#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ccg s ALA 3 N 0.00 -0.48 -0.55 7.33 0.00 -1.03 -4.99 121.76 122.04 2ccg s ALA 3 Ca 0.00 0.89 -0.17 0.00 0.00 0.00 0.00 51.96 52.68 2ccg s ALA 3 Cb 0.00 -0.75 0.11 0.00 0.00 0.00 0.00 23.12 22.48 2ccg s ALA 3 CO 0.00 -0.37 0.56 0.12 0.00 0.00 0.00 175.76 176.07 2ccg s PHE 4 N 1.72 3.15 -0.22 0.00 5.36 -1.26 -0.31 117.98 126.42 2ccg s PHE 4 Ca -0.05 -1.09 -0.04 0.00 -0.96 0.00 0.00 56.93 54.79 2ccg s PHE 4 Cb -0.11 -3.78 -0.01 0.00 -0.34 0.00 0.00 43.02 38.78 2ccg s PHE 4 CO -0.08 -1.08 -0.03 0.42 -1.46 0.00 0.00 175.22 172.98 2ccg s ILE 5 N 2.03 3.48 0.21 3.12 1.01 0.33 0.45 121.20 131.84 2ccg s ILE 5 Ca 0.07 -0.46 0.07 0.00 0.00 0.00 0.00 60.65 60.33 2ccg s ILE 5 Cb -0.27 -2.58 -0.04 0.00 0.01 0.00 0.00 42.46 39.58 2ccg s ILE 5 CO 0.05 0.42 0.13 0.42 0.00 0.00 0.00 174.94 175.96 2ccg s THR 6 N 1.39 4.24 -0.09 2.92 -4.23 -0.15 -0.37 115.64 119.35 2ccg s THR 6 Ca 0.05 -1.36 0.04 0.00 -1.18 0.00 0.00 61.69 59.23 2ccg s THR 6 Cb -0.14 -3.23 0.00 0.00 1.34 0.00 0.00 72.50 70.47 2ccg s THR 6 CO -0.02 -0.24 -0.21 -0.36 -0.54 0.00 0.00 174.62 173.25 2ccg s PHE 7 N -1.98 2.24 0.17 3.99 0.40 -0.23 -0.18 117.98 122.39 2ccg s PHE 7 Ca 0.31 -0.90 0.05 0.00 -0.60 0.00 0.00 56.93 55.80 2ccg s PHE 7 Cb -0.09 -1.52 -0.05 0.00 0.51 0.00 0.00 43.02 41.88 2ccg s PHE 7 CO 0.23 -0.37 -0.11 -1.21 0.70 0.00 0.00 175.22 174.46 2ccg s GLU 8 N 0.42 1.15 0.00 0.44 0.41 -0.12 -0.73 118.70 120.26 2ccg s GLU 8 Ca -0.17 -1.50 0.00 0.00 -0.41 0.00 0.00 54.97 52.89 2ccg s GLU 8 Cb -0.17 -0.76 0.00 0.00 -1.78 0.00 0.00 34.13 31.42 2ccg s GLU 8 CO 0.07 0.10 0.00 0.41 -0.49 0.00 0.00 175.26 175.35 2ccg n GLY 9 N -0.26 2.82 0.00 -1.39 0.00 -1.26 -1.30 105.19 103.81 2ccg n GLY 9 Ca -0.09 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.28 2ccg n GLY 9 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ccg n PRO 10 N -0.78 -0.35 -2.59 1.61 -0.04 -1.26 -4.96 135.00 126.63 2ccg n PRO 10 Ca 0.00 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.11 2ccg n PRO 10 Cb 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.42 2ccg n PRO 10 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2ccg s GLU 11 N -2.55 4.03 -0.93 0.54 0.41 -1.26 -3.54 118.70 115.40 2ccg s GLU 11 Ca 0.00 1.39 0.00 0.00 -0.41 0.00 0.00 54.97 55.95 2ccg s GLU 11 Cb 0.00 -2.31 0.00 0.00 -1.78 0.00 0.00 34.13 30.04 2ccg s GLU 11 CO 0.00 -0.24 0.00 0.41 -0.49 0.00 0.00 