#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kly n MET 12 N 0.00 2.25 -1.21 7.34 0.00 -1.26 -0.86 117.12 123.37 1kly n MET 12 Ca 0.00 0.82 -0.08 0.00 0.00 0.00 0.00 57.70 58.43 1kly n MET 12 Cb 0.00 -2.63 -0.04 0.00 0.00 0.00 0.00 33.22 30.56 1kly n MET 12 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1kly n ASN 13 N 4.78 -5.54 -2.30 6.12 5.03 -1.26 -2.03 115.26 120.06 1kly n ASN 13 Ca 0.19 0.20 -0.20 0.00 0.87 0.00 0.00 54.58 55.65 1kly n ASN 13 Cb 0.30 -3.91 -0.02 0.00 -1.02 0.00 0.00 39.78 35.14 1kly n ASN 13 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1kly n ARG 14 N -0.40 -1.73 -4.27 3.52 1.74 -0.04 -4.96 116.66 110.52 1kly n ARG 14 Ca -0.08 0.98 -0.28 0.00 -0.77 0.00 0.00 57.85 57.70 1kly n ARG 14 Cb 0.55 -5.59 -0.17 0.00 -1.02 0.00 0.00 32.46 26.23 1kly n ARG 14 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1kly s LEU 15 N -5.79 1.56 -0.16 0.55 2.96 -0.86 -1.14 118.68 115.79 1kly s LEU 15 Ca 0.00 -0.38 -0.02 0.00 -0.22 0.00 0.00 54.13 53.52 1kly s LEU 15 Cb 0.00 -0.99 -0.01 0.00 0.50 0.00 0.00 46.19 45.69 1kly s LEU 15 CO 0.00 -0.03 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.28 1kly s ILE 16 N 1.19 3.22 -0.14 6.68 1.01 0.33 -4.52 121.20 128.97 1kly s ILE 16 Ca -0.03 -0.58 -0.25 0.00 0.00 0.00 0.00 60.65 59.79 1kly s ILE 16 Cb -0.14 -2.40 -0.02 0.00 0.01 0.00 0.00 42.46 39.91 1kly s ILE 16 CO -0.04 0.49 0.80 -0.22 0.00 0.00 0.00 174.94 175.98 1kly s LEU 17 N 0.70 4.21 -0.54 2.97 2.96 -1.01 -0.99 118.68 126.98 1kly s LEU 17 Ca -0.05 1.19 -0.20 0.00 -0.22 0.00 0.00 54.13 54.85 1kly s LEU 17 Cb -0.15 -3.20 0.07 0.00 0.50 0.00 0.00 46.19 43.40 1kly s LEU 17 CO 0.02 -0.32 0.72 0.00 -1.32 0.00 0.00 176.35 175.44 1kly s ALA 18 N 1.79 3.34 -0.97 5.97 0.00 0.07 -0.32 121.76 131.64 1kly s ALA 18 Ca 0.38 -1.77 -0.17 0.00 0.00 0.00 0.00 51.96 50.41 1kly s ALA 18 Cb -0.17 -3.48 0.16 0.00 0.00 0.00 0.00 23.12 19.63 1kly s ALA 18 CO 0.14 -2.20 1.11 1.41 0.00 0.00 0.00 175.76 176.23 1kly s MET 19 N 2.95 3.71 -0.17 0.00 1.75 -0.35 -4.34 119.30 122.86 1kly s MET 19 Ca 0.17 -2.11 0.16 0.00 -1.25 0.00 0.00 55.69 52.66 1kly s MET 19 Cb -0.19 -4.83 0.67 0.00 2.84 0.00 0.00 34.83 33.32 1kly s MET 19 CO 0.12 -1.65 1.58 -0.25 -0.65 0.00 0.00 175.02 174.17 1kly n ASP 20 N 5.71 4.70 -4.78 1.11 8.00 -1.26 -4.37 116.55 125.66 1kly n ASP 20 Ca 0.24 -2.75 -0.34 0.00 0.71 0.00 0.00 54.79 52.65 1kly n ASP 20 Cb 0.47 -0.58 0.03 0.00 -0.02 0.00 0.00 41.12 41.02 1kly n ASP 20 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1kly s LEU 21 N -2.39 3.51 -0.01 0.64 1.43 -1.26 -4.66 118.68 115.94 1kly s LEU 21 Ca 0.47 2.02 0.22 0.00 -1.03 0.00 0.00 54.13 55.81 1kly s LEU 21 Cb 0.35 -4.56 -0.24 0.00 0.03 0.00 0.00 46.19 41.77 1kly s LEU 21 CO 0.16 -1.44 0.74 0.23 0.23 0.00 0.00 176.35 176.27 1kly n MET 22 N -2.04 0.31 -4.20 1.70 2.81 -1.26 -3.97 117.12 110.47 1kly n MET 22 Ca 0.10 -0.08 -0.35 0.00 -1.81 0.00 0.00 57.70 55.56 1kly n MET 22 Cb 0.52 -1.52 -0.09 0.00 -0.71 0.00 0.00 33.22 31.42 1kly n MET 22 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1kly s ASN 23 N -3.76 5.51 0.23 7.83 2.20 -1.26 -4.54 114.94 121.16 1kly s ASN 23 Ca 0.01 0.17 -0.06 0.00 -0.94 0.00 0.00 52.86 52.04 1kly s ASN 23 Cb 0.15 -1.72 0.36 0.00 -2.00 0.00 0.00 41.25 38.04 1kly s ASN 23 CO 0.88 0.32 1.80 -0.09 -2.94 0.00 0.00 177.10 177.07 1kly h ARG 24 N 5.57 0.70 -0.41 3.55 2.43 -1.95 -0.76 114.38 123.52 1kly h ARG 24 Ca -0.47 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 58.65 1kly h ARG 24 Cb 1.19 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.57 1kly h ARG 24 CO 0.59 0.46 0.21 -0.44 -1.51 0.00 0.00 179.97 179.28 1kly h ASP 25 N 0.72 0.52 -0.38 -3.80 3.32 -1.99 0.07 116.42 114.88 1kly h ASP 25 Ca 0.37 -0.11 -0.15 0.00 0.02 0.00 0.00 57.03 57.17 1kly h ASP 25 Cb 0.34 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 1kly h ASP 25 CO -0.25 0.48 -0.34 0.44 -1.72 0.00 0.00 179.24 177.85 1kly h ASP 26 N 0.52 0.95 -0.64 6.45 3.32 -1.92 -1.19 116.42 123.92 1kly h ASP 26 Ca 0.14 -0.46 -0.00 0.00 0.02 0.00 0.00 57.03 56.73 1kly h ASP 26 Cb 0.08 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 1kly h ASP 26 CO -0.02 1.21 0.39 0.00 -1.72 0.00 0.00 179.24 179.11 1kly h ALA 27 N 0.77 0.82 -0.54 3.45 0.00 -0.89 -0.80 119.26 122.07 1kly h ALA 27 Ca 0.06 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 1kly h ALA 27 Cb 0.93 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1kly h ALA 27 CO 0.09 0.29 -0.07 -0.07 0.00 0.00 0.00 179.25 179.48 1kly h LEU 28 N 0.87 1.00 0.46 0.00 3.38 -0.91 -1.78 115.31 118.32 1kly h LEU 28 Ca 0.23 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 1kly h LEU 28 Cb -0.04 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.45 1kly h LEU 28 CO -0.04 1.10 -0.22 -0.09 0.09 0.00 0.00 178.44 179.27 1kly h ARG 29 N 0.87 -0.60 -0.50 1.13 2.43 -0.80 -1.23 114.38 115.69 1kly h ARG 29 Ca 0.14 0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.33 1kly h ARG 29 Cb 0.63 0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.30 1kly h ARG 29 CO 0.04 -0.39 0.20 0.28 -1.51 0.00 0.00 179.97 178.59 1kly h VAL 30 N -0.63 1.21 -0.80 0.20 2.07 -1.18 -1.46 116.25 115.66 1kly h VAL 30 Ca -0.06 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 66.78 1kly h VAL 30 Cb 0.48 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 1kly h VAL 30 CO 0.10 0.25 0.43 0.74 0.02 0.00 0.00 177.57 179.11 1kly h THR 31 N 0.66 1.24 -0.44 2.57 2.02 -1.30 -2.05 112.91 115.61 1kly h THR 31 Ca 0.17 -0.61 -0.08 0.00 0.77 0.00 0.00 66.41 66.66 1kly h THR 31 Cb 0.19 0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 66.77 1kly h THR 31 CO -0.01 0.27 -0.04 1.23 0.37 0.00 0.00 175.52 177.33 1kly h GLY 32 N 1.11 0.81 1.95 2.16 0.00 -0.94 -1.86 103.07 106.30 1kly h GLY 32 Ca 0.28 -0.56 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 1kly h GLY 32 CO -0.04 0.51 -0.31 0.83 0.00 0.00 0.00 176.54 177.53 1kly h GLU 33 N 0.69 0.06 -0.40 4.80 5.08 -0.70 -3.07 114.58 121.04 1kly h GLU 33 Ca 0.13 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1kly h GLU 33 Cb 0.49 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1kly h GLU 33 CO 0.03 0.36 0.00 1.33 -1.00 0.00 0.00 179.01 179.73 1kly n VAL 34 N -4.16 0.80 -0.18 3.13 0.24 -0.83 -4.55 118.33 112.78 1kly n VAL 34 Ca -0.02 -0.90 0.12 0.00 -2.04 0.00 0.00 64.34 61.50 1kly n VAL 34 Cb 0.36 0.66 0.44 0.00 -1.47 0.00 0.00 33.84 33.83 1kly n VAL 34 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1kly h ARG 35 N 2.89 0.54 0.00 7.34 9.65 -1.24 -0.79 114.38 132.77 1kly h ARG 35 Ca 0.00 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 1kly h ARG 35 Cb 0.79 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 29.25 1kly h ARG 35 CO 0.00 0.36 0.00 1.05 2.80 0.00 0.00 179.97 184.18 1kly h GLU 36 N 0.56 0.00 0.00 0.20 4.11 -1.83 -2.65 114.58 114.97 1kly h GLU 36 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.80 1kly h GLU 36 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1kly h GLU 36 CO -0.13 0.00 -1.04 0.66 0.07 0.00 0.00 179.01 178.57 1kly n TYR 37 N -2.71 0.05 -4.41 2.06 4.02 -0.31 -4.99 117.16 110.86 1kly n TYR 37 Ca 0.00 0.01 -0.22 