 118.95 120.75 2j00 s ARG 100 Ca 0.07 2.46 -0.30 0.00 -0.52 0.00 0.00 55.73 57.44 2j00 s ARG 100 Cb 0.06 -3.27 -0.11 0.00 0.52 0.00 0.00 34.95 32.15 2j00 s ARG 100 CO 0.13 -0.70 1.49 1.25 0.02 0.00 0.00 175.30 177.49 2j00 h LEU 101 N 7.35 -1.59 -0.97 2.53 5.85 -0.70 0.24 115.31 128.00 2j00 h LEU 101 Ca -0.43 0.20 0.32 0.00 0.84 0.00 0.00 57.88 58.81 2j00 h LEU 101 Cb 1.20 0.63 -0.16 0.00 0.37 0.00 0.00 40.66 42.70 2j00 h LEU 101 CO 0.93 -0.41 0.38 -2.24 -0.34 0.00 0.00 178.44 176.76 2j00 h ASP 102 N -0.48 0.15 0.43 1.25 2.03 -1.85 0.16 116.42 118.12 2j00 h ASP 102 Ca 0.04 0.23 -0.02 0.00 -0.73 0.00 0.00 57.03 56.55 2j00 h ASP 102 Cb 0.59 0.28 0.00 0.00 -0.83 0.00 0.00 39.33 39.37 2j00 h ASP 102 CO -0.44 -0.28 -0.21 -1.13 -1.03 0.00 0.00 179.24 176.16 2j00 h ASN 103 N 0.13 -0.49 -0.73 4.15 -1.24 -0.93 -3.02 115.58 113.46 2j00 h ASN 103 Ca 0.71 0.02 0.07 0.00 0.71 0.00 0.00 56.30 57.80 2j00 h ASN 103 Cb 1.65 0.13 -0.09 0.00 0.73 0.00 0.00 38.32 40.74 2j00 h ASN 103 CO -0.73 -0.32 -0.43 0.52 -1.29 0.00 0.00 177.43 175.18 2j00 n VAL 104 N -3.74 -0.50 0.10 2.57 0.31 0.33 0.20 118.33 117.61 2j00 n VAL 104 Ca -0.07 2.16 0.03 0.00 -0.01 0.00 0.00 64.34 66.45 2j00 n VAL 104 Cb 0.23 -2.71 0.14 0.00 -0.91 0.00 0.00 33.84 30.59 2j00 n VAL 104 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2j00 n VAL 105 N -4.64 0.50 -0.10 2.52 0.31 0.21 0.43 118.33 117.56 2j00 n VAL 105 Ca 0.01 0.66 -0.19 0.00 -0.01 0.00 0.00 64.34 64.81 2j00 n VAL 105 Cb 0.19 -1.66 -0.09 0.00 -0.91 0.00 0.00 33.84 31.38 2j00 n VAL 105 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2j00 n TYR 106 N -1.66 0.79 -0.04 3.52 9.36 0.54 -2.44 117.16 127.23 2j00 n TYR 106 Ca -0.00 0.34 0.02 0.00 3.32 0.00 0.00 57.90 61.58 2j00 n TYR 106 Cb 0.42 -0.99 0.34 0.00 -0.63 0.00 0.00 39.34 38.49 2j00 n TYR 106 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2j00 h ARG 107 N -1.00 0.63 -0.26 2.98 3.08 0.60 0.12 114.38 120.52 2j00 h ARG 107 Ca -0.31 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.67 2j00 h ARG 107 Cb 1.17 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.09 2j00 h ARG 107 CO -0.19 0.49 0.00 1.28 -1.07 0.00 0.00 179.97 180.48 2j00 n LEU 108 N -4.39 0.26 0.00 3.04 4.32 0.17 -4.82 117.00 115.57 2j00 n LEU 108 Ca 0.03 -0.13 0.00 0.00 -0.02 0.00 0.00 56.01 55.89 2j00 n LEU 108 Cb 0.12 -0.13 0.00 0.00 -1.62 0.00 0.00 43.42 41.79 2j00 n LEU 108 CO 0.37 0.07 0.00 0.61 -1.22 0.00 0.00 177.39 177.21 2j00 n GLY 109 N 0.18 1.92 0.41 -0.72 0.00 0.40 -4.81 105.19 102.58 2j00 n GLY 109 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.20 2j00 n GLY 109 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2j00 h PHE 110 N 0.00 0.00 -4.33 1.61 -1.00 -1.73 -3.39 116.94 108.10 2j00 h PHE 110 Ca 0.00 0.00 -0.56 0.00 2.81 0.00 0.00 57.97 60.22 2j00 h PHE 110 Cb 0.00 0.00 -0.29 0.00 3.61 0.00 0.00 35.95 39.27 2j00 h PHE 110 CO 0.00 0.00 -0.84 0.00 -1.61 0.00 0.00 178.31 175.86 2j00 s ALA 111 N -4.34 1.51 -0.94 2.45 0.00 -1.02 -4.79 121.76 114.62 2j00 s ALA 111 Ca -0.03 -0.78 0.20 0.00 0.00 0.00 0.00 51.96 51.36 2j00 s ALA 111 Cb 0.11 -0.39 0.84 0.00 0.00 0.00 0.00 23.12 23.68 2j00 s ALA 111 CO 0.36 0.37 1.63 1.55 0.00 0.00 0.00 175.76 179.67 2j00 n VAL 112 N 2.65 0.68 -3.55 0.00 3.14 -1.26 -4.76 118.33 115.24 2j00 n VAL 112 Ca -0.15 0.15 -0.09 0.00 -2.96 0.00 0.00 64.34 61.29 2j00 n VAL 112 Cb 0.54 -0.85 -0.04 0.00 -1.06 0.00 0.00 33.84 32.43 2j00 n VAL 112 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 2j00 s SER 113 N -3.17 -0.36 0.21 6.55 1.04 -1.26 -4.26 113.70 112.45 2j00 s SER 113 Ca 0.09 0.22 -0.09 0.00 0.48 0.00 0.00 55.95 56.65 2j00 s SER 113 Cb 0.12 0.33 0.27 0.00 0.10 0.00 0.00 66.02 66.84 2j00 s SER 113 CO 0.37 -0.46 1.79 0.03 0.98 