175.26 174.94 2ccg n GLY 12 N -0.03 0.93 0.21 -1.39 0.00 -1.26 -4.65 105.19 99.01 2ccg n GLY 12 Ca 0.07 -0.61 0.12 0.00 0.00 0.00 0.00 46.02 45.60 2ccg n GLY 12 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ccg n SER 13 N 0.51 1.04 -0.39 1.61 3.41 -1.23 -4.24 113.62 114.32 2ccg n SER 13 Ca -0.09 -0.84 -0.05 0.00 -0.26 0.00 0.00 58.87 57.63 2ccg n SER 13 Cb 0.33 0.25 -0.02 0.00 -0.26 0.00 0.00 64.21 64.51 2ccg n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ccg n GLY 14 N 1.39 0.75 0.28 5.00 0.00 -1.26 -4.91 105.19 106.45 2ccg n GLY 14 Ca 0.10 -0.45 -0.06 0.00 0.00 0.00 0.00 46.02 45.61 2ccg n GLY 14 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2ccg h LYS 15 N 0.22 -0.17 -0.50 1.61 3.64 -1.91 -1.19 116.57 118.27 2ccg h LYS 15 Ca -0.10 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.32 2ccg h LYS 15 Cb 0.46 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.28 2ccg h LYS 15 CO 0.15 -0.11 0.27 1.15 -2.27 0.00 0.00 179.45 178.65 2ccg h THR 16 N -0.17 1.00 -0.28 1.00 2.02 -1.99 -0.44 112.91 114.05 2ccg h THR 16 Ca 0.19 -0.18 -0.12 0.00 0.77 0.00 0.00 66.41 67.07 2ccg h THR 16 Cb 0.48 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 2ccg h THR 16 CO -0.51 0.10 -0.33 0.71 0.37 0.00 0.00 175.52 175.85 2ccg h THR 17 N 0.54 1.29 0.72 3.16 1.35 -1.91 -2.43 112.91 115.62 2ccg h THR 17 Ca 0.21 -1.45 -0.04 0.00 -0.55 0.00 0.00 66.41 64.58 2ccg h THR 17 Cb 0.08 1.43 0.01 0.00 -1.73 0.00 0.00 68.15 67.94 2ccg h THR 17 CO -0.12 0.46 -0.35 0.58 -0.25 0.00 0.00 175.52 175.84 2ccg h VAL 18 N 0.50 0.26 -0.87 6.82 2.07 -0.64 -1.78 116.25 122.62 2ccg h VAL 18 Ca 0.06 -0.08 0.13 0.00 0.82 0.00 0.00 66.70 67.62 2ccg h VAL 18 Cb 0.82 0.28 -0.07 0.00 -1.52 0.00 0.00 31.29 30.81 2ccg h VAL 18 CO 0.07 0.01 0.56 -0.29 0.02 0.00 0.00 177.57 177.94 2ccg h ILE 19 N -1.03 0.88 -0.23 4.57 2.10 -1.12 0.33 117.51 123.02 2ccg h ILE 19 Ca -0.10 -0.25 -0.02 0.00 1.08 0.00 0.00 64.86 65.58 2ccg h ILE 19 Cb 0.76 0.09 -0.01 0.00 -1.09 0.00 0.00 36.82 36.57 2ccg h ILE 19 CO 0.16 0.13 0.08 -1.13 -1.08 0.00 0.00 178.15 176.32 2ccg h ASN 20 N 0.72 0.32 -0.22 2.19 -1.24 -1.18 -0.55 115.58 115.64 2ccg h ASN 20 Ca 0.42 -0.18 -0.18 0.00 0.71 0.00 0.00 56.30 57.07 2ccg h ASN 20 Cb 0.61 -0.08 -0.00 0.00 0.73 0.00 0.00 38.32 39.58 2ccg h ASN 20 CO -0.18 0.42 -0.55 -0.33 -1.29 0.00 0.00 177.43 175.49 2ccg h GLU 21 N 0.21 0.81 -0.13 6.67 5.08 -0.55 -2.37 114.58 124.29 2ccg