0.00 -0.01 0.00 0.00 57.90 57.69 1kly n TYR 37 Cb 0.21 -0.17 -0.09 0.00 -0.02 0.00 0.00 39.34 39.27 1kly n TYR 37 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 1kly s ILE 38 N -3.09 0.45 0.00 -0.72 -4.36 -1.00 -4.38 121.20 108.10 1kly s ILE 38 Ca 0.06 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.45 1kly s ILE 38 Cb 0.16 -2.46 0.00 0.00 1.25 0.00 0.00 42.46 41.41 1kly s ILE 38 CO 0.84 0.00 0.03 -0.90 0.24 0.00 0.00 174.94 175.15 1kly n ASP 39 N -1.16 0.00 -3.85 4.36 5.75 -1.26 -4.83 116.55 115.56 1kly n ASP 39 Ca -0.01 -1.00 -0.20 0.00 -0.01 0.00 0.00 54.79 53.57 1kly n ASP 39 Cb 0.65 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 40.57 1kly n ASP 39 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1kly s THR 40 N 0.00 0.41 -0.07 2.12 2.01 -1.26 -0.98 115.64 117.88 1kly s THR 40 Ca 0.00 -0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.03 1kly s THR 40 Cb 0.00 -0.48 -0.01 0.00 0.01 0.00 0.00 72.50 72.02 1kly s THR 40 CO 0.00 0.21 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.23 1kly s VAL 41 N 1.14 1.88 -0.28 3.82 1.01 -0.41 -2.41 120.40 125.15 1kly s VAL 41 Ca -0.08 -0.96 -0.13 0.00 0.00 0.00 0.00 61.98 60.82 1kly s VAL 41 Cb -0.14 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 1kly s VAL 41 CO -0.01 0.53 0.29 -0.75 0.00 0.00 0.00 175.10 175.15 1kly s LYS 42 N 0.04 3.94 -0.16 2.72 2.20 0.57 -1.05 119.74 128.00 1kly s LYS 42 Ca -0.08 -0.17 -0.03 0.00 -0.36 0.00 0.00 55.97 55.33 1kly s LYS 42 Cb -0.14 -3.67 -0.02 0.00 -1.51 0.00 0.00 37.83 32.48 1kly s LYS 42 CO 0.05 -0.26 -0.06 0.42 -0.36 0.00 0.00 175.35 175.14 1kly s ILE 43 N 1.92 3.61 0.00 5.43 1.01 -0.06 -1.20 121.20 131.90 1kly s ILE 43 Ca 0.11 -0.45 0.00 0.00 0.00 0.00 0.00 60.65 60.30 1kly s ILE 43 Cb -0.16 -2.57 0.00 0.00 0.01 0.00 0.00 42.46 39.74 1kly s ILE 43 CO 0.11 0.49 0.00 0.61 0.00 0.00 0.00 174.94 176.15 1kly n GLY 44 N 3.68 5.64 0.20 6.18 0.00 -1.26 -0.40 105.19 119.22 1kly n GLY 44 Ca -0.18 -2.12 0.01 0.00 0.00 0.00 0.00 46.02 43.73 1kly n GLY 44 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1kly h TYR 45 N 0.60 0.12 -0.99 1.61 0.99 -1.96 -1.83 116.97 115.51 1kly h TYR 45 Ca 0.00 -0.02 0.10 0.00 2.00 0.00 0.00 58.73 60.80 1kly h TYR 45 Cb 0.00 -0.03 -0.08 0.00 1.00 0.00 0.00 36.73 37.62 1kly h TYR 45 CO 0.00 0.42 0.62 -1.35 -0.00 0.00 0.00 178.16 177.86 1kly h PRO 46 N 0.10 1.02 0.10 4.88 0.11 -1.92 0.11 132.00 136.39 1kly h PRO 46 Ca 0.01 -0.06 -0.21 0.00 0.11 0.00 0.00 66.00 65.85 1kly h PRO 46 Cb 0.62 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.51 1kly h PRO 46 CO 0.05 0.67 -1.02 1.25 -0.21 0.00 0.00 178.00 178.74 1kly h LEU 47 N 1.05 0.33 -0.84 2.35 5.85 -1.65 -3.30 115.31 119.09 1kly h LEU 47 Ca 0.46 -0.87 -0.06 0.00 0.84 0.00 0.00 57.88 58.25 1kly h LEU 47 Cb 0.36 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 1kly h LEU 47 CO -0.23 1.45 0.19 0.58 -0.34 0.00 0.00 178.44 180.09 1kly h VAL 48 N -0.48 1.25 0.00 1.05 2.07 -1.18 0.30 116.25 119.26 1kly h VAL 48 Ca -0.22 -0.90 0.00 0.00 0.82 0.00 0.00 66.70 66.41 1kly h VAL 48 Cb 1.58 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1kly h VAL 48 CO 0.06 0.35 0.00 -0.07 0.02 0.00 0.00 177.57 177.92 1kly h LEU 49 N 1.01 0.00 0.05 2.57 3.38 -0.96 0.26 115.31 121.62 1kly h LEU 49 Ca 0.22 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.83 1kly h LEU 49 Cb 0.32 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1kly h LEU 49 CO -0.00 0.00 -2.13 -1.20 0.09 0.00 0.00 178.44 175.20 1kly n SER 50 N -2.52 1.59 -0.09 -0.43 7.64 -0.92 -4.65 113.62 114.23 1kly n SER 50 Ca 0.03 0.13 0.02 0.00 1.01 0.00 0.00 58.87 60.06 1kly n SER 50 Cb 0.35 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 1kly n SER 50 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1kly n GLU 51 N -3.25 2.23 0.00 1.43 -0.58 0.05 -5.03 120.64 115.49 1kly n GLU 51 Ca -0.33 -0.43 0.00 0.00 -0.42 0.00 0.00 57.16 55.98 1kly n GLU 51 Cb 1.05 -0.91 0.00 0.00 -0.57 0.00 0.00 31.44 31.01 1kly n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1kly n GLY 52 N 0.60 0.86 0.31 0.62 0.00 0.90 -4.62 105.19 103.86 1kly n GLY 52 Ca 0.02 -1.72 0.20 0.00 0.00 0.00 0.00 46.02 44.52 1kly n GLY 52 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1kly h MET 53 N 0.00 0.00 0.00 1.61 2.86 -1.94 -2.57 114.93 114.89 1kly h MET 53 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1kly h MET 53 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1kly h MET 53 CO 0.00 0.00 0.00 -0.44 1.06 0.00 0.00 176.91 177.53 1kly h ASP 54 N 0.00 0.00 0.23 1.22 3.32 -1.92 -2.24 116.42 117.03 1kly h ASP 54 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1kly h ASP 54 Cb 0.26 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.81 1kly h ASP 54 CO 0.00 0.00 -0.07 -0.29 -1.72 0.00 0.00 179.24 177.16 1kly h ILE 55 N 0.00 0.51 -0.03 0.35 6.09 -1.71 -2.17 117.51 120.55 1kly h ILE 55 Ca 0.00 -0.32 -0.00 0.00 -1.37 0.00 0.00 64.86 63.17 1kly h ILE 55 Cb 0.19 1.21 -0.00 0.00 0.47 0.00 0.00 36.82 38.69 1kly h ILE 55 CO 0.00 0.07 0.00 0.40 -3.07 0.00 0.00 178.15 175.55 1kly h ILE 56 N 0.00 1.25 -0.25 2.19 2.04 -1.64 -1.12 117.51 119.98 1kly h ILE 56 Ca -0.00 -0.75 -0.09 0.00 1.00 0.00 0.00 64.86 65.02 1kly h ILE 56 Cb 0.20 1.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.97 1kly h ILE 56 CO 0.01 0.20 -0.22 0.00 0.00 0.00 0.00 178.15 178.13 1kly h ALA 57 N 0.71 1.15 -0.32 1.87 0.00 -1.53 -1.43 119.26 119.70 1kly h ALA 57 Ca 0.01 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 1kly h ALA 57 Cb 0.32 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1kly h ALA 57 CO 0.00 0.54 0.13 1.49 0.00 0.00 0.00 179.25 181.41 1kly h GLU 58 N 0.42 0.48 -0.33 0.00 4.81 -1.24 -1.49 114.58 117.22 1kly h GLU 58 Ca 0.07 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 1kly h GLU 58 Cb 0.62 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 1kly h GLU 58 CO 0.04 0.48 0.15 0.74 -0.73 0.00 0.00 179.01 179.70 1kly h PHE 59 N 0.37 0.49 -0.80 0.92 -1.00 -0.94 0.24 116.94 116.23 1kly h PHE 59 Ca 0.11 -0.03 0.05 0.00 2.81 0.00 0.00 57.97 60.92 1kly h PHE 59 Cb 0.18 -0.15 -0.06 0.00 3.61 0.00 0.00 35.95 39.53 1kly h PHE 59 CO -0.01 0.43 0.49 -0.09 -1.61 0.00 0.00 178.31 177.52 1kly h ARG 60 N 0.40 0.88 0.20 1.51 2.43 -1.12 -0.25 114.38 118.43 1kly h ARG 60 Ca 0.11 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1kly h ARG 60 Cb 0.13 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1kly h ARG 60 CO -0.01 0.58 -0.10 -0.22 -1.51 0.00 0.00 179.97 178.71 1kly h LYS 61 N 0.90 -0.26 -0.91 0.20 3.64 -1.13 -0.20 116.57 118.81 1kly h LYS 61 Ca 0.34 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.78 1kly h LYS 61 Cb 0.14 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.97 1kly h LYS 61 CO -0.16 0.09 0.59 -0.09 -2.27 0.00 0.00 179.45 177.61 1kly h ARG 62 N -0.94 1.10 0.00 1.90 2.43 -0.87 -3.20 114.38 114.80 1kly h ARG 62 Ca -0.03 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1kly h ARG 62 Cb 0.48 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 1kly h ARG 62 CO 0.05 0.73 -0.75 1.19 -1.51 0.00 0.00 179.97 179.67 1kly n PHE 63 N -4.52 0.00 -2.26 2.20 3.01 -0.11 -4.99 