0.00 0.00 173.24 175.95 2j00 h ARG 114 N 2.30 0.61 -0.47 4.02 3.08 -1.87 0.13 114.38 122.18 2j00 h ARG 114 Ca -0.19 -0.04 0.07 0.00 0.07 0.00 0.00 59.98 59.89 2j00 h ARG 114 Cb 1.19 -0.14 -0.06 0.00 0.08 0.00 0.00 29.97 31.05 2j00 h ARG 114 CO 0.31 0.40 0.14 0.00 -1.07 0.00 0.00 179.97 179.75 2j00 h ARG 115 N 0.62 0.29 -0.71 0.04 3.08 -1.93 0.05 114.38 115.83 2j00 h ARG 115 Ca 0.31 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.29 2j00 h ARG 115 Cb 0.26 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 2j00 h ARG 115 CO -0.22 0.19 0.23 0.37 -1.07 0.00 0.00 179.97 179.47 2j00 h GLN 116 N 0.30 1.09 -0.38 0.04 4.15 -1.73 -2.95 115.11 115.63 2j00 h GLN 116 Ca 0.23 -0.23 0.05 0.00 0.77 0.00 0.00 58.65 59.47 2j00 h GLN 116 Cb 0.26 -0.16 -0.08 0.00 0.21 0.00 0.00 27.48 27.71 2j00 h GLN 116 CO -0.26 0.94 -0.56 0.00 -1.93 0.00 0.00 178.83 177.02 2j00 h ALA 117 N 1.11 -0.79 -0.03 3.38 0.00 0.11 -2.33 119.26 120.72 2j00 h ALA 117 Ca 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2j00 h ALA 117 Cb 0.29 1.12 0.00 0.00 0.00 0.00 0.00 17.79 19.20 2j00 h ALA 117 CO -0.01 -1.06 0.00 -2.13 0.00 0.00 0.00 179.25 176.05 2j00 n ARG 118 N -5.38 0.00 -0.20 0.00 0.63 -0.62 -0.71 116.66 110.38 2j00 n ARG 118 Ca -0.04 0.94 -0.05 0.00 -0.92 0.00 0.00 57.85 57.78 2j00 n ARG 118 Cb 0.35 -1.41 -0.05 0.00 0.45 0.00 0.00 32.46 31.80 2j00 n ARG 118 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 2j00 n GLN 119 N -2.93 -0.21 -0.04 -0.14 7.27 -0.92 0.70 117.38 121.12 2j00 n GLN 119 Ca 0.00 0.87 -0.10 0.00 0.07 0.00 0.00 57.00 57.84 2j00 n GLN 119 Cb 0.00 -1.28 -0.03 0.00 2.41 0.00 0.00 30.24 31.34 2j00 n GLN 119 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.06 177.06 2j00 h LEU 120 N 0.00 -1.00 -0.76 1.69 3.38 -0.62 0.67 115.31 118.68 2j00 h LEU 120 Ca 0.08 0.16 0.07 0.00 0.09 0.00 0.00 57.88 58.28 2j00 h LEU 120 Cb 0.19 0.44 -0.06 0.00 0.09 0.00 0.00 40.66 41.32 2j00 h LEU 120 CO -0.44 -0.34 0.43 0.58 0.09 0.00 0.00 178.44 178.76 2j00 h VAL 121 N -0.34 0.95 -0.20 1.22 2.07 0.22 -2.50 116.25 117.67 2j00 h VAL 121 Ca 0.12 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 2j00 h VAL 121 Cb 0.53 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 2j00 h VAL 121 CO -0.41 0.14 0.06 -0.09 0.02 0.00 0.00 177.57 177.30 2j00 h ARG 122 N 0.77 0.31 0.00 1.57 1.12 0.21 -2.88 114.38 115.48 2j00 h ARG 122 Ca 0.35 -0.07 0.00 0.00 -1.11 0.00 0.00 59.98 59.15 2j00 h ARG 122 Cb 0.26 -0.05 0.00 0.00 -0.01 0.00 0.00 29.97 30.17 2j00 h ARG 122 CO -0.21 0.41 0.00 0.72 -3.11 0.00 0.00 179.97 177.78 2j00 n HIS 123 N -4.79 0.00 -0.92 2.20 8.25 0.22 -4.71 115.22 115.46 2j00 n HIS 123 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 2j00 n HIS 123 Cb 0.15 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.26 2j00 n HIS 123 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2j00 n GLY 124 N -0.01 0.73 0.00 -1.41 0.00 -1.09 -4.86 105.19 98.55 2j00 n GLY 124 Ca 0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.07 2j00 n GLY 124 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2j00 n HIS 125 N -2.16 0.00 -4.20 1.61 8.25 -1.01 -4.66 115.22 113.05 2j00 n HIS 125 Ca 0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.23 2j00 n HIS 125 Cb 0.02 -0.49 -0.07 0.00 1.12 0.00 0.00 29.99 30.57 2j00 n HIS 125 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2j00 s ILE 126 N -2.98 3.12 0.24 1.59 -1.09 -1.25 -1.34 121.20 119.48 2j00 s ILE 126 Ca 0.04 -1.80 -0.13 0.00 -2.23 0.00 0.00 60.65 56.54 2j00 s ILE 126 Cb 0.06 -2.92 -0.00 0.00 -1.58 0.00 0.00 42.46 38.02 2j00 s ILE 126 CO 0.16 -0.25 0.46 0.28 -1.23 0.00 0.00 174.94 174.36 2j00 s THR 127 N -2.40 0.01 -0.08 2.92 -1.32 -0.67 -2.86 115.64 111.23 2j00 s THR 127 Ca 0.35 -1.37 -0.04 0.00 -1.21 0.00 0.00 61.69 59.42 2j00 s THR 127 Cb -0.03 -2.13 0.03 0.00 -1.51 0.00 0.00 72.50 68.86 2j00 s THR 127 CO 0.21 -0.03 0.18 -0.69 -2.21 0.00 0.00 174.62 172.08 2j00 s VAL 128 N -4.01 -0.03 -1.82 5.08 1.01 0.31 -2.91 120.40 118.04 2j00 s VAL 128 Ca 0.21 0.11 -0.21 0.00 0.00 0.00 0.00 61.98 62.09 2j00 s VAL 128 Cb -0.00 -0.28 0.20 0.00 0.00 0.00 0.00 36.38 36.30 2j00 s VAL 128 CO 0.07 0.05 0.64 0.59 0.00 0.00 0.00 175.10 176.45 2j00 n ASN 129 N 3.83 -2.19 0.00 3.32 3.02 -0.79 -2.23 115.26 120.22 2j00 n ASN 129 Ca -0.22 -1.17 0.00 0.00 -0.03 0.00 0.00 54.58 53.16 2j00 n ASN 129 Cb 0.54 -1.98 0.00 0.00 -0.61 0.00 0.00 39.78 37.74 2j00 n ASN 129 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2j00 n GLY 130 N -1.23 2.00 3.61 7.41 0.00 -1.26 -5.01 105.19 110.71 2j00 n GLY 130 Ca 0.09 -0.62 -0.39 0.00 0.00 0.00 0.00 46.02 45.10 2j00 n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j00 n ARG 131 N 0.00 1.10 -3.17 1.61 3.00 -0.95 -4.88 116.66 113.37 2j00 n ARG 131 Ca 0.00 0.41 -0.27 0.00 -0.01 0.00 0.00 57.85 57.98 2j00 n ARG 131 Cb 0.00 -2.11 -0.02 0.00 0.00 0.00 0.00 32.46 30.33 2j00 n ARG 131 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 2j00 s ARG 132 N -2.42 3.57 0.03 5.56 1.04 -1.26 0.11 118.95 125.59 2j00 s ARG 132 Ca 0.70 -0.04 0.01 0.00 -1.04 0.00 0.00 55.73 55.36 2j00 s ARG 132 Cb -0.47 -2.58 -0.02 0.00 -2.04 0.00 0.00 34.95 29.84 2j00 s ARG 132 CO 0.52 0.09 -0.05 0.08 -0.04 0.00 0.00 175.30 175.89 2j00 s VAL 133 N -2.32 0.34 -0.04 4.99 1.01 -1.14 -4.80 120.40 118.45 2j00 s VAL 133 Ca 0.44 -1.06 0.23 0.00 0.00 0.00 0.00 61.98 61.59 2j00 s VAL 133 Cb -0.10 -0.52 0.43 0.00 0.00 0.00 0.00 36.38 36.18 2j00 s VAL 133 CO 0.35 -0.47 1.18 -0.90 0.00 0.00 0.00 175.10 175.26 2j00 n ASP 134 N 1.43 1.13 -4.26 3.32 3.85 -1.24 -4.48 116.55 116.30 2j00 n ASP 134 Ca -0.23 -2.36 -0.43 0.00 -0.71 0.00 0.00 54.79 51.07 2j00 n ASP 134 Cb 0.55 -0.34 -0.03 0.00 -1.35 0.00 0.00 41.12 39.95 2j00 n ASP 134 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 2j00 s LEU 135 N -0.61 6.17 0.21 -2.12 2.01 -1.26 -4.42 118.68 118.67 2j00 s LEU 135 Ca 0.35 -3.26 -0.18 0.00 0.01 0.00 0.00 54.13 51.04 2j00 s LEU 135 Cb 0.38 -2.10 0.20 0.00 0.01 0.00 0.00 46.19 44.68 2j00 s LEU 135 CO -0.15 -0.36 1.57 -0.65 1.01 0.00 0.00 176.35 177.77 2j00 h PRO 136 N 6.90 -0.06 -1.03 1.29 0.11 -1.91 0.45 132.00 137.75 2j00 h PRO 136 Ca 0.13 0.00 0.27 0.00 0.11 0.00 0.00 66.00 66.52 2j00 h PRO 136 Cb 0.92 0.01 -0.12 0.00 0.11 0.00 0.00 31.00 31.92 2j00 h PRO 136 CO 0.86 -0.04 0.62 0.66 -0.21 0.00 0.00 178.00 179.89 2j00 h SER 137 N -0.07 0.58 -0.41 -2.05 4.64 -1.97 -3.12 113.55 111.16 2j00 h SER 137 Ca 0.30 0.13 -0.35 0.00 -0.47 0.00 0.00 61.79 61.41 2j00 h SER 137 Cb 0.58 0.05 0.01 0.00 -0.31 0.00 0.00 62.40 62.73 2j00 h SER 137 CO -0.86 0.04 0.20 0.00 -0.87 0.00 0.00 176.83 175.35 2j00 n TYR 138 N -4.85 0.57 -3.29 4.77 -0.00 0.16 -4.46 117.16 110.06 2j00 n TYR 138 Ca 0.28 0.46 -0.42 0.00 -0.00 0.00 0.00 57.90 58.21 2j00 n TYR 138 Cb 0.85 -0.89 -0.08 0.00 -0.00 0.00 0.00 39.34 39.21 2j00 n TYR 138 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.86 177.89 2j00 s ARG 139 N 0.84 3.26 0.13 2.98 0.52 -1.26 -0.47 118.95 124.95 2j00 s ARG 139 Ca 0.41 -0.57 -0.31 0.00 -0.52 0.00 0.00 55.73 54.74 2j00 s ARG 139 Cb -0.58 -3.92 -0.08 0.00 0.52 0.00 0.00 34.95 30.89 2j00 s ARG 139 CO 0.30 -0.80 1.30 0.08 0.02 0.00 0.00 175.30 176.21 2j00 s VAL 140 N 2.25 3.49 0.40 3.52 1.01 0.30 -4.99 120.40 126.39 2j00 s VAL 140 Ca 0.14 1.12 -0.02 0.00 0.00 0.00 0.00 61.98 63.23 2j00 s VAL 140 Cb -0.16 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 2j00 s VAL 140 CO 0.14 0.12 0.65 -0.13 0.00 0.00 0.00 175.10 175.87 2j00 s ARG 141 N 0.66 3.48 -0.13 2.72 0.52 -1.26 -4.87 118.95 120.07 2j00 s ARG 141 Ca 0.60 -0.14 -0.29 0.00 -0.52 0.00 0.00 55.73 55.37 2j00 s ARG 141 Cb -0.34 -2.55 -0.04 0.00 0.52 0.00 0.00 34.95 32.53 2j00 s ARG 141 CO 0.32 -0.01 1.68 -2.14 0.02 0.00 0.00 175.30 175.17 2j00 s PRO 142 N -4.49 3.96 0.00 3.54 0.02 -1.26 -2.75 135.00 134.01 2j00 s PRO 142 Ca 0.43 1.98 0.00 0.00 0.02 0.00 0.00 61.00 63.43 2j00 s PRO 142 Cb -0.10 -4.03 0.00 0.00 0.02 0.00 0.00 34.50 30.39 2j00 s PRO 142 CO 0.39 -1.10 0.00 0.41 -0.33 0.00 0.00 177.00 176.37 2j00 n GLY 143 N 4.45 1.36 3.87 0.52 0.00 0.41 -4.99 105.19 110.80 2j00 n GLY 143 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2j00 n GLY 143 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2j00 s ASP 144 N -2.00 6.63 -0.23 1.61 1.01 -1.11 -4.82 116.67 117.76 2j00 s ASP 144 Ca 0.00 0.76 -0.13 0.00 0.71 0.00 0.00 52.55 53.89 2j00 s ASP 144 Cb 0.00 -2.17 -0.04 0.00 1.01 0.00 0.00 42.92 41.72 2j00 s ASP 144 CO 0.00 0.23 0.29 -1.61 0.21 0.00 0.00 175.17 174.29 2j00 s GLU 145 N -1.69 4.11 -0.32 8.23 2.02 -1.26 -0.76 118.70 129.03 2j00 s GLU 145 Ca 0.29 -0.03 0.01 0.00 0.02 0.00 0.00 54.97 55.26 2j00 s GLU 145 Cb -0.14 -3.55 0.07 0.00 0.10 0.00 0.00 34.13 30.61 2j00 s GLU 145 CO 0.16 -0.02 0.01 0.42 0.02 0.00 0.00 175.26 175.86 2j00 s ILE 146 N 1.28 2.63 0.37 -1.63 1.09 -0.15 -1.88 121.20 122.91 2j00 s ILE 146 Ca 0.13 -1.81 0.04 0.00 -1.10 0.00 0.00 60.65 57.92 2j00 s ILE 146 Cb -0.14 -2.67 -0.05 0.00 -1.06 0.00 0.00 42.46 38.53 2j00 s ILE 146 CO 0.07 -0.30 0.07 0.00 -0.10 0.00 0.00 174.94 174.67 2j00 s ALA 147 N 1.10 2.74 0.58 9.38 0.00 -1.15 -1.91 121.76 132.51 2j00 s ALA 147 Ca -0.00 -1.68 -0.15 0.00 0.00 0.00 0.00 51.96 50.13 2j00 s ALA 147 Cb -0.20 0.59 -0.05 0.00 0.00 0.00 0.00 23.12 23.46 2j00 s ALA 147 CO -0.04 -0.28 1.02 0.08 0.00 0.00 0.00 175.76 176.54 2j00 s VAL 148 N -3.19 4.28 0.45 0.00 1.01 -1.22 -1.67 120.40 120.05 2j00 s VAL 148 Ca 0.30 0.98 -0.16 0.00 0.00 0.00 0.00 61.98 63.10 2j00 s VAL 148 Cb 0.06 -3.60 -0.09 0.00 0.00 0.00 0.00 36.38 32.76 2j00 s VAL 148 CO 0.14 -0.73 0.91 0.00 0.00 0.00 0.00 175.10 175.42 2j00 s ALA 149 N -2.72 3.14 0.14 5.51 0.00 -0.45 -4.76 121.76 122.63 2j00 s ALA 149 Ca 0.60 0.15 -0.22 0.00 0.00 0.00 0.00 51.96 52.48 2j00 s ALA 149 Cb -0.12 -3.01 0.01 0.00 0.00 0.00 0.00 23.12 20.00 2j00 s ALA 149 CO 0.40 -0.03 1.64 1.05 0.00 0.00 0.00 175.76 178.82 2j00 h GLU 150 N 1.40 -0.22 -0.58 0.00 9.09 -1.96 0.36 114.58 122.67 2j00 h GLU 150 Ca -0.48 0.02 0.10 0.00 0.05 0.00 0.00 59.36 59.05 2j00 h GLU 150 Cb 1.18 0.05 -0.03 0.00 -1.65 0.00 0.00 28.75 28.30 2j00 h GLU 150 CO 0.62 -0.15 0.39 -0.22 0.05 0.00 0.00 179.01 179.71 2j00 h LYS 151 N -0.23 0.36 0.06 1.06 3.64 -1.97 -2.00 116.57 117.49 2j00 h LYS 151 Ca 0.12 -0.02 -0.24 0.00 -1.27 0.00 0.00 60.65 59.24 2j00 h LYS 151 Cb 0.41 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2j00 h LYS 151 CO -0.33 0.24 -1.13 0.77 -2.27 0.00 0.00 179.45 176.73 2j00 h SER 152 N 0.38 0.19 -1.05 4.20 0.02 -1.43 -3.36 113.55 112.49 2j00 h SER 152 Ca 0.27 -0.21 0.31 0.00 -0.84 0.00 0.00 61.79 61.32 2j00 h SER 152 Cb 0.56 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 63.00 2j00 h SER 152 CO -0.07 1.17 0.90 0.54 -1.14 0.00 0.00 176.83 178.23 2j00 n ARG 153 N -3.42 0.00 -0.68 3.45 1.74 0.11 0.10 116.66 117.96 2j00 n ARG 153 Ca -0.04 0.71 0.05 0.00 -0.77 0.00 0.00 57.85 57.80 2j00 n ARG 153 Cb 0.98 -1.70 0.30 0.00 -1.02 0.00 0.00 32.46 31.03 2j00 n ARG 153 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2j00 n ASN 154 N -2.98 4.46 -4.68 0.55 3.02 -1.26 -4.82 115.26 109.55 2j00 n ASN 154 Ca 0.24 -3.08 -0.42 0.00 -0.03 0.00 0.00 54.58 51.29 2j00 n ASN 154 Cb 1.22 -0.62 -0.03 0.00 -0.61 0.00 0.00 39.78 39.74 2j00 n ASN 