h GLU 21 Ca 0.07 -0.51 0.01 0.00 -1.00 0.00 0.00 59.36 57.93 2ccg h GLU 21 Cb 0.20 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 2ccg h GLU 21 CO -0.00 1.14 0.06 0.28 -1.00 0.00 0.00 179.01 179.49 2ccg h VAL 22 N 0.62 0.99 -0.71 3.13 2.07 -0.90 -2.24 116.25 119.22 2ccg h VAL 22 Ca 0.01 -0.05 0.08 0.00 0.82 0.00 0.00 66.70 67.57 2ccg h VAL 22 Cb 1.14 0.85 -0.07 0.00 -1.52 0.00 0.00 31.29 31.69 2ccg h VAL 22 CO 0.12 0.02 0.37 0.22 0.02 0.00 0.00 177.57 178.32 2ccg h TYR 23 N 0.13 0.66 0.00 1.57 3.20 -1.05 -1.13 116.97 120.36 2ccg h TYR 23 Ca 0.05 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.93 2ccg h TYR 23 Cb 0.01 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.09 2ccg h TYR 23 CO -0.09 0.26 -0.10 0.45 -1.64 0.00 0.00 178.16 177.04 2ccg h HIS 24 N 0.64 0.00 -0.03 -3.82 3.86 -0.87 0.58 115.15 115.51 2ccg h HIS 24 Ca 0.34 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 59.29 2ccg h HIS 24 Cb 0.32 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.81 2ccg h HIS 24 CO -0.10 0.10 -0.99 0.00 0.86 0.00 0.00 177.93 177.80 2ccg h ARG 25 N 0.00 0.73 0.10 2.45 2.47 -0.77 -3.35 114.38 116.00 2ccg h ARG 25 Ca -0.00 -0.74 -0.27 0.00 -1.26 0.00 0.00 59.98 57.71 2ccg h ARG 25 Cb 0.20 0.20 0.01 0.00 -1.65 0.00 0.00 29.97 28.74 2ccg h ARG 25 CO 0.01 1.32 -1.17 -0.07 0.56 0.00 0.00 179.97 180.62 2ccg h LEU 26 N 0.43 0.63 -1.60 3.04 3.38 -0.80 -3.33 115.31 117.06 2ccg h LEU 26 Ca -0.11 -0.59 0.32 0.00 0.09 0.00 0.00 57.88 57.59 2ccg h LEU 26 Cb 1.64 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 42.14 2ccg h LEU 26 CO 0.20 1.42 1.04 1.62 0.09 0.00 0.00 178.44 182.80 2ccg h VAL 27 N 0.19 0.15 0.09 1.22 3.04 -1.03 0.46 116.25 120.37 2ccg h VAL 27 Ca -0.14 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.54 2ccg h VAL 27 Cb 1.85 0.21 0.00 0.00 -2.01 0.00 0.00 31.29 31.34 2ccg h VAL 27 CO 0.21 0.00 -0.04 0.11 -1.01 0.00 0.00 177.57 176.83 2ccg h LYS 28 N 0.00 -0.12 0.00 4.17 1.57 -1.77 -3.37 116.57 117.05 2ccg h LYS 28 Ca 0.53 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.32 2ccg h LYS 28 Cb 2.60 0.03 0.00 0.00 0.08 0.00 0.00 32.23 34.94 2ccg h LYS 28 CO -0.01 0.39 -0.45 -0.25 -0.57 0.00 0.00 179.45 178.57 2ccg n ASP 29 N -4.83 0.71 -4.22 0.86 8.00 -0.45 -4.93 116.55 111.69 2ccg n ASP 29 Ca -0.07 0.23 -0.13 0.00 0.71 0.00 0.00 54.79 55.53 2ccg n ASP 29 Cb 0.28 -0.10 -0.10 0.00 -0.02 0.00 0.00 41.12 41.18 2ccg n ASP 29 