117.46 110.80 1kly n PHE 63 Ca 0.12 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.38 1kly n PHE 63 Cb 0.10 -0.01 -0.02 0.00 -0.01 0.00 0.00 39.48 39.54 1kly n PHE 63 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1kly n GLY 64 N 1.37 -0.08 3.99 1.37 0.00 -0.09 -4.98 105.19 106.78 1kly n GLY 64 Ca 0.03 -0.03 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 1kly n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kly s ARG 66 N -4.33 3.98 -0.13 0.00 6.06 -0.15 -4.62 118.95 119.76 1kly s ARG 66 Ca 0.49 0.56 0.02 0.00 -2.50 0.00 0.00 55.73 54.31 1kly s ARG 66 Cb -0.10 -2.65 0.01 0.00 0.06 0.00 0.00 34.95 32.28 1kly s ARG 66 CO 0.33 0.29 -0.19 0.42 -2.50 0.00 0.00 175.30 173.66 1kly s ILE 67 N -1.78 1.81 -0.22 4.11 -1.09 -1.26 -1.29 121.20 121.49 1kly s ILE 67 Ca 0.48 -0.83 -0.09 0.00 -2.23 0.00 0.00 60.65 57.98 1kly s ILE 67 Cb -0.12 -1.62 -0.04 0.00 -1.58 0.00 0.00 42.46 39.09 1kly s ILE 67 CO 0.19 0.50 0.10 -0.63 -1.23 0.00 0.00 174.94 173.88 1kly s ILE 68 N 0.89 4.88 -0.45 2.92 1.01 -0.21 -0.95 121.20 129.29 1kly s ILE 68 Ca -0.07 0.01 -0.25 0.00 0.00 0.00 0.00 60.65 60.34 1kly s ILE 68 Cb -0.15 -3.25 0.03 0.00 0.01 0.00 0.00 42.46 39.09 1kly s ILE 68 CO -0.02 0.38 0.91 0.00 0.00 0.00 0.00 174.94 176.22 1kly s ALA 69 N 0.96 3.26 -1.30 9.38 0.00 0.46 -0.88 121.76 133.63 1kly s ALA 69 Ca 0.05 -0.77 -0.11 0.00 0.00 0.00 0.00 51.96 51.14 1kly s ALA 69 Cb -0.14 -3.61 0.15 0.00 0.00 0.00 0.00 23.12 19.52 1kly s ALA 69 CO 0.03 -1.98 1.89 0.41 0.00 0.00 0.00 175.76 176.11 1kly n GLY 70 N 4.86 4.54 0.42 0.00 0.00 0.46 -1.62 105.19 113.86 1kly n GLY 70 Ca 0.06 -2.00 0.11 0.00 0.00 0.00 0.00 46.02 44.20 1kly n GLY 70 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1kly n PHE 71 N 4.47 0.00 -4.02 1.61 0.99 -1.26 -4.25 117.46 115.01 1kly n PHE 71 Ca 0.42 0.00 -0.28 0.00 -0.00 0.00 0.00 57.45 57.59 1kly n PHE 71 Cb 0.37 -0.03 -0.03 0.00 -1.00 0.00 0.00 39.48 38.80 1kly n PHE 71 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 1kly n LYS 72 N -0.22 -3.16 -1.66 -1.08 4.76 -0.89 -4.74 118.16 111.17 1kly n LYS 72 Ca 0.10 0.38 -0.50 0.00 -2.87 0.00 0.00 58.31 55.42 1kly n LYS 72 Cb 0.44 -4.58 -0.05 0.00 -1.84 0.00 0.00 35.03 28.99 1kly n LYS 72 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1kly n VAL 73 N -4.42 0.21 -2.69 -0.18 0.31 -0.93 -4.44 118.33 106.20 1kly n VAL 73 Ca -0.24 -0.04 -0.08 0.00 -0.01 0.00 0.00 64.34 63.97 1kly n VAL 73 Cb 0.65 -1.42 0.08 0.00 -0.91 0.00 0.00 33.84 32.23 1kly n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1kly n ALA 74 N 4.41 2.25 -4.14 3.52 0.00 -1.26 -0.81 120.51 124.48 1kly n ALA 74 Ca 0.20 -2.19 -0.08 0.00 0.00 0.00 0.00 53.44 51.38 1kly n ALA 74 Cb 0.24 -0.97 -0.02 0.00 0.00 0.00 0.00 19.45 18.71 1kly n ALA 74 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1kly n ASP 75 N -0.32 2.21 -4.76 0.00 -0.08 -1.26 -4.98 116.55 107.36 1kly n ASP 75 Ca 0.03 -1.52 -0.30 0.00 -1.51 0.00 0.00 54.79 51.49 1kly n ASP 75 Cb 0.83 0.10 0.11 0.00 2.34 0.00 0.00 41.12 44.50 1kly n ASP 75 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 1kly s ILE 76 N -1.47 3.04 0.20 5.18 -4.36 -1.26 -4.71 121.20 117.82 1kly s ILE 76 Ca 0.00 0.34 -0.13 0.00 -0.26 0.00 0.00 60.65 60.60 1kly s ILE 76 Cb 0.00 -2.92 0.18 0.00 1.25 0.00 0.00 42.46 40.97 1kly s ILE 76 CO 0.00 -0.44 1.66 -0.65 0.24 0.00 0.00 174.94 175.75 1kly h PRO 77 N -1.25 0.06 -0.69 0.37 0.11 -1.87 -0.16 132.00 128.57 1kly h PRO 77 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1kly h PRO 77 Cb 1.26 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 1kly h PRO 77 CO 0.55 0.04 0.45 0.93 -0.21 0.00 0.00 178.00 179.77 1kly h GLU 78 N 0.07 0.91 -0.18 1.05 3.07 -1.95 -0.62 114.58 116.94 1kly h GLU 78 Ca 0.29 -0.06 -0.19 0.00 -0.50 0.00 0.00 59.36 58.89 1kly h GLU 78 Cb 0.45 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 28.16 1kly h GLU 78 CO -0.52 0.61 -0.66 1.15 -1.40 0.00 0.00 179.01 178.19 1kly h THR 79 N 0.94 1.31 -0.97 1.13 2.02 -1.84 -2.88 112.91 112.61 1kly h THR 79 Ca 0.25 -1.91 0.04 0.00 0.77 0.00 0.00 66.41 65.56 1kly h THR 79 Cb -0.09 1.87 -0.06 0.00 -1.74 0.00 0.00 68.15 68.13 1kly h THR 79 CO -0.05 0.60 0.63 0.78 0.37 0.00 0.00 175.52 177.85 1kly h ASN 80 N 0.49 1.05 -0.53 4.18 4.21 -0.67 -0.30 115.58 124.02 1kly h ASN 80 Ca -0.02 -0.01 -0.00 0.00 1.21 0.00 0.00 56.30 57.48 1kly h ASN 80 Cb 1.25 -0.24 -0.03 0.00 -1.12 0.00 0.00 38.32 38.19 1kly h ASN 80 CO 0.13 0.71 0.33 -0.33 -1.29 0.00 0.00 177.43 176.98 1kly h GLU 81 N 1.22 0.72 -0.66 0.81 5.08 -1.02 -0.74 114.58 119.99 1kly h GLU 81 Ca 0.39 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.67 1kly h GLU 81 Cb 0.01 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.08 1kly h GLU 81 CO -0.13 0.51 0.33 0.87 -1.00 0.00 0.00 179.01 179.59 1kly h LYS 82 N 0.71 0.94 -0.24 2.33 1.57 -1.16 -0.10 116.57 120.62 1kly h LYS 82 Ca 0.19 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 1kly h LYS 82 Cb -0.03 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 1kly h LYS 82 CO -0.04 0.74 0.04 0.82 -0.57 0.00 0.00 179.45 180.44 1kly h ILE 83 N 0.91 1.22 -0.78 1.86 2.04 -0.75 -2.11 117.51 119.90 1kly h ILE 83 Ca 0.23 -0.75 -0.05 0.00 1.00 0.00 0.00 64.86 65.29 1kly h ILE 83 Cb 0.10 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 1kly h ILE 83 CO -0.03 0.24 0.28 0.00 0.00 0.00 0.00 178.15 178.64 1kly h ARG 85 N 1.15 0.64 -0.44 0.00 2.43 -0.88 -0.18 114.38 117.10 1kly h ARG 85 Ca 0.26 -0.09 -0.07 0.00 -0.81 0.00 0.00 59.98 59.27 1kly h ARG 85 Cb 0.26 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 1kly h ARG 85 CO -0.02 0.54 0.00 0.00 -1.51 0.00 0.00 179.97 178.99 1kly h ALA 86 N 1.07 1.18 -0.27 2.80 0.00 -1.18 -0.20 119.26 122.66 1kly h ALA 86 Ca 0.16 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1kly h ALA 86 Cb 0.11 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1kly h ALA 86 CO -0.02 0.54 -0.29 1.15 0.00 0.00 0.00 179.25 180.63 1kly h THR 87 N 0.68 1.31 -0.08 0.00 2.02 -0.79 -1.51 112.91 114.54 1kly h THR 87 Ca 0.14 -1.46 -0.16 0.00 0.77 0.00 0.00 66.41 65.69 1kly h THR 87 Cb 0.41 1.64 -0.01 0.00 -1.74 0.00 0.00 68.15 68.45 1kly h THR 87 CO 0.02 0.46 -0.65 -0.26 0.37 0.00 0.00 175.52 175.46 1kly h PHE 88 N 0.39 0.41 -0.43 3.16 0.04 -0.94 -2.62 116.94 116.95 1kly h PHE 88 Ca 0.04 -0.17 -0.01 0.00 2.80 0.00 0.00 57.97 60.63 1kly h PHE 88 Cb 0.86 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 38.92 1kly h PHE 88 CO 0.07 0.87 0.23 -0.22 -0.60 0.00 0.00 178.31 178.67 1kly h LYS 89 N 0.23 0.59 0.00 1.51 3.64 -0.92 -0.50 116.57 121.12 1kly h LYS 89 Ca -0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1kly h LYS 89 Cb 1.18 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 1kly h LYS 89 CO 0.11 0.44 0.00 0.00 -2.27 0.00 0.00 179.45 177.72 1kly n ALA 90 N -2.47 2.08 0.00 5.00 0.00 -0.58 -4.89 120.51 119.65 1kly n ALA 90 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1kly n ALA 90 Cb 0.10 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.21 1kly n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1kly n GLY 91 N 0.46 0.61 3.77 0.00 0.00 -0.19 -3.50 105.19 106.33 1kly n GLY 91 