154 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2j00 s LEU 155 N -2.87 4.27 0.46 3.41 1.43 0.28 -4.88 118.68 120.78 2j00 s LEU 155 Ca 0.48 1.85 0.32 0.00 -1.03 0.00 0.00 54.13 55.74 2j00 s LEU 155 Cb 0.38 -3.56 1.43 0.00 0.03 0.00 0.00 46.19 44.48 2j00 s LEU 155 CO 0.11 -0.63 1.66 -0.33 0.23 0.00 0.00 176.35 177.38 2j00 h GLU 156 N 7.65 0.11 0.02 1.70 5.08 -1.94 -0.40 114.58 126.79 2j00 h GLU 156 Ca -0.34 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.02 2j00 h GLU 156 Cb 1.16 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.38 2j00 h GLU 156 CO 0.90 0.07 -0.01 1.25 -1.00 0.00 0.00 179.01 180.22 2j00 h LEU 157 N 0.11 -0.02 -1.70 1.33 5.85 -1.96 -2.71 115.31 116.21 2j00 h LEU 157 Ca 0.78 0.00 0.49 0.00 0.84 0.00 0.00 57.88 59.99 2j00 h LEU 157 Cb 2.54 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 43.51 2j00 h LEU 157 CO -0.31 0.08 1.36 -0.38 -0.34 0.00 0.00 178.44 178.86 2j00 n ILE 158 N -2.61 0.00 0.00 4.05 2.08 -0.91 -0.51 119.36 121.47 2j00 n ILE 158 Ca -0.00 1.41 0.00 0.00 0.56 0.00 0.00 62.75 64.72 2j00 n ILE 158 Cb 0.01 -2.39 0.00 0.00 -0.75 0.00 0.00 39.64 36.51 2j00 n ILE 158 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 2j00 n ARG 159 N -3.70 0.00 -0.37 0.38 5.12 -0.21 -2.05 116.66 115.83 2j00 n ARG 159 Ca 0.38 0.00 0.29 0.00 -1.93 0.00 0.00 57.85 56.60 2j00 n ARG 159 Cb 1.87 -0.79 0.47 0.00 -1.16 0.00 0.00 32.46 32.85 2j00 n ARG 159 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2j00 n GLN 160 N -0.49 -0.01 0.10 5.56 6.02 0.33 -0.06 117.38 128.83 2j00 n GLN 160 Ca 0.00 0.75 -0.04 0.00 -0.01 0.00 0.00 57.00 57.70 2j00 n GLN 160 Cb 0.00 -1.58 -0.02 0.00 1.02 0.00 0.00 30.24 29.66 2j00 n GLN 160 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 2j00 h ASN 161 N 0.00 -0.24 -0.01 1.08 4.21 -1.06 -3.18 115.58 116.38 2j00 h ASN 161 Ca 0.58 0.01 0.00 0.00 1.21 0.00 0.00 56.30 58.10 2j00 h ASN 161 Cb 2.08 0.06 -0.00 0.00 -1.12 0.00 0.00 38.32 39.34 2j00 h ASN 161 CO -0.17 -0.05 0.05 -0.07 -1.29 0.00 0.00 177.43 175.90 2j00 h LEU 162 N -0.52 0.00 0.00 1.61 3.38 0.12 -2.57 115.31 117.34 2j00 h LEU 162 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2j00 h LEU 162 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2j00 h LEU 162 CO 0.05 0.00 0.00 1.21 0.09 0.00 0.00 178.44 179.79 2j00 n GLU 163 N -3.16 0.00 -0.26 1.13 4.07 0.40 -1.31 120.64 121.52 2j00 n GLU 163 Ca -0.03 0.56 0.33 0.00 -0.06 0.00 0.00 57.16 57.96 2j00 n GLU 163 Cb 0.12 -1.31 0.74 0.00 -0.06 0.00 0.00 31.44 30.93 2j00 n GLU 163 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2j00 h ALA 164 N -1.69 3.00 -0.03 4.31 0.00 -1.47 0.22 119.26 123.60 2j00 h ALA 164 Ca 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2j00 h ALA 164 Cb 0.00 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2j00 h ALA 164 CO 0.00 -1.34 0.05 0.52 0.00 0.00 0.00 179.25 178.48 2j00 h MET 165 N 0.00 0.00 -6.19 0.00 2.86 -1.01 -3.39 114.93 107.19 2j00 h MET 165 Ca 0.51 0.00 -0.58 0.00 -2.06 0.00 0.00 59.70 57.57 2j00 h MET 165 Cb 2.08 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.73 2j00 h MET 165 CO -0.01 0.00 1.33 0.15 1.06 0.00 0.00 176.91 179.44 2j00 s LYS 166 N -4.40 3.33 0.00 1.72 1.02 0.76 -3.06 119.74 119.11 2j00 s LYS 166 Ca -0.05 1.66 0.00 0.00 0.02 0.00 0.00 55.97 57.60 2j00 s LYS 166 Cb 0.14 -4.23 0.00 0.00 -0.52 0.00 0.00 37.83 33.21 2j00 s LYS 166 CO 0.47 -1.86 0.00 0.41 -0.92 0.00 0.00 175.35 173.46 2j00 n GLY 167 N 5.44 2.61 3.75 -3.33 0.00 -1.26 -5.08 105.19 107.33 2j00 n GLY 167 Ca 0.25 -0.78 -0.40 0.00 0.00 0.00 0.00 46.02 45.09 2j00 n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j00 n ARG 168 N 0.00 2.15 -2.72 1.61 1.74 -1.17 -5.03 116.66 113.25 2j00 n ARG 168 Ca 0.00 0.77 -0.22 0.00 -0.77 0.00 0.00 57.85 57.63 2j00 n ARG 168 Cb 0.00 -2.59 0.07 0.00 -1.02 0.00 0.00 32.46 28.92 2j00 n ARG 168 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2j00 s LYS 169 N -2.45 2.12 0.12 5.56 1.02 -1.26 -4.99 119.74 119.85 2j00 s LYS 169 Ca 0.62 -1.14 -0.20 0.00 0.02 0.00 0.00 55.97 55.27 2j00 s LYS 169 Cb -0.45 -2.47 0.05 0.00 -0.52 0.00 0.00 37.83 34.44 2j00 s LYS 169 CO 0.57 -1.05 0.51 0.54 -0.92 0.00 0.00 175.35 175.00 2j00 s VAL 170 N -2.89 0.03 0.00 3.17 0.11 -1.26 -5.11 120.40 114.46 2j00 s VAL 170 Ca 0.62 -0.27 0.00 0.00 -2.93 0.00 0.00 61.98 59.40 2j00 s VAL 170 Cb -0.07 -1.06 0.00 0.00 -1.53 0.00 0.00 36.38 33.72 2j00 s VAL 170 CO 0.41 -0.15 0.00 0.61 -3.33 0.00 0.00 175.10 172.64 2j00 n GLY 171 N -0.14 0.00 0.40 6.54 0.00 -1.26 -4.62 105.19 106.11 2j00 n GLY 171 Ca -0.17 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.03 2j00 n GLY 171 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2j00 h PRO 172 N 0.00 0.00 -0.64 1.61 0.11 -1.99 0.82 132.00 131.91 2j00 h PRO 172 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2j00 h PRO 172 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2j00 h PRO 172 CO 0.00 0.00 0.00 -2.67 -0.21 0.00 0.00 178.00 175.12 2j00 n TRP 173 N -3.20 1.43 -4.32 0.65 2.14 -1.26 -4.94 117.44 107.95 2j00 n TRP 173 Ca 0.08 -0.54 -0.16 0.00 2.07 0.00 0.00 57.50 58.95 2j00 n TRP 173 Cb 0.85 -0.30 -0.04 0.00 -0.81 0.00 0.00 31.31 31.01 2j00 n TRP 173 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 2j00 n LEU 174 N 0.78 0.00 -3.14 5.67 4.77 0.28 -1.46 117.00 123.91 2j00 n LEU 174 Ca 0.22 -1.84 0.05 0.00 -0.03 0.00 0.00 56.01 54.41 2j00 n LEU 174 Cb 0.87 0.54 -0.00 0.00 -2.33 0.00 0.00 43.42 42.50 2j00 n LEU 174 CO 0.23 -0.28 0.32 -0.94 -1.33 0.00 0.00 177.39 175.39 2j00 s SER 175 N -2.50 -0.99 -0.16 -1.43 1.04 -1.23 -4.81 113.70 103.63 2j00 s SER 175 Ca 0.10 0.09 -0.16 0.00 0.48 0.00 0.00 55.95 56.46 2j00 s SER 175 Cb 0.00 1.61 -0.04 0.00 0.10 0.00 0.00 66.02 67.69 2j00 s SER 175 CO 0.07 -0.18 0.37 -0.22 0.98 0.00 0.00 173.24 174.26 2j00 s LEU 176 N 2.85 4.24 -0.87 2.42 2.96 -1.26 -1.54 118.68 127.47 2j00 s LEU 176 Ca 0.19 0.60 0.00 0.00 -0.22 0.00 0.00 54.13 54.71 2j00 s LEU 176 Cb -0.05 -2.50 0.34 0.00 0.50 0.00 0.00 46.19 44.48 2j00 s LEU 176 CO -0.24 0.04 1.69 -0.67 -1.32 0.00 0.00 176.35 175.85 2j00 n ASP 177 N 3.77 6.78 -0.03 3.68 -0.08 -1.14 -4.91 116.55 124.63 2j00 n ASP 177 Ca -0.10 -3.73 0.02 0.00 -1.51 0.00 0.00 54.79 49.47 2j00 n ASP 177 Cb 0.52 -1.00 0.04 0.00 2.34 0.00 0.00 41.12 43.01 2j00 n ASP 177 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 2j00 n VAL 178 N -0.25 -0.03 0.00 5.18 0.31 -1.26 -1.15 118.33 121.13 2j00 n VAL 178 Ca 0.46 0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.95 2j00 n VAL 178 Cb 0.30 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 32.98 2j00 n VAL 178 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2j00 n GLU 179 N -3.48 0.00 0.00 5.55 1.02 -1.26 -2.05 120.64 120.41 2j00 n GLU 179 Ca 0.02 0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 2j00 n GLU 179 Cb 0.08 -0.99 0.00 0.00 -0.02 0.00 0.00 31.44 30.51 2j00 n GLU 179 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2j00 n GLY 180 N -0.65 0.49 3.33 0.62 0.00 -0.30 -4.87 105.19 103.81 2j00 n GLY 180 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 2j00 n GLY 180 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2j00 n MET 181 N -0.07 -0.81 -3.36 1.61 0.00 -0.32 -4.87 117.12 109.30 2j00 n MET 181 Ca 0.00 0.31 -0.06 0.00 0.00 0.00 0.00 57.70 57.95 2j00 n MET 181 Cb 0.12 -1.16 -0.06 0.00 0.00 0.00 0.00 33.22 32.11 2j00 n MET 181 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 175.97 174.38 2j00 s LYS 182 N -4.06 0.40 0.81 3.17 -2.85 -1.25 -3.44 119.74 112.52 2j00 s LYS 182 Ca 0.04 0.75 -0.05 0.00 -1.00 0.00 0.00 55.97 55.72 2j00 s LYS 182 Cb -0.02 -0.07 0.16 0.00 -2.06 0.00 0.00 37.83 35.84 2j00 s LYS 182 CO 0.50 -0.56 1.11 0.20 0.10 0.00 0.00 175.35 176.70 2j00 s GLY 183 N 2.64 1.77 0.19 0.59 0.00 -0.80 -2.87 107.32 108.83 2j00 s GLY 183 Ca 0.12 -1.71 0.02 0.00 0.00 0.00 0.00 44.72 43.14 2j00 s GLY 183 CO -0.17 -1.04 0.02 0.54 0.00 0.00 0.00 173.10 172.45 2j00 s LYS 184 N -5.38 1.17 -0.51 2.90 1.02 -0.59 -0.98 119.74 117.38 2j00 s LYS 184 Ca 0.70 -1.58 -0.04 0.00 0.02 0.00 0.00 55.97 55.07 2j00 s LYS 184 Cb -0.04 -0.29 0.13 0.00 -0.52 0.00 0.00 37.83 37.12 2j00 s LYS 184 CO 0.47 -0.15 0.33 0.12 -0.92 0.00 0.00 175.35 175.20 2j00 s PHE 185 N -3.66 3.51 0.05 3.18 5.36 0.06 -3.57 117.98 122.91 2j00 s PHE 185 Ca 0.26 -2.44 -0.32 0.00 -0.96 0.00 0.00 56.93 53.47 2j00 s PHE 185 Cb 0.06 -3.27 -0.18 0.00 -0.34 0.00 0.00 43.02 39.29 2j00 s PHE 185 CO 0.06 -0.93 1.45 -0.07 -1.46 0.00 0.00 175.22 174.27 2j00 h LEU 186 N 7.72 -0.98 -7.57 6.12 3.38 -1.57 1.19 115.31 123.60 2j00 h LEU 186 Ca -0.09 0.03 0.16 0.00 0.09 0.00 0.00 57.88 58.08 2j00 h LEU 186 Cb 1.02 0.25 -0.09 0.00 0.09 0.00 0.00 40.66 41.93 2j00 h LEU 186 CO 0.73 -0.69 0.48 0.00 0.09 0.00 0.00 178.44 179.05 2j00 s ARG 187 N -5.48 1.16 -0.02 1.13 1.70 -1.22 -4.35 118.95 111.87 2j00 s ARG 187 Ca -0.17 -0.62 -0.30 0.00 -0.47 0.00 0.00 55.73 54.18 2j00 s ARG 187 Cb 0.02 0.41 -0.06 0.00 -0.57 0.00 0.00 34.95 34.75 2j00 s ARG 187 CO 0.51 -0.53 1.50 -0.51 -1.08 0.00 0.00 175.30 175.19 2j00 s LEU 188 N -2.88 4.31 0.58 -1.89 1.43 -1.26 -4.80 118.68 114.17 2j00 s LEU 188 Ca 0.11 2.17 -0.20 0.00 -1.03 0.00 0.00 54.13 55.18 2j00 s LEU 188 Cb -0.01 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.62 2j00 s LEU 188 CO 0.01 -0.81 1.32 -2.16 0.23 0.00 0.00 176.35 174.93 2j00 s PRO 189 N 3.02 2.96 0.06 1.29 0.04 -1.26 -5.02 135.00 136.11 2j00 s PRO 189 Ca 0.67 2.13 0.01 0.00 0.04 0.00 0.00 61.00 63.86 2j00 s PRO 189 Cb -0.32 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 32.07 2j00 s PRO 189 CO 0.27 -1.30 0.15 0.34 0.04 0.00 0.00 177.00 176.51 2j00 s ASP 190 N -1.16 5.99 0.07 6.66 2.15 -1.26 -4.70 116.67 124.43 2j00 s ASP 190 Ca 0.75 0.15 -0.14 0.00 0.43 0.00 0.00 52.55 53.75 2j00 s ASP 190 Cb -0.38 -1.75 -0.02 0.00 -0.30 0.00 0.00 42.92 40.46 2j00 s ASP 190 CO 0.43 0.18 0.70 -1.14 -0.17 0.00 0.00 175.17 175.17 2j00 n ARG 191 N 0.40 -0.19 -0.32 4.34 3.00 -1.26 0.14 116.66 122.76 2j00 n ARG 191 Ca -0.07 0.68 0.19 0.00 -0.00 0.00 0.00 57.85 58.66 2j00 n ARG 191 Cb 0.51 -1.01 0.39 0.00 0.00 0.00 0.00 32.46 32.35 2j00 n ARG 191 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2j00 h GLU 192 N 0.00 0.10 -1.00 -0.14 3.07 -2.04 0.66 114.58 115.24 2j00 h GLU 192 Ca 0.08 -0.01 0.03 0.00 -0.50 0.00 0.00 59.36 58.96 2j00 h GLU 192 Cb 0.19 -0.02 -0.06 0.00 -0.84 0.00 0.00 28.75 28.02 2j00 h GLU 192 CO -0.43 0.06 0.65 -0.44 -1.40 0.00 0.00 179.01 177.46 2j00 h ASP 193 N 0.10 1.10 -3.61 1.42 3.32 0.84 -3.42 116.42 116.18 2j00 h ASP 193 Ca 0.66 -0.01 -0.49 0.00 0.02 0.00 0.00 57.03 57.21 2j00 h ASP 193 Cb 1.50 -0.26 0.04 0.00 0.22 0.00 0.00 39.33 40.83 2j00 h ASP 193 CO -0.77 0.76 0.13 -0.76 -1.72 0.00 0.00 179.24 176.88 2j00 s LEU 194 N -10.14 3.61 -0.46 1.55 2.01 0.23 -4.97 118.68 110.50 2j00 s LEU 194 Ca -0.13 0.95 0.07 0.00 0.01 0.00 0.00 54.13 55.03 2j00 s LEU 194 Cb 0.19 -3.91 0.28 0.00 0.01 0.00 0.00 46.19 42.75 2j00 s LEU 194 CO 0.82 -0.59 0.95 0.00 1.01 0.00 0.00 176.35 178.53 2j00 n ALA 195 N -2.28 -0.68 -2.85 4.21 0.00 -1.26 -4.91 120.51 112.74 2j00 n ALA 195 Ca 0.01 -1.69 -0.29 0.00 0.00 0.00 0.00 53.44 51.46 2j00 n ALA 195 Cb 0.55 -1.20 -0.05 0.00 0.00 0.00 0.00 19.45 18.75 2j00 n ALA 195 