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2ccg s TYR 30 N -3.14 1.13 -1.22 1.24 1.51 0.02 -5.05 117.35 111.84 2ccg s TYR 30 Ca 0.08 -0.88 -0.14 0.00 -1.01 0.00 0.00 57.07 55.12 2ccg s TYR 30 Cb 0.13 -0.62 0.16 0.00 -0.11 0.00 0.00 41.96 41.53 2ccg s TYR 30 CO 0.68 -0.07 1.46 -3.47 -1.11 0.00 0.00 175.55 173.05 2ccg n ASP 31 N -0.16 5.20 -4.54 2.29 -0.08 -1.26 -4.39 116.55 113.61 2ccg n ASP 31 Ca -0.10 -2.97 -0.34 0.00 -1.51 0.00 0.00 54.79 49.87 2ccg n ASP 31 Cb 0.61 -1.58 -0.12 0.00 2.34 0.00 0.00 41.12 42.37 2ccg n ASP 31 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2ccg s VAL 32 N 1.73 3.53 -0.02 5.18 0.11 -1.26 -1.30 120.40 128.38 2ccg s VAL 32 Ca 0.44 -0.54 0.05 0.00 -2.93 0.00 0.00 61.98 59.00 2ccg s VAL 32 Cb -0.02 -2.44 -0.03 0.00 -1.53 0.00 0.00 36.38 32.36 2ccg s VAL 32 CO 0.01 0.59 -0.15 0.27 -3.33 0.00 0.00 175.10 172.48 2ccg s ILE 33 N -0.64 2.98 -0.21 7.04 -4.36 0.05 -4.85 121.20 121.22 2ccg s ILE 33 Ca 0.10 -0.87 -0.07 0.00 -0.26 0.00 0.00 60.65 59.54 2ccg s ILE 33 Cb -0.11 -2.20 -0.04 0.00 1.25 0.00 0.00 42.46 41.36 2ccg s ILE 33 CO 0.02 0.51 0.06 -0.32 0.24 0.00 0.00 174.94 175.44 2ccg s MET 34 N -0.97 3.82 0.15 0.37 -2.45 -1.26 -0.98 119.30 117.98 2ccg s MET 34 Ca 0.13 -0.41 -0.04 0.00 -1.25 0.00 0.00 55.69 54.12 2ccg s MET 34 Cb -0.11 -3.25 -0.03 0.00 1.25 0.00 0.00 34.83 32.70 2ccg s MET 34 CO 0.02 0.07 0.14 -0.08 1.05 0.00 0.00 175.02 176.22 2ccg s THR 35 N 0.92 0.07 -0.04 10.11 -1.32 0.62 -4.97 115.64 121.04 2ccg s THR 35 Ca 0.04 -1.77 -0.23 0.00 -1.21 0.00 0.00 61.69 58.52 2ccg s THR 35 Cb -0.14 -2.06 0.05 0.00 -1.51 0.00 0.00 72.50 68.84 2ccg s THR 35 CO 0.03 -0.34 0.50 -0.60 -2.21 0.00 0.00 174.62 171.99 2ccg s ARG 36 N -4.04 0.85 0.21 7.08 3.52 -1.26 -0.44 118.95 124.87 2ccg s ARG 36 Ca 0.24 0.07 -0.30 0.00 -0.13 0.00 0.00 55.73 55.61 2ccg s ARG 36 Cb 0.06 0.39 -0.08 0.00 -1.56 0.00 0.00 34.95 33.76 2ccg s ARG 36 CO 0.03 -0.25 0.96 -1.21 -0.81 0.00 0.00 175.30 174.02 2ccg s GLU 37 N -1.19 4.80 0.00 5.12 2.02 -1.26 0.20 118.70 128.39 2ccg s GLU 37 Ca -0.12 1.52 0.31 0.00 0.02 0.00 0.00 54.97 56.70 2ccg s GLU 37 Cb -0.03 -3.29 1.78 0.00 0.10 0.00 0.00 34.13 32.69 2ccg s GLU 37 CO 0.07 0.42 2.15 -0.35 0.02 0.00 0.00 175.26 177.57 2ccg n PRO 38 N 1.77 1.06 -3.87 0.39 -0.04 -1.26 -5.00 135.00 128.04 2ccg n PRO 38 Ca -0.01 -0.08 -0.28 0.00 -0.04 0.00 0.00 63.50 63.09 2ccg n PRO 38 Cb 0.47 -1.48 0.03 0.00 -0.04 0.00 0.00 33.50 