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 1kly n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kly s ALA 92 N -2.00 3.30 -0.07 4.61 0.00 -1.01 -4.86 121.76 121.72 1kly s ALA 92 Ca 0.00 1.24 0.13 0.00 0.00 0.00 0.00 51.96 53.33 1kly s ALA 92 Cb 0.00 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.60 1kly s ALA 92 CO 0.00 -0.80 1.33 -0.44 0.00 0.00 0.00 175.76 175.86 1kly h ASP 93 N 2.78 0.00 -5.09 0.00 3.32 -1.40 -3.43 116.42 112.62 1kly h ASP 93 Ca -0.49 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.52 1kly h ASP 93 Cb 1.24 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.68 1kly h ASP 93 CO 0.63 0.66 -0.02 0.00 -1.72 0.00 0.00 179.24 178.79 1kly s ALA 94 N -2.88 -0.93 0.01 3.45 0.00 -1.13 -2.29 121.76 117.99 1kly s ALA 94 Ca 0.02 -0.13 0.02 0.00 0.00 0.00 0.00 51.96 51.87 1kly s ALA 94 Cb 0.08 0.79 -0.01 0.00 0.00 0.00 0.00 23.12 23.98 1kly s ALA 94 CO 0.77 -0.72 -0.05 -1.50 0.00 0.00 0.00 175.76 174.25 1kly s ILE 95 N -3.84 0.42 -0.17 0.00 2.07 -0.55 -0.41 121.20 118.72 1kly s ILE 95 Ca 0.06 -0.40 -0.16 0.00 -1.41 0.00 0.00 60.65 58.75 1kly s ILE 95 Cb 0.00 -0.39 -0.04 0.00 0.13 0.00 0.00 42.46 42.17 1kly s ILE 95 CO -0.07 -0.00 0.38 -0.63 -1.91 0.00 0.00 174.94 172.70 1kly s ILE 96 N -0.40 5.23 -0.05 2.00 1.01 -0.64 -0.70 121.20 127.65 1kly s ILE 96 Ca -0.01 0.71 0.06 0.00 0.00 0.00 0.00 60.65 61.40 1kly s ILE 96 Cb -0.04 -3.72 -0.01 0.00 0.01 0.00 0.00 42.46 38.71 1kly s ILE 96 CO -0.00 0.31 -0.23 0.54 0.00 0.00 0.00 174.94 175.56 1kly s VAL 97 N 0.89 1.88 0.36 2.92 0.11 -0.05 -2.08 120.40 124.42 1kly s VAL 97 Ca 0.20 -0.97 -0.26 0.00 -2.93 0.00 0.00 61.98 58.01 1kly s VAL 97 Cb -0.14 -1.60 -0.09 0.00 -1.53 0.00 0.00 36.38 33.02 1kly s VAL 97 CO 0.07 0.53 1.13 -1.00 -3.33 0.00 0.00 175.10 172.50 1kly s HIS 98 N -0.12 3.26 -0.23 1.54 3.76 0.01 -0.58 115.29 122.94 1kly s HIS 98 Ca -0.03 1.61 0.22 0.00 -0.15 0.00 0.00 55.06 56.71 1kly s HIS 98 Cb -0.13 -3.32 -0.11 0.00 1.11 0.00 0.00 32.58 30.13 1kly s HIS 98 CO 0.03 -0.98 0.84 0.41 -0.85 0.00 0.00 174.74 174.20 1kly n GLY 99 N 0.74 -1.26 0.36 -2.22 0.00 -1.09 -4.41 105.19 97.30 1kly n GLY 99 Ca 0.03 -0.36 0.15 0.00 0.00 0.00 0.00 46.02 45.83 1kly n GLY 99 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1kly h PHE 100 N 0.00 0.22 0.00 1.61 3.57 -1.90 -1.14 116.94 119.30 1kly h PHE 100 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1kly h PHE 100 Cb 0.95 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.62 1kly h PHE 100 CO 0.00 0.10 0.00 -2.30 -2.23 0.00 0.00 178.31 173.88 1kly n PRO 101 N -4.44 0.53 0.00 6.41 -0.02 -1.26 -4.98 135.00 131.23 1kly n PRO 101 Ca 0.09 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 1kly n PRO 101 Cb 0.44 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.42 1kly n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1kly n GLY 102 N 0.42 2.12 0.34 -1.23 0.00 -0.43 -4.64 105.19 101.78 1kly n GLY 102 Ca 0.14 -2.03 -0.05 0.00 0.00 0.00 0.00 46.02 44.07 1kly n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kly h ALA 103 N 0.00 1.05 -0.75 4.61 0.00 -1.94 -2.50 119.26 119.75 1kly h ALA 103 Ca 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1kly h ALA 103 Cb 0.00 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 1kly h ALA 103 CO 0.00 0.66 0.34 0.38 0.00 0.00 0.00 179.25 180.63 1kly h ASP 104 N 1.18 0.98 -0.15 0.00 2.03 -1.99 0.15 116.42 118.61 1kly h ASP 104 Ca 0.27 -0.12 -0.09 0.00 -0.73 0.00 0.00 57.03 56.36 1kly h ASP 104 Cb 0.19 -0.25 -0.02 0.00 -0.83 0.00 0.00 39.33 38.42 1kly h ASP 104 CO -0.03 0.84 -0.20 0.28 -1.03 0.00 0.00 179.24 179.11 1kly h SER 105 N 1.07 0.57 -0.15 4.15 0.02 -1.76 -1.64 113.55 115.81 1kly h SER 105 Ca 0.26 -0.18 -0.16 0.00 -0.84 0.00 0.00 61.79 60.86 1kly h SER 105 Cb 0.14 -0.16 0.01 0.00 0.14 0.00 0.00 62.40 62.53 1kly h SER 105 CO -0.03 0.78 -0.54 0.58 -1.14 0.00 0.00 176.83 176.48 1kly h VAL 106 N 0.52 1.33 -0.63 2.27 2.07 -0.96 -3.20 116.25 117.65 1kly h VAL 106 Ca 0.08 -1.80 0.02 0.00 0.82 0.00 0.00 66.70 65.82 1kly h VAL 106 Cb 0.63 2.04 -0.03 0.00 -1.52 0.00 0.00 31.29 32.41 1kly h VAL 106 CO 0.04 0.55 0.42 -0.09 0.02 0.00 0.00 177.57 178.52 1kly h ARG 107 N 0.28 0.78 -0.97 1.57 9.65 -0.52 -0.78 114.38 124.39 1kly h ARG 107 Ca -0.03 -0.05 0.02 0.00 -1.10 0.00 0.00 59.98 58.82 1kly h ARG 107 Cb 1.17 -0.18 -0.05 0.00 -1.39 0.00 0.00 29.97 29.52 1kly h ARG 107 CO 0.11 0.52 0.64 0.00 2.80 0.00 0.00 179.97 184.05 1kly h ALA 108 N 1.62 1.32 -0.26 2.80 0.00 -1.30 0.85 119.26 124.29 1kly h ALA 108 Ca 0.24 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 1kly h ALA 108 Cb -0.02 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.39 1kly h ALA 108 CO -0.06 0.62 -0.30 0.00 0.00 0.00 0.00 179.25 179.51 1kly h LEU 110 N 0.38 0.76 -0.60 0.00 3.38 -0.74 -1.25 115.31 117.25 1kly h LEU 110 Ca 0.04 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 1kly h LEU 110 Cb 0.88 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1kly h LEU 110 CO 0.07 0.61 0.06 0.78 0.09 0.00 0.00 178.44 180.05 1kly h ASN 111 N 0.87 0.98 -0.33 -0.43 2.35 -0.74 -0.77 115.58 117.51 1kly h ASN 111 Ca 0.22 -0.28 -0.14 0.00 -0.55 0.00 0.00 56.30 55.55 1kly h ASN 111 Cb 0.01 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.11 1kly h ASN 111 CO -0.04 1.01 -0.32 0.58 -1.65 0.00 0.00 177.43 177.01 1kly h VAL 112 N 0.91 1.28 -0.84 2.81 2.07 -1.25 -1.78 116.25 119.45 1kly h VAL 112 Ca 0.18 -1.49 -0.02 0.00 0.82 0.00 0.00 66.70 66.19 1kly h VAL 112 Cb 0.47 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.53 1kly h VAL 112 CO 0.02 0.50 0.47 0.00 0.02 0.00 0.00 177.57 178.57 1kly h ALA 113 N 0.91 1.23 -0.45 1.67 0.00 -1.01 -0.69 119.26 120.92 1kly h ALA 113 Ca 0.07 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1kly h ALA 113 Cb 0.89 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1kly h ALA 113 CO 0.08 0.62 0.06 1.49 0.00 0.00 0.00 179.25 181.50 1kly h GLU 114 N 1.18 0.76 -0.41 0.00 4.81 -0.91 0.74 114.58 120.75 1kly h GLU 114 Ca 0.30 -0.21 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 1kly h GLU 114 Cb 0.02 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 1kly h GLU 114 CO -0.05 0.79 0.19 0.93 -0.73 0.00 0.00 179.01 180.14 1kly h GLU 115 N 0.62 0.57 -0.28 1.92 5.08 -0.76 -3.13 114.58 118.61 1kly h GLU 115 Ca 0.14 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1kly h GLU 115 Cb 0.41 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1kly h GLU 115 CO 0.01 0.45 0.00 -1.33 -1.00 0.00 0.00 179.01 177.14 1kly n MET 116 N -4.40 2.11 -3.34 2.33 2.81 -0.32 -4.98 117.12 111.33 1kly n MET 116 Ca 0.03 -1.96 -0.19 0.00 -1.81 0.00 0.00 57.70 53.77 1kly n MET 116 Cb 0.12 -1.39 0.06 0.00 -0.71 0.00 0.00 33.22 31.31 1kly n MET 116 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1kly n GLY 117 N 1.07 -0.23 1.56 3.03 0.00 0.07 -5.03 105.19 105.66 1kly n GLY 117 Ca 0.14 0.05 -0.14 0.00 0.00 0.00 0.00 46.02 46.08 1kly n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kly n ARG 118 N -4.02 1.33 -4.23 1.61 5.12 -0.13 -5.04 116.66 111.29 1kly n ARG 118 Ca 0.00 -1.59 -0.21 0.00 -1.93 0.00 0.00 57.85 54.13 1kly n ARG 118 Cb 0.55 0.51 -0.12 0.00 -1.16 0.00 0.00 32.46 32.24 1kly n ARG 118 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1kly s GLU 119 N -2.77 0.98 -0.11 5.56 2.02 -0.97 -4.53 118.70 118.88 1kly s GLU 119 Ca 0.02 -1.09 0.00 0.00 0.02 0.00 0.00 54.97 53.92 1kly s GLU 119 Cb 0.00 -1.07 -0.02 0.00 0.10 0.00 0.00 34.13 33.14 1kly s GLU 119 CO 0.01 0.24 -0.11 0.08 0.02 0.00 0.00 175.26 175.51 1kly s VAL 120 N -1.36 3.31 -0.17 2.63 1.01 -1.26 -1.48 120.40 123.07 1kly s VAL 120 Ca 0.03 -0.59 -0.05 0.00 0.00 0.00 0.00 61.98 61.37 1kly s VAL 120 Cb -0.09 -2.38 -0.03 0.00 0.00 0.00 0.00 36.38 33.88 1kly s VAL 120 CO 0.03 0.54 -0.01 -0.36 0.00 0.00 0.00 175.10 175.31 1kly s PHE 121 N -0.03 3.07 -0.28 5.22 0.40 0.12 -4.21 117.98 122.27 1kly s PHE 121 Ca -0.02 -0.26 -0.15 0.00 -0.60 0.00 0.00 56.93 55.90 1kly s PHE 121 Cb -0.14 -2.01 -0.03 0.00 0.51 0.00 0.00 43.02 41.35 1kly s PHE 121 CO 0.04 -0.04 0.40 -1.17 0.70 0.00 0.00 175.22 175.14 1kly s LEU 122 N 0.50 4.10 -0.27 -0.37 2.96 0.16 -0.87 118.68 124.89 1kly s LEU 122 Ca -0.02 0.23 -0.28 0.00 -0.22 0.00 0.00 54.13 53.85 1kly s LEU 122 Cb -0.14 -2.45 0.01 0.00 0.50 0.00 0.00 46.19 44.11 1kly s LEU 122 CO 0.02 -0.23 0.98 -0.22 -1.32 0.00 0.00 176.35 175.58 1kly s LEU 123 N 2.12 4.04 0.00 -0.68 2.96 0.26 -1.26 118.68 126.11 1kly s LEU 123 Ca 0.16 1.12 0.00 0.00 -0.22 0.00 0.00 54.13 55.18 1kly s LEU 123 Cb -0.16 -3.42 0.00 0.00 0.50 0.00 0.00 46.19 43.11 1kly s LEU 123 CO 0.10 -0.71 0.00 0.35 -1.32 0.00 0.00 176.35 174.78 1kly n THR 124 N 5.52 0.00 -4.29 3.68 -2.24 -0.78 -2.68 114.28 113.49 1kly n THR 124 Ca 0.10 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.53 1kly n THR 124 Cb 0.47 -0.44 -0.09 0.00 -2.10 0.00 0.00 70.33 68.17 1kly n THR 124 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1kly s GLU 125 N 0.00 3.08 0.51 -0.78 2.12 -1.26 -4.80 118.70 117.57 1kly s GLU 125 Ca 0.00 -0.36 -0.04 0.00 0.36 0.00 0.00 54.97 54.92 1kly s GLU 125 Cb 0.00 -2.86 -0.02 0.00 0.26 0.00 0.00 34.13 31.51 1kly s GLU 125 CO 0.00 0.70 0.80 -1.64 -0.54 0.00 0.00 175.26 174.59 1kly s MET 126 N -0.87 3.25 0.12 4.30 -1.94 -1.26 -3.47 119.30 119.44 1kly s MET 126 Ca 0.13 0.01 0.23 0.00 -1.71 0.00 0.00 55.69 54.36 1kly s MET 126 Cb -0.11 -2.37 0.19 0.00 2.01 0.00 0.00 34.83 34.54 1kly s MET 126 CO 0.03 -0.38 1.18 -1.13 -0.01 0.00 0.00 175.02 174.71 1kly n SER 127 N -2.34 0.72 -4.89 3.03 3.41 -1.26 -4.70 113.62 107.59 1kly n SER 127 Ca 0.02 0.10 -0.30 0.00 -0.26 0.00 0.00 58.87 58.43 1kly n SER 127 Cb 0.56 0.38 0.04 0.00 -0.26 0.00 0.00 64.21 64.93 1kly n SER 127 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 1kly s HIS 128 N -3.23 3.39 0.22 7.33 -3.43 -1.26 -4.71 115.29 113.60 1kly s HIS 128 Ca 0.04 1.04 -0.08 0.00 -0.80 0.00 0.00 55.06 55.26 1kly s HIS 128 Cb 0.13 -2.93 0.32 0.00 -1.43 0.00 0.00 32.58 28.67 1kly s HIS 128 CO 0.76 -1.00 1.74 -1.35 -2.00 0.00 0.00 174.74 172.89 1kly h PRO 129 N -0.50 0.42 0.00 -0.38 0.11 -1.98 -1.34 132.00 128.33 1kly h PRO 129 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1kly h PRO 129 Cb 1.24 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1kly h PRO 129 CO 0.63 0.28 0.07 0.78 -0.21 0.00 0.00 178.00 179.55 1kly h GLY 130 N 0.44 0.00 2.00 -0.55 0.00 -1.97 -1.77 103.07 101.21 1kly h GLY 130 Ca 0.33 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.66 1kly h GLY 130 CO -0.32 0.00 -0.00 0.00 0.00 0.00 0.00 176.54 176.21 1kly h ALA 131 N 1.86 1.09 0.00 3.60 0.00 -1.54 -1.61 119.26 122.66 1kly h ALA 131 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1kly h ALA 131 Cb 0.13 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1kly h ALA 131 CO 0.00 0.01 -0.07 0.93 0.00 0.00 0.00 179.25 180.12 1kly h GLU 132 N 0.00 0.00 -0.01 0.00 5.08 -1.50 -0.22 114.58 117.93 1kly h GLU 132 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1kly h GLU 132 Cb 0.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 1kly h GLU 132 CO 0.00 0.07 0.00 1.98 -1.00 0.00 0.00 179.01 180.06 1kly h MET 133 N 0.00 0.02 0.00 2.33 4.05 -1.50 -3.42 114.93 116.41 1kly h MET 133 Ca -0.00 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1kly h MET 133 Cb 0.64 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.43 1kly h MET 133 CO 0.01 0.26 -0.36 1.19 0.23 0.00 0.00 176.91 178.24 1kly n PHE 134 N -4.96 0.00 -0.11 1.39 3.01 -1.25 -4.89 117.46 110.65 1kly n PHE 134 Ca -0.08 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.27 1kly n PHE 134 Cb 0.14 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.58 1kly n PHE 134 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1kly h ILE 135 N 0.00 1.27 -0.68 4.37 2.04 -1.78 -3.15 117.51 119.57 1kly h ILE 135 Ca 0.00 -1.01 0.11 0.00 1.00 0.00 0.00 64.86 64.96 1kly h ILE 135 Cb 0.36 1.29 -0.08 0.00 -0.74 0.00 0.00 36.82 37.65 1kly h ILE 135 CO 0.00 0.33 0.28 -0.61 0.00 0.00 0.00 178.15 178.15 1kly h GLN 136 N 0.37 0.45 0.00 2.37 4.15 -1.28 0.10 115.11 121.27 1kly h GLN 136 Ca 0.09 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.48 1kly h GLN 136 Cb 0.49 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.07 1kly h GLN 136 CO 0.02 0.30 0.00 0.78 -1.93 0.00 0.00 178.83 178.00 1kly h GLY 137 N 0.46 0.00 -0.07 2.39 0.00 -1.81 -2.52 103.07 101.51 1kly h GLY 137 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 1kly h GLY 137 CO -0.33 0.00 -0.67 0.00 0.00 0.00 0.00 176.54 175.54 1kly n ALA 138 N -2.06 3.88 -0.31 3.60 0.00 -0.44 -4.72 120.51 120.46 1kly n ALA 138 Ca -0.01 -0.43 -0.01 0.00 0.00 0.00 0.00 53.44 52.98 1kly n ALA 138 Cb 0.17 -0.54 0.12 0.00 0.00 0.00 0.00 19.45 19.20 1kly n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1kly h ALA 139 N 2.18 1.13 -0.67 0.00 0.00 -0.57 0.70 119.26 122.02 1kly h ALA 139 Ca 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1kly h ALA 139 Cb 0.37 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1kly h ALA 139 CO 0.00 0.34 0.28 -0.44 0.00 0.00 0.00 179.25 179.43 1kly h ASP 140 N 1.02 0.92 -0.23 0.00 5.19 -1.85 -0.09 116.42 121.39 1kly h ASP 140 Ca 0.35 -0.16 -0.12 0.00 -0.62 0.00 0.00 57.03 56.48 1kly h ASP 140 Cb 0.06 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 39.32 1kly h ASP 140 CO -0.13 0.83 -0.26 -0.08 -3.12 0.00 0.00 179.24 176.48 1kly h GLU 141 N 0.95 0.71 -0.69 3.56 4.81 -1.74 -0.72 114.58 121.47 1kly h GLU 141 Ca 0.23 -0.29 -0.04 0.00 -0.13 0.00 0.00 59.36 59.13 1kly h GLU 141 Cb 0.19 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 1kly h GLU 141 CO -0.02 0.89 0.29 0.82 -0.73 0.00 0.00 179.01 180.26 1kly h ILE 142 N 0.61 1.24 -0.66 2.32 2.04 -0.46 0.10 117.51 122.70 1kly h ILE 142 Ca 0.08 -0.73 -0.05 0.00 1.00 0.00 0.00 64.86 65.16 1kly h ILE 142 Cb 0.75 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 1kly h ILE 142 CO 0.06 0.30 0.21 0.00 0.00 0.00 0.00 178.15 178.72 1kly h ALA 143 N 1.13 0.87 -0.68 1.87 0.00 -0.63 -0.89 119.26 120.93 1kly h ALA 143 Ca 0.23 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1kly h ALA 143 Cb 0.19 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1kly h ALA 143 CO -0.02 0.53 0.40 0.00 0.00 0.00 0.00 179.25 180.16 1kly h ARG 144 N 0.96 0.92 -0.59 0.00 3.08 -0.82 -1.35 114.38 116.57 1kly h ARG 144 Ca 0.21 -0.09 0.02 0.00 0.07 0.00 0.00 59.98 60.20 1kly h ARG 144 Cb 0.28 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 30.11 1kly h ARG 144 CO -0.01 0.66 0.37 1.98 -1.07 0.00 0.00 179.97 181.91 1kly h MET 145 N 0.92 0.72 -0.43 0.04 4.05 -0.60 -0.20 114.93 119.43 1kly h MET 145 Ca 0.24 -0.04 0.06 0.00 -0.28 0.00 0.00 59.70 59.68 1kly h MET 145 Cb -0.02 -0.16 -0.05 0.00 -0.80 0.00 0.00 31.60 30.57 1kly h MET 145 CO -0.04 0.47 0.13 0.78 0.23 0.00 0.00 176.91 178.48 1kly h GLY 146 N 0.74 0.54 0.98 1.39 0.00 -0.39 -0.40 103.07 105.93 1kly h GLY 146 Ca 0.23 -0.07 0.01 0.00 0.00 0.00 0.00 47.33 47.50 1kly h GLY 146 CO -0.09 0.01 0.35 -2.08 0.00 0.00 0.00 176.54 174.73 1kly h VAL 147 N 0.29 1.13 -0.46 4.60 2.07 -0.37 0.18 116.25 123.69 1kly h VAL 147 Ca 0.20 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 1kly h VAL 147 Cb 0.21 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 1kly h VAL 147 CO -0.22 0.13 0.27 0.44 0.02 0.00 0.00 177.57 178.21 1kly h ASP 148 N 0.72 0.54 0.29 0.57 3.32 -0.51 -1.97 116.42 119.37 1kly h ASP 148 Ca 0.20 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1kly h ASP 148 Cb -0.07 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.35 1kly h ASP 148 CO -0.05 0.42 -0.12 0.18 -1.72 0.00 0.00 179.24 177.95 1kly n LEU 149 N -4.44 0.63 0.00 1.55 4.77 -0.21 -4.92 117.00 114.38 1kly n LEU 149 Ca 0.04 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 1kly n LEU 149 Cb 0.08 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1kly n LEU 149 CO 0.36 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1kly n GLY 150 N 1.26 0.67 3.76 -0.72 0.00 -0.70 -5.03 105.19 104.43 1kly n GLY 150 Ca 0.15 -0.19 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 1kly n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kly s VAL 151 N -2.00 2.62 -0.32 1.61 1.01 -0.03 -4.93 120.40 118.35 1kly s VAL 151 Ca 0.00 0.56 0.03 0.00 0.00 0.00 0.00 61.98 62.57 1kly s VAL 151 Cb 0.00 -3.36 0.01 0.00 0.00 0.00 0.00 36.38 33.03 1kly s VAL 151 CO 0.00 0.11 0.44 0.29 0.00 0.00 0.00 175.10 175.94 1kly n LYS 152 N 1.61 1.74 -4.51 2.72 4.76 -1.26 -4.59 118.16 118.62 1kly n LYS 152 Ca 0.04 -0.46 -0.24 0.00 -2.87 0.00 0.00 58.31 54.78 1kly n LYS 152 Cb 0.41 -0.92 -0.17 0.00 -1.84 0.00 0.00 35.03 32.51 1kly n LYS 152 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1kly s ASN 153 N -0.63 1.68 0.11 4.39 0.01 -1.26 -0.74 114.94 118.51 1kly s ASN 153 Ca 0.03 -0.28 0.03 0.00 -0.71 0.00 0.00 52.86 51.93 1kly s ASN 153 Cb 0.03 -0.78 -0.04 0.00 0.41 0.00 0.00 41.25 40.86 1kly s ASN 153 CO 0.07 0.02 -0.08 -0.31 -1.51 0.00 0.00 177.10 175.29 1kly s TYR 154 N 0.72 1.00 -0.06 2.20 1.51 0.41 -0.66 117.35 122.47 1kly s TYR 154 Ca -0.14 -0.85 0.04 0.00 -1.01 0.00 0.00 57.07 55.11 1kly s TYR 154 Cb -0.16 -0.55 0.00 0.00 -0.11 0.00 0.00 41.96 41.15 1kly s TYR 154 CO 0.03 -0.08 -0.17 0.08 -1.11 0.00 0.00 175.55 174.31 1kly s VAL 155 N -3.43 1.44 0.11 0.71 1.01 -0.39 -0.93 120.40 118.91 1kly s VAL 155 Ca 0.12 -0.69 -0.03 0.00 0.00 0.00 0.00 61.98 61.38 1kly s VAL 155 Cb 0.04 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 1kly s VAL 155 CO -0.03 0.42 0.08 -0.83 0.00 0.00 0.00 175.10 174.74 1kly s GLY 156 N 0.31 0.66 -0.16 4.51 0.00 -0.75 -1.87 107.32 110.02 1kly s GLY 156 Ca -0.10 -1.21 -0.29 0.00 0.00 0.00 0.00 44.72 43.12 1kly s GLY 156 CO 0.04 -1.20 1.02 2.56 0.00 0.00 0.00 173.10 175.51 1kly s PRO 157 N -3.98 4.35 0.34 2.90 0.04 -1.23 -3.71 135.00 133.73 1kly s PRO 157 Ca 0.16 1.37 0.06 0.00 0.04 0.00 0.00 61.00 62.63 1kly s PRO 157 Cb 0.07 -3.58 0.62 0.00 0.04 0.00 0.00 34.50 31.64 1kly s PRO 157 CO -0.03 -0.44 1.84 1.03 0.04 0.00 0.00 177.00 179.43 1kly h SER 158 N 7.25 0.35 0.48 6.66 0.87 -1.49 -2.67 113.55 125.00 1kly h SER 158 Ca -0.26 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.21 1kly h SER 158 Cb 1.11 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.98 1kly h SER 158 CO 0.91 0.53 0.00 0.35 -0.53 0.00 0.00 176.83 178.09 1kly n THR 159 N -4.22 1.06 -3.45 2.23 -2.24 -1.26 -3.96 114.28 102.45 1kly n THR 159 Ca -0.00 0.31 -0.27 0.00 -2.27 0.00 0.00 64.05 61.82 1kly n THR 159 Cb 0.31 -1.16 -0.10 0.00 -2.10 0.00 0.00 70.33 67.28 1kly n THR 159 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1kly n ARG 160 N -1.80 0.51 0.22 -0.78 1.74 -1.01 -4.95 116.66 110.59 1kly n ARG 160 Ca 0.02 -3.40 0.14 0.00 -0.77 0.00 0.00 57.85 53.85 1kly n ARG 160 Cb 0.16 -1.73 0.77 0.00 -1.02 0.00 0.00 32.46 30.64 1kly n ARG 160 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 1kly h PRO 161 N 5.43 0.00 -0.11 5.56 0.11 -1.73 0.39 132.00 141.64 1kly h PRO 161 Ca 0.23 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.23 1kly h PRO 161 Cb 0.88 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.98 1kly h PRO 161 CO 0.44 0.00 -0.46 1.05 -0.21 0.00 0.00 178.00 178.82 1kly h GLU 162 N 0.00 0.27 -0.07 1.05 9.09 -1.94 0.86 114.58 123.84 1kly h GLU 162 Ca 0.06 -0.14 -0.24 0.00 0.05 0.00 0.00 59.36 59.09 1kly h GLU 162 Cb 0.30 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.42 1kly h GLU 162 CO -0.00 0.67 -0.91 0.00 0.05 0.00 0.00 179.01 178.82 1kly h ARG 163 N 0.22 0.71 -0.82 1.06 2.47 -1.35 -2.32 114.38 114.36 1kly h ARG 163 Ca 0.01 -0.67 0.00 0.00 -1.26 0.00 0.00 59.98 58.06 1kly h ARG 163 Cb 0.89 0.17 -0.04 0.00 -1.65 0.00 0.00 29.97 29.34 1kly h ARG 163 CO 0.07 1.27 0.52 1.25 0.56 0.00 0.00 179.97 183.64 1kly h LEU 164 N 0.44 0.95 -0.34 3.04 5.85 -0.90 0.11 115.31 124.46 1kly h LEU 164 Ca -0.09 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.56 1kly h LEU 164 Cb 1.55 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 42.33 1kly h LEU 164 CO 0.18 0.71 0.07 -1.28 -0.34 0.00 0.00 178.44 177.78 1kly h SER 165 N 1.11 0.53 -0.73 1.25 0.87 -0.73 -0.05 113.55 115.82 1kly h SER 165 Ca 0.30 -0.25 -0.06 0.00 -1.23 0.00 0.00 61.79 60.55 1kly h SER 165 Cb -0.09 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 61.69 1kly h SER 165 CO -0.06 0.65 0.24 -0.09 -0.53 0.00 0.00 176.83 177.03 1kly h ARG 166 N 0.40 1.13 -0.55 2.24 9.65 -0.92 -0.87 114.38 125.46 1kly h ARG 166 Ca 0.11 -0.23 -0.08 0.00 -1.10 0.00 0.00 59.98 58.67 1kly h ARG 166 Cb 0.33 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.73 1kly h ARG 166 CO 0.00 0.96 0.03 -0.07 2.80 0.00 0.00 179.97 183.69 1kly h LEU 167 N 1.09 0.93 -1.15 3.80 3.38 -0.56 -2.01 115.31 120.79 1kly h LEU 167 Ca 0.24 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1kly h LEU 167 Cb 0.29 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 1kly h LEU 167 CO -0.01 1.00 0.43 -0.09 0.09 0.00 0.00 178.44 179.86 1kly h ARG 168 N 0.84 1.01 -0.73 1.13 9.65 -0.71 -1.44 114.38 124.13 1kly h ARG 168 Ca 0.16 -0.10 0.00 0.00 -1.10 0.00 0.00 59.98 58.94 1kly h ARG 168 Cb 0.50 -0.21 -0.04 0.00 -1.39 0.00 0.00 29.97 28.84 1kly h ARG 168 CO 0.02 0.72 0.46 1.49 2.80 0.00 0.00 179.97 185.46 1kly h GLU 169 N 1.03 0.98 -0.17 0.20 4.81 -0.53 -0.73 114.58 120.17 1kly h GLU 169 Ca 0.27 -0.08 -0.09 0.00 -0.13 0.00 0.00 59.36 59.33 1kly h GLU 169 Cb -0.02 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.15 1kly h GLU 169 CO -0.05 0.67 -0.24 0.82 -0.73 0.00 0.00 179.01 179.49 1kly h