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2j00 s LEU 196 N -1.47 4.07 -0.48 0.00 1.02 -1.26 -4.97 118.68 115.59 2j00 s LEU 196 Ca 0.29 0.10 -0.12 0.00 0.02 0.00 0.00 54.13 54.42 2j00 s LEU 196 Cb 0.26 -2.70 -0.11 0.00 0.02 0.00 0.00 46.19 43.65 2j00 s LEU 196 CO -0.15 0.14 1.67 -0.81 0.02 0.00 0.00 176.35 177.22 2j00 n PRO 197 N 0.15 1.03 -3.73 1.29 -0.04 -1.26 -4.78 135.00 127.66 2j00 n PRO 197 Ca -0.07 -1.20 -0.14 0.00 -0.04 0.00 0.00 63.50 62.06 2j00 n PRO 197 Cb 0.52 -2.44 -0.09 0.00 -0.04 0.00 0.00 33.50 31.45 2j00 n PRO 197 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2j00 s VAL 198 N 4.79 0.03 -0.74 0.52 1.01 -1.26 -4.90 120.40 119.84 2j00 s VAL 198 Ca 0.37 -0.21 -0.06 0.00 0.00 0.00 0.00 61.98 62.08 2j00 s VAL 198 Cb 0.09 -0.61 0.19 0.00 0.00 0.00 0.00 36.38 36.05 2j00 s VAL 198 CO 0.07 -0.11 0.61 0.21 0.00 0.00 0.00 175.10 175.88 2j00 s ASN 199 N -0.56 5.84 0.46 3.32 3.84 -1.26 -4.94 114.94 121.63 2j00 s ASN 199 Ca -0.07 -2.99 0.36 0.00 0.21 0.00 0.00 52.86 50.37 2j00 s ASN 199 Cb -0.04 -1.97 1.24 0.00 -0.55 0.00 0.00 41.25 39.93 2j00 s ASN 199 CO 0.03 -0.39 1.20 -1.84 -2.79 0.00 0.00 177.10 173.31 2j00 n GLU 200 N 3.38 0.00 0.39 0.43 0.00 -1.26 -0.96 120.64 122.62 2j00 n GLU 200 Ca 0.12 0.86 -0.19 0.00 0.00 0.00 0.00 57.16 57.95 2j00 n GLU 200 Cb 0.40 -2.01 -0.10 0.00 0.00 0.00 0.00 31.44 29.73 2j00 n GLU 200 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.13 179.09 2j00 h GLN 201 N 0.00 -1.10 -0.82 3.44 1.08 -1.94 -1.37 115.11 114.39 2j00 h GLN 201 Ca 0.67 0.08 0.11 0.00 -1.45 0.00 0.00 58.65 58.06 2j00 h GLN 201 Cb 2.88 0.25 -0.13 0.00 -0.05 0.00 0.00 27.48 30.44 2j00 h GLN 201 CO -0.01 -0.73 -0.46 -0.07 -0.95 0.00 0.00 178.83 176.60 2j00 h LEU 202 N -1.14 -1.67 -0.58 1.46 3.38 -1.43 0.55 115.31 115.89 2j00 h LEU 202 Ca -0.09 0.29 0.12 0.00 0.09 0.00 0.00 57.88 58.28 2j00 h LEU 202 Cb 0.94 0.78 -0.11 0.00 0.09 0.00 0.00 40.66 42.36 2j00 h LEU 202 CO 0.05 -0.29 -0.17 0.58 0.09 0.00 0.00 178.44 178.69 2j00 h VAL 203 N -0.10 0.38 0.12 1.22 2.07 -1.57 0.82 116.25 119.18 2j00 h VAL 203 Ca 0.23 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.76 2j00 h VAL 203 Cb 0.53 0.38 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 2j00 h VAL 203 CO -0.85 0.00 -0.50 0.40 0.02 0.00 0.00 177.57 176.64 2j00 h ILE 204 N -0.03 0.05 -0.27 4.57 1.08 0.10 -2.20 117.51 120.80 2j00 h ILE 204 Ca 0.27 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.80 2j00 h ILE 204 Cb 0.45 0.05 -0.08 0.00 -3.07 0.00 0.00 36.82 34.17 2j00 h ILE 204 CO -0.61 0.00 -0.46 -0.33 -0.69 0.00 0.00 178.15 176.06 2j00 h GLU 205 N -0.73 -0.42 -0.99 2.37 5.08 0.23 -0.90 114.58 119.23 2j00 h GLU 205 Ca 0.00 0.03 0.33 0.00 -1.00 0.00 0.00 59.36 58.73 2j00 h GLU 205 Cb 0.74 0.09 -0.16 0.00 0.50 0.00 0.00 28.75 29.93 2j00 h GLU 205 CO -0.28 -0.28 0.49 0.35 -1.00 0.00 0.00 179.01 178.29 2j00 h PHE 206 N -0.43 0.77 -0.02 4.33 3.57 0.84 0.13 116.94 126.13 2j00 h PHE 206 Ca 0.09 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 2j00 h PHE 206 Cb 0.62 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 39.18 2j00 h PHE 206 CO -0.59 -0.28 0.01 0.66 -2.23 0.00 0.00 178.31 175.89 2j00 n TYR 207 N -5.16 0.07 -0.57 0.41 0.53 -0.34 -1.86 117.16 110.24 2j00 n TYR 207 Ca 0.32 -0.26 0.00 0.00 -1.02 0.00 0.00 57.90 56.93 2j00 n TYR 207 Cb 1.01 -0.19 0.00 0.00 -1.03 0.00 0.00 39.34 39.14 2j00 n TYR 207 CO 0.00 0.00 0.00 0.43 -1.02 0.00 0.00 176.86 176.27 2j00 n SER 208 N 0.22 0.61 0.00 7.72 7.64 0.45 -5.08 113.62 125.18 2j00 n SER 208 Ca 0.01 -1.18 0.00 0.00 1.01 0.00 0.00 58.87 58.71 2j00 n SER 208 Cb 0.40 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 2j00 n SER 208 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89