32.48 2ccg n PRO 38 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ccg n GLY 39 N 1.00 -0.45 3.01 0.55 0.00 0.52 -2.04 105.19 107.79 2ccg n GLY 39 Ca 0.23 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.43 2ccg n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ccg n GLY 40 N -1.68 1.46 3.66 -0.02 0.00 -1.26 -4.93 105.19 102.42 2ccg n GLY 40 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 2ccg n GLY 40 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ccg s VAL 41 N -3.75 3.90 0.05 1.61 1.01 -0.86 -4.91 120.40 117.45 2ccg s VAL 41 Ca 0.00 1.12 -0.12 0.00 0.00 0.00 0.00 61.98 62.98 2ccg s VAL 41 Cb 0.00 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 2ccg s VAL 41 CO 0.00 -0.09 1.20 1.55 0.00 0.00 0.00 175.10 177.76 2ccg h PRO 42 N 8.73 -0.06 -0.91 2.72 0.13 -1.94 0.46 132.00 141.14 2ccg h PRO 42 Ca -0.34 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.83 2ccg h PRO 42 Cb 1.15 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.24 2ccg h PRO 42 CO 0.95 -0.04 0.59 1.15 -0.23 0.00 0.00 178.00 180.43 2ccg h THR 43 N -0.06 1.16 -0.72 1.56 2.02 -1.99 -1.99 112.91 112.90 2ccg h THR 43 Ca 0.05 -0.40 0.03 0.00 0.77 0.00 0.00 66.41 66.86 2ccg h THR 43 Cb 0.18 -0.10 -0.04 0.00 -1.74 0.00 0.00 68.15 66.44 2ccg h THR 43 CO -0.29 0.21 0.45 1.23 0.37 0.00 0.00 175.52 177.50 2ccg h GLY 44 N 1.16 1.04 0.98 2.16 0.00 -1.60 -1.93 103.07 104.88 2ccg h GLY 44 Ca 0.36 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 2ccg h GLY 44 CO -0.11 0.29 0.24 0.83 0.00 0.00 0.00 176.54 177.79 2ccg h GLU 45 N 0.89 0.59 -0.51 4.80 4.39 0.60 -0.72 114.58 124.61 2ccg h GLU 45 Ca 0.29 -0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.93 2ccg h GLU 45 Cb 0.01 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.52 2ccg h GLU 45 CO -0.11 0.46 0.34 0.93 -1.16 0.00 0.00 179.01 179.47 2ccg h GLU 46 N 0.56 0.68 -0.41 2.33 4.39 -1.12 -0.07 114.58 120.93 2ccg h GLU 46 Ca 0.15 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.82 2ccg h GLU 46 Cb 0.03 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.51 2ccg h GLU 46 CO -0.03 0.45 0.27 0.82 -1.16 0.00 0.00 179.01 179.36 2ccg h ILE 47 N 0.70 1.09 -0.48 3.13 2.04 -1.08 -2.66 117.51 120.25 2ccg h ILE 47 Ca 0.19 -0.19 -0.08 0.00 1.00 0.00 0.00 64.86 65.78 2ccg h ILE 47 Cb -0.08 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.48 2ccg h ILE 47 CO -0.04 0.10 -0.02 -0.09 0.00 0.00 0.00 178.15 178.10 