ILE 170 N 0.99 1.35 0.00 2.32 2.04 -0.80 -3.28 117.51 120.13 1kly h ILE 170 Ca 0.26 -1.46 0.00 0.00 1.00 0.00 0.00 64.86 64.67 1kly h ILE 170 Cb -0.07 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.91 1kly h ILE 170 CO -0.05 0.44 -0.05 0.16 0.00 0.00 0.00 178.15 178.65 1kly h ILE 171 N 0.10 0.00 0.00 -0.67 3.07 -1.17 -3.48 117.51 115.35 1kly h ILE 171 Ca 0.02 -0.52 0.00 0.00 1.55 0.00 0.00 64.86 65.91 1kly h ILE 171 Cb 0.81 1.49 0.00 0.00 -0.27 0.00 0.00 36.82 38.85 1kly h ILE 171 CO 0.06 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.77 1kly n GLY 172 N 1.29 -0.86 0.22 0.16 0.00 -0.29 -4.26 105.19 101.45 1kly n GLY 172 Ca 0.05 -1.64 0.11 0.00 0.00 0.00 0.00 46.02 44.54 1kly n GLY 172 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1kly h GLN 173 N 0.00 0.00 0.00 1.61 1.08 -1.93 -3.21 115.11 112.66 1kly h GLN 173 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1kly h GLN 173 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1kly h GLN 173 CO 0.00 0.16 -0.07 -0.44 -0.95 0.00 0.00 178.83 177.52 1kly h ASP 174 N 0.00 0.00 -4.16 1.46 3.32 -1.97 -3.45 116.42 111.62 1kly h ASP 174 Ca -0.00 -0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.56 1kly h ASP 174 Cb 0.87 0.00 0.06 0.00 0.22 0.00 0.00 39.33 40.48 1kly h ASP 174 CO 0.02 0.00 0.38 -0.44 -1.72 0.00 0.00 179.24 177.49 1kly s SER 175 N -6.02 5.82 -0.21 6.45 0.01 -1.22 -5.02 113.70 113.51 1kly s SER 175 Ca 0.07 1.89 -0.12 0.00 1.31 0.00 0.00 55.95 59.10 1kly s SER 175 Cb 0.06 -2.55 -0.05 0.00 0.21 0.00 0.00 66.02 63.70 1kly s SER 175 CO 0.67 -1.14 0.22 0.12 0.41 0.00 0.00 173.24 173.52 1kly s PHE 176 N -2.28 3.37 -0.12 2.43 5.36 0.08 -4.99 117.98 121.84 1kly s PHE 176 Ca 0.66 0.39 0.01 0.00 -0.96 0.00 0.00 56.93 57.02 1kly s PHE 176 Cb -0.17 -2.31 0.02 0.00 -0.34 0.00 0.00 43.02 40.22 1kly s PHE 176 CO 0.33 0.13 -0.13 -1.17 -1.46 0.00 0.00 175.22 172.92 1kly s LEU 177 N 0.84 1.62 0.19 6.12 2.96 -1.26 -0.45 118.68 128.70 1kly s LEU 177 Ca 0.11 -0.42 0.09 0.00 -0.22 0.00 0.00 54.13 53.69 1kly s LEU 177 Cb -0.13 -1.06 -0.04 0.00 0.50 0.00 0.00 46.19 45.46 1kly s LEU 177 CO 0.04 -0.03 -0.07 0.27 -1.32 0.00 0.00 176.35 175.23 1kly s ILE 178 N 1.24 3.28 -0.09 6.68 -4.36 -0.11 0.02 121.20 127.87 1kly s ILE 178 Ca -0.02 -1.65 -0.03 0.00 -0.26 0.00 0.00 60.65 58.69 1kly s ILE 178 Cb -0.14 -2.64 0.05 0.00 1.25 0.00 0.00 42.46 40.98 1kly s ILE 178 CO -0.05 -0.13 0.13 -0.55 0.24 0.00 0.00 174.94 174.58 1kly s SER 179 N -2.91 0.99 0.50 4.36 0.15 -0.54 -1.81 113.70 114.44 1kly s SER 179 Ca 0.26 0.17 0.05 0.00 0.70 0.00 0.00 55.95 57.13 1kly s SER 179 Cb -0.09 0.14 0.03 0.00 -1.71 0.00 0.00 66.02 64.40 1kly s SER 179 CO 0.16 -0.26 0.70 -2.16 1.20 0.00 0.00 173.24 172.88 1kly s PRO 180 N 2.25 2.59 0.00 5.44 0.04 -1.24 -0.87 135.00 143.22 1kly s PRO 180 Ca 0.04 -1.10 0.00 0.00 0.04 0.00 0.00 61.00 59.97 1kly s PRO 180 Cb -0.12 -2.62 0.00 0.00 0.04 0.00 0.00 34.50 31.80 1kly s PRO 180 CO -0.06 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 176.82 1kly n GLY 181 N -2.14 1.06 3.72 0.56 0.00 -1.26 -1.33 105.19 105.80 1kly n GLY 181 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 1kly n GLY 181 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kly s VAL 182 N -2.00 5.03 0.00 1.61 1.01 -1.26 -0.36 120.40 124.44 1kly s VAL 182 Ca 0.00 1.37 0.00 0.00 0.00 0.00 0.00 61.98 63.35 1kly s VAL 182 Cb 0.00 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.38 1kly s VAL 182 CO 0.00 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.00 1kly n GLY 183 N 3.01 1.38 0.29 4.51 0.00 -0.39 -4.47 105.19 109.52 1kly n GLY 183 Ca -0.03 -0.52 0.05 0.00 0.00 0.00 0.00 46.02 45.53 1kly n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kly h ALA 184 N 0.00 1.14 0.00 4.61 0.00 -1.89 -0.68 119.26 122.43 1kly h ALA 184 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1kly h ALA 184 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1kly h ALA 184 CO 0.00 -0.13 0.00 1.04 0.00 0.00 0.00 179.25 180.16 1kly n GLN 185 N -4.92 0.19 0.00 0.00 6.02 -1.26 -4.91 117.38 112.50 1kly n GLN 185 Ca 0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.14 1kly n GLN 185 Cb 0.40 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.16 1kly n GLN 185 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1kly n GLY 186 N 1.40 1.52 3.77 1.08 0.00 -0.26 -4.95 105.19 107.75 1kly n GLY 186 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 1kly n GLY 186 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1kly s GLY 187 N -2.12 2.63 -0.18 -0.02 0.00 0.52 -4.74 107.32 103.42 1kly s GLY 187 Ca 0.00 0.86 -0.07 0.00 0.00 0.00 0.00 44.72 45.50 1kly s GLY 187 CO 0.00 1.22 0.07 -0.35 0.00 0.00 0.00 173.10 174.04 1kly s ASP 188 N -1.77 5.67 0.12 1.64 2.15 -1.26 -1.26 116.67 121.95 1kly s ASP 188 Ca 0.74 0.10 -0.27 0.00 0.43 0.00 0.00 52.55 53.55 1kly s ASP 188 Cb -0.25 -1.96 -0.06 0.00 -0.30 0.00 0.00 42.92 40.34 1kly s ASP 188 CO 0.29 0.19 1.62 -0.65 -0.17 0.00 0.00 175.17 176.45 1kly h PRO 189 N 6.59 -0.46 -0.30 4.34 0.11 -1.96 -1.71 132.00 138.61 1kly h PRO 189 Ca -0.38 0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.75 1kly h PRO 189 Cb 1.17 0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 1kly h PRO 189 CO 0.70 -0.30 0.14 0.78 -0.21 0.00 0.00 178.00 179.11 1kly h GLY 190 N -0.47 0.46 1.11 -0.55 0.00 -1.94 -1.58 103.07 100.09 1kly h GLY 190 Ca 0.05 -0.23 -0.03 0.00 0.00 0.00 0.00 47.33 47.12 1kly h GLY 190 CO -0.23 0.22 0.37 0.83 0.00 0.00 0.00 176.54 177.73 1kly h GLU 191 N 0.35 1.15 -0.70 4.80 4.39 -1.98 -2.79 114.58 119.80 1kly h GLU 191 Ca 0.10 -0.17 -0.06 0.00 0.34 0.00 0.00 59.36 59.57 1kly h GLU 191 Cb 0.12 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 28.54 1kly h GLU 191 CO -0.01 0.89 0.20 1.15 -1.16 0.00 0.00 179.01 180.08 1kly h THR 192 N 1.14 1.26 0.00 1.13 2.02 -1.05 -2.45 112.91 114.96 1kly h THR 192 Ca 0.27 -0.91 0.00 0.00 0.77 0.00 0.00 66.41 66.54 1kly h THR 192 Cb 0.13 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1kly h THR 192 CO -0.03 0.35 0.00 0.18 0.37 0.00 0.00 175.52 176.39 1kly n LEU 193 N -4.29 0.00 0.21 2.58 4.77 -0.62 -0.89 117.00 118.76 1kly n LEU 193 Ca 0.05 0.17 0.08 0.00 -0.03 0.00 0.00 56.01 56.28 1kly n LEU 193 Cb 0.23 -0.17 0.43 0.00 -2.33 0.00 0.00 43.42 41.59 1kly n LEU 193 CO 0.41 -0.07 0.77 0.03 -1.33 0.00 0.00 177.39 177.20 1kly h ARG 194 N 0.00 0.00 0.00 3.23 3.08 -1.29 -3.37 114.38 116.03 1kly h ARG 194 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1kly h ARG 194 Cb 0.10 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 1kly h ARG 194 CO 0.00 0.28 -1.03 1.19 -1.07 0.00 0.00 179.97 179.34 1kly n PHE 195 N -3.48 0.00 -3.29 3.04 3.01 -0.62 -5.06 117.46 111.06 1kly n PHE 195 Ca -0.00 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.16 1kly n PHE 195 Cb 0.44 -0.02 -0.04 0.00 -0.01 0.00 0.00 39.48 39.85 1kly n PHE 195 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1kly s ALA 196 N -2.01 3.56 0.15 4.37 0.00 -0.07 -4.92 121.76 122.84 1kly s ALA 196 Ca -0.01 -0.39 0.07 0.00 0.00 0.00 0.00 51.96 51.64 1kly s ALA 196 Cb 0.00 -2.42 -0.09 0.00 0.00 0.00 0.00 23.12 20.61 1kly s ALA 196 CO 0.01 0.30 1.35 -0.44 0.00 0.00 0.00 175.76 176.99 1kly h ASP 197 N 1.94 0.02 -5.04 0.00 3.32 -0.73 -3.40 116.42 112.53 1kly h ASP 197 Ca -0.47 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 56.45 1kly h ASP 197 Cb 1.18 -0.01 -0.18 0.00 0.22 0.00 0.00 39.33 40.55 1kly h ASP 197 CO 0.67 0.93 -0.29 0.00 -1.72 0.00 0.00 179.24 178.83 1kly s ALA 198 N -2.91 -0.64 0.02 3.45 0.00 -1.13 -4.76 121.76 115.80 1kly s ALA 198 Ca 0.00 0.03 0.03 0.00 0.00 0.00 0.00 51.96 52.02 1kly s ALA 198 Cb 0.10 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.43 1kly s ALA 198 CO 0.81 -0.36 -0.02 0.96 0.00 0.00 0.00 175.76 177.15 1kly s ILE 199 N -2.21 3.96 -0.20 0.00 -4.36 -0.29 -1.47 121.20 116.62 1kly s ILE 199 Ca -0.07 -0.73 -0.09 0.00 -0.26 0.00 0.00 60.65 59.49 1kly s ILE 199 Cb -0.02 -2.77 -0.04 0.00 1.25 0.00 0.00 42.46 40.87 1kly s ILE 199 CO -0.01 0.33 0.10 -0.63 0.24 0.00 0.00 174.94 174.97 1kly s ILE 200 N -1.10 5.02 -0.06 8.37 1.01 -0.04 -0.51 121.20 133.89 1kly s ILE 200 Ca 0.20 0.05 0.01 0.00 0.00 0.00 0.00 60.65 60.91 1kly s ILE 200 Cb -0.11 -3.29 0.02 0.00 0.01 0.00 0.00 42.46 39.08 1kly s ILE 200 CO 0.11 0.42 -0.05 -0.69 0.00 0.00 0.00 174.94 174.73 1kly s VAL 201 N 0.60 0.65 0.00 2.92 1.01 -0.16 -4.07 120.40 121.35 1kly s VAL 201 Ca 0.05 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 61.89 1kly s VAL 201 Cb -0.12 -0.69 0.00 0.00 0.00 0.00 0.00 36.38 35.57 1kly s VAL 201 CO 0.01 0.27 0.00 0.61 0.00 0.00 0.00 175.10 175.99 1kly n GLY 202 N 4.36 0.29 0.37 4.51 0.00 -1.26 -0.75 105.19 112.71 1kly n GLY 202 Ca -0.19 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.96 1kly n GLY 202 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1kly h ARG 203 N 0.00 0.67 -0.09 1.61 3.08 -1.92 -0.01 114.38 117.72 1kly h ARG 203 Ca 0.00 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.04 1kly h ARG 203 Cb 0.00 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 29.89 1kly h ARG 203 CO 0.00 0.44 0.10 0.77 -1.07 0.00 0.00 179.97 180.21 1kly h SER 204 N 0.69 0.00 0.00 7.04 0.02 -1.90 -0.99 113.55 118.40 1kly h SER 204 Ca 0.49 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 61.14 1kly h SER 204 Cb 0.83 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.32 1kly h SER 204 CO -0.25 0.00 -1.94 -0.38 -1.14 0.00 0.00 176.83 173.12 1kly n ILE 205 N -3.96 1.52 0.59 3.27 5.41 -0.23 -4.29 119.36 121.66 1kly n ILE 205 Ca -0.01 -0.19 0.12 0.00 1.00 0.00 0.00 62.75 63.67 1kly n ILE 205 Cb 0.20 -2.04 0.46 0.00 -0.71 0.00 0.00 39.64 37.55 1kly n ILE 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1kly n TYR 206 N -4.34 0.66 0.93 1.39 0.18 -0.19 -2.23 117.16 113.56 1kly n TYR 206 Ca -0.40 0.22 0.11 0.00 1.88 0.00 0.00 57.90 59.71 1kly n TYR 206 Cb 0.75 -0.86 0.04 0.00 -0.38 0.00 0.00 39.34 38.89 1kly n TYR 206 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1kly n LEU 207 N -2.06 2.37 -4.76 -3.48 4.77 -0.39 -4.99 117.00 108.46 1kly n LEU 207 Ca 0.04 -0.87 -0.34 0.00 -0.03 0.00 0.00 56.01 54.81 1kly n LEU 207 Cb 0.32 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.45 1kly n LEU 207 CO 0.24 0.42 0.77 0.00 -1.33 0.00 0.00 177.39 177.49 1kly s ALA 208 N -2.11 2.51 0.37 -1.18 0.00 -0.95 -4.92 121.76 115.48 1kly s ALA 208 Ca 0.21 0.71 0.08 0.00 0.00 0.00 0.00 51.96 52.97 1kly s ALA 208 Cb 0.18 -3.36 0.72 0.00 0.00 0.00 0.00 23.12 20.66 1kly s ALA 208 CO 0.41 -1.17 1.89 -0.44 0.00 0.00 0.00 175.76 176.45 1kly h ASP 209 N 0.44 0.26 -3.19 0.00 3.45 -1.94 -3.34 116.42 112.10 1kly h ASP 209 Ca -0.48 -0.06 -0.60 0.00 0.43 0.00 0.00 57.03 56.32 1kly h ASP 209 Cb 1.26 -0.07 -0.40 0.00 -0.56 0.00 0.00 39.33 39.56 1kly h ASP 209 CO 0.55 0.44 -0.77 0.21 -1.57 0.00 0.00 179.24 178.09 1kly s ASN 210 N -6.86 3.40 0.26 6.45 3.84 -1.26 -5.01 114.94 115.76 1kly s ASN 210 Ca -0.06 -2.55 -0.01 0.00 0.21 0.00 0.00 52.86 50.45 1kly s ASN 210 Cb 0.15 -0.85 0.51 0.00 -0.55 0.00 0.00 41.25 40.51 1kly s ASN 210 CO 0.74 -0.27 1.78 -0.65 -2.79 0.00 0.00 177.10 175.91 1kly h PRO 211 N 6.73 0.68 -0.72 0.43 0.11 -1.73 -0.14 132.00 137.36 1kly h PRO 211 Ca 0.02 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.06 1kly h PRO 211 Cb 0.93 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 31.86 1kly h PRO 211 CO 0.42 0.45 0.30 0.00 -0.21 0.00 0.00 178.00 178.96 1kly h ALA 212 N 1.53 0.94 -0.36 -0.75 0.00 -1.89 0.10 119.26 118.83 1kly h ALA 212 Ca 0.45 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 55.08 1kly h ALA 212 Cb 0.58 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1kly h ALA 212 CO -0.32 0.55 -0.22 0.00 0.00 0.00 0.00 179.25 179.26 1kly h ALA 213 N 1.14 0.94 -0.41 0.00 0.00 -1.70 0.12 119.26 119.36 1kly h ALA 213 Ca 0.24 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1kly h ALA 213 Cb 0.19 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1kly h ALA 213 CO -0.02 0.61 0.07 0.00 0.00 0.00 0.00 179.25 179.91 1kly h ALA 214 N 1.14 0.54 -0.60 0.00 0.00 -0.58 0.20 119.26 119.96 1kly h ALA 214 Ca 0.09 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1kly h ALA 214 Cb 0.70 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1kly h ALA 214 CO 0.05 0.25 0.06 0.00 0.00 0.00 0.00 179.25 179.61 1kly h ALA 215 N 0.93 0.80 -0.84 0.00 0.00 -0.76 -1.99 119.26 117.40 1kly h ALA 215 Ca 0.12 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1kly h ALA 215 Cb 0.36 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1kly h ALA 215 CO 0.01 0.58 0.40 0.00 0.00 0.00 0.00 179.25 180.24 1kly h ALA 216 N 1.00 1.08 -0.49 0.00 0.00 -0.79 -1.44 119.26 118.63 1kly h ALA 216 Ca 0.18 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1kly h ALA 216 Cb 0.47 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1kly h ALA 216 CO 0.02 0.65 0.17 0.78 0.00 0.00 0.00 179.25 180.87 1kly h GLY 217 N 1.20 0.81 0.98 0.00 0.00 -0.66 -0.08 103.07 105.32 1kly h GLY 217 Ca 0.29 -0.47 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 1kly h GLY 217 CO -0.04 0.44 0.20 -2.22 0.00 0.00 0.00 176.54 174.92 1kly h ILE 218 N 0.66 1.11 -0.88 2.60 2.04 -1.04 -0.82 117.51 121.17 1kly h ILE 218 Ca 0.16 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.76 1kly h ILE 218 Cb 0.25 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 36.97 1kly h ILE 218 CO -0.01 0.11 0.48 0.40 0.00 0.00 0.00 178.15 179.13 1kly h ILE 219 N 0.42 1.26 -0.18 -0.67 2.04 -1.02 -2.17 117.51 117.19 1kly h ILE 219 Ca 0.12 -0.64 -0.10 0.00 1.00 0.00 0.00 64.86 65.24 1kly h ILE 219 Cb -0.00 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.13 1kly h ILE 219 CO -0.02 0.29 -0.34 -0.08 0.00 0.00 0.00 178.15 178.00 1kly h GLU 220 N 1.23 0.37 0.00 2.37 4.22 -0.73 -2.40 114.58 119.64 1kly h GLU 220 Ca 0.31 -0.16 0.00 0.00 0.08 0.00 0.00 59.36 59.59 1kly h GLU 220 Cb 0.03 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1kly h GLU 220 CO -0.05 0.67 0.00 0.66 -2.18 0.00 0.00 179.01 178.11 1kly h SER 221 N 0.32 0.00 -0.01 1.04 4.64 -0.50 -3.51 113.55 115.53 1kly h SER 221 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1kly h SER 221 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 1kly h SER 221 CO 0.06 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.32