2ccg h ARG 48 N 0.54 0.82 -0.65 2.37 9.65 -0.78 -2.81 114.38 123.52 2ccg h ARG 48 Ca 0.15 -0.23 0.05 0.00 -1.10 0.00 0.00 59.98 58.85 2ccg h ARG 48 Cb -0.05 -0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 28.40 2ccg h ARG 48 CO -0.04 0.84 0.43 0.87 2.80 0.00 0.00 179.97 184.86 2ccg h LYS 49 N 0.76 0.69 0.00 0.20 1.57 -0.66 0.49 116.57 119.61 2ccg h LYS 49 Ca 0.14 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.87 2ccg h LYS 49 Cb 0.49 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 2ccg h LYS 49 CO 0.02 0.45 -0.08 0.82 -0.57 0.00 0.00 179.45 180.10 2ccg h ILE 50 N 0.71 0.48 0.00 1.86 2.04 -1.36 -3.11 117.51 118.13 2ccg h ILE 50 Ca 0.27 -0.36 -0.10 0.00 1.00 0.00 0.00 64.86 65.67 2ccg h ILE 50 Cb 0.17 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 2ccg h ILE 50 CO -0.08 0.07 -0.57 0.58 0.00 0.00 0.00 178.15 178.16 2ccg h VAL 51 N 0.00 1.14 -0.20 1.67 2.07 -0.96 -3.33 116.25 116.65 2ccg h VAL 51 Ca -0.00 -2.06 -0.08 0.00 0.82 0.00 0.00 66.70 65.37 2ccg h VAL 51 Cb 0.24 2.37 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 2ccg h VAL 51 CO 0.01 0.39 -0.23 -0.07 0.02 0.00 0.00 177.57 177.69 2ccg h LEU 52 N -1.00 0.35 -2.42 2.57 3.38 -1.57 0.22 115.31 116.84 2ccg h LEU 52 Ca -0.15 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 57.59 2ccg h LEU 52 Cb 1.01 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.59 2ccg h LEU 52 CO -0.09 0.59 0.15 -0.62 0.09 0.00 0.00 178.44 178.57 2ccg n GLU 53 N -4.16 1.48 -1.97 1.13 1.02 -1.17 -4.86 120.64 112.10 2ccg n GLU 53 Ca -0.01 -0.85 -0.43 0.00 -0.02 0.00 0.00 57.16 55.85 2ccg n GLU 53 Cb 0.37 -1.40 -0.03 0.00 -0.02 0.00 0.00 31.44 30.37 2ccg n GLU 53 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2ccg s GLY 54 N 0.26 0.84 -0.59 0.62 0.00 0.75 -4.97 107.32 104.23 2ccg s GLY 54 Ca 0.16 0.35 -0.03 0.00 0.00 0.00 0.00 44.72 45.21 2ccg s GLY 54 CO 0.03 3.28 0.40 -1.31 0.00 0.00 0.00 173.10 175.50 2ccg s ASN 55 N 6.00 5.23 -0.93 1.64 0.02 -1.26 -4.82 114.94 120.81 2ccg s ASN 55 Ca 0.81 -2.71 -0.10 0.00 -1.02 0.00 0.00 52.86 49.84 2ccg s ASN 55 Cb -0.24 -1.85 0.01 0.00 0.02 0.00 0.00 41.25 39.19 2ccg s ASN 55 CO 0.34 -0.40 0.67 -0.67 0.02 0.00 0.00 177.10 177.06 2ccg n ASP 56 N 3.68 -5.35 -4.90 -1.22 -0.08 -1.26 -4.96 116.55 102.45 2ccg n ASP 56 Ca 0.06 -0.88 -0.33 0.00 -1.51 0.00 0.00 54.79 52.13 2ccg n ASP 56 Cb 0.38 -2.62 -0.05 0.00 2.34 0.00 0.00 41.12 41.17 2ccg n ASP 56 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2ccg s MET 57 N -5.20 3.47 0.23 -0.67 0.23 -1.26 -5.02 119.30 111.08 2ccg s MET 57 Ca 0.17 -0.29 -0.28 0.00 -1.03 0.00 0.00 55.69 54.25 2ccg s MET 57 Cb -0.08 -3.08 -0.16 0.00 -1.53 0.00 0.00 34.83 29.99 2ccg s MET 57 CO 0.88 0.66 0.72 -3.47 -2.03 0.00 0.00 175.02 171.77 2ccg n ASP 58 N 0.85 -0.27 0.22 -1.18 -0.08 -1.26 -4.72 116.55 110.11 2ccg n ASP 58 Ca -0.10 1.15 0.06 0.00 -1.51 0.00 0.00 54.79 54.39 2ccg n ASP 58 Cb 0.52 -1.08 0.50 0.00 2.34 0.00 0.00 41.12 43.41 2ccg n ASP 58 CO 0.00 0.00 0.00 0.16 0.12 0.00 0.00 177.20 177.48 2ccg h ILE 59 N 1.41 1.05 -0.42 5.18 3.07 -1.99 -0.38 117.51 125.44 2ccg h ILE 59 Ca -0.33 -0.81 -0.14 0.00 1.55 0.00 0.00 64.86 65.13 2ccg h ILE 59 Cb 1.40 1.45 -0.01 0.00 -0.27 0.00 0.00 36.82 39.39 2ccg h ILE 59 CO 0.59 0.22 -0.29 0.03 -1.05 0.00 0.00 178.15 177.64 2ccg h ARG 60 N 0.00 0.92 -0.21 0.16 3.08 -1.98 0.12 114.38 116.47 2ccg h ARG 60 Ca -0.00 -0.43 -0.02 0.00 0.07 0.00 0.00 59.98 59.59 2ccg h ARG 60 Cb 0.43 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2ccg h ARG 60 CO 0.03 1.09 0.04 1.15 -1.07 0.00 0.00 179.97 181.21 2ccg h THR 61 N 0.78 1.21 -0.30 2.04 2.02 -1.67 -1.28 112.91 115.72 2ccg h THR 61 Ca 0.09 -0.70 0.06 0.00 0.77 0.00 0.00 66.41 66.63 2ccg h THR 61 Cb 0.87 1.28 -0.06 0.00 -1.74 0.00 0.00 68.15 68.49 2ccg h THR 61 CO 0.08 0.22 -0.12 -0.08 0.37 0.00 0.00 175.52 175.99 2ccg h GLU 62 N 0.15 -0.06 -0.59 6.66 4.81 -0.88 0.73 114.58 125.41 2ccg h GLU 62 Ca 0.06 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.37 2ccg h GLU 62 Cb 0.29 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.62 2ccg h GLU 62 CO 0.00 -0.04 0.26 0.00 -0.73 0.00 0.00 179.01 178.51 2ccg h ALA 63 N 1.20 0.76 -0.52 2.92 0.00 -0.55 -1.05 119.26 122.03 2ccg h ALA 63 Ca 0.15 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 2ccg h ALA 63 Cb 0.29 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2ccg h ALA 63 CO -0.34 -0.12 -0.07 0.52 0.00 0.00 0.00 179.25 179.24 2ccg h MET 64 N 0.49 0.94 -0.59 0.00 2.86 -0.38 -1.46 114.93 116.78 2ccg h MET 64 Ca 0.28 -0.32 -0.09 0.00 -2.06 0.00 0.00 59.70 57.51 2ccg h MET 64 Cb 0.27 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 2ccg h MET 64 CO -0.23 0.97 0.00 -0.07 1.06 0.00 0.00 176.91 178.64 2ccg h LEU 65 N 0.85 1.01 -0.74 1.22 3.38 -0.27 0.23 115.31 120.98 2ccg h LEU 65 Ca 0.14 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 2ccg h LEU 65 Cb 0.60 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 2ccg h LEU 65 CO 0.04 1.06 0.26 -0.26 0.09 0.00 0.00 178.44 179.63 2ccg h PHE 66 N 0.95 1.17 -0.49 1.13 0.04 -1.04 -0.59 116.94 118.11 2ccg h PHE 66 Ca 0.17 -0.11 -0.05 0.00 2.80 0.00 0.00 57.97 60.79 2ccg h PHE 66 Cb 0.54 -0.34 -0.02 0.00 2.20 0.00 0.00 35.95 38.33 2ccg h PHE 66 CO 0.04 0.91 0.12 0.00 -0.60 0.00 0.00 178.31 178.78 2ccg h ALA 67 N 1.13 0.64 -0.63 2.45 0.00 -0.67 -0.24 119.26 121.94 2ccg h ALA 67 Ca 0.24 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2ccg h ALA 67 Cb 0.27 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2ccg h ALA 67 CO -0.01 0.33 0.18 0.00 0.00 0.00 0.00 179.25 179.74 2ccg h ALA 68 N 0.99 0.82 -0.53 0.00 0.00 -0.23 -0.90 119.26 119.41 2ccg h ALA 68 Ca 0.15 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 2ccg h ALA 68 Cb 0.32 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2ccg h ALA 68 CO 0.00 0.51 -0.10 1.03 0.00 0.00 0.00 179.25 180.70 2ccg h SER 69 N 0.91 1.00 -0.45 0.00 0.87 -1.02 -2.53 113.55 112.33 2ccg h SER 69 Ca 0.20 -0.35 0.04 0.00 -1.23 0.00 0.00 61.79 60.46 2ccg h SER 69 Cb 0.32 -0.27 -0.04 0.00 -0.44 0.00 0.00 62.40 61.97 2ccg h SER 69 CO -0.00 1.11 0.21 -0.09 -0.53 0.00 0.00 176.83 177.53 2ccg h ARG 70 N 0.87 0.40 0.23 2.24 2.43 -0.68 -1.87 114.38 117.99 2ccg h ARG 70 Ca 0.14 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2ccg h ARG 70 Cb 0.66 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.10 2ccg h ARG 70 CO 0.05 0.26 -0.23 -0.09 -1.51 0.00 0.00 179.97 178.45 2ccg h ARG 71 N 0.41 -0.48 -0.08 0.20 9.65 -0.92 0.75 114.38 123.92 2ccg h ARG 71 Ca 0.20 0.03 0.04 0.00 -1.10 0.00 0.00 59.98 59.16 2ccg h ARG 71 Cb 0.14 0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 28.78 2ccg h ARG 71 CO -0.16 -0.32 -0.25 0.93 2.80 0.00 0.00 179.97 182.97 2ccg h GLU 72 N -0.49 -0.33 -0.55 0.20 4.39 -1.31 -0.15 114.58 116.34 2ccg h GLU 72 Ca -0.00 0.02 0.05 0.00 0.34 0.00 0.00 59.36 59.77 2ccg h GLU 72 Cb 0.46 0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.14 2ccg h GLU 72 CO -0.05 -0.22 0.29 1.25 -1.16 0.00 0.00 179.01 179.12 2ccg h HIS 73 N -0.34 0.54 0.09 4.33 2.76 -1.21 0.37 115.15 121.69 2ccg h HIS 73 Ca 0.08 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.27 2ccg h HIS 73 Cb 0.46 -0.16 0.00 0.00 1.55 0.00 0.00 27.41 29.26 2ccg h HIS 73 CO -0.32 0.27 -0.04 1.25 -1.30 0.00 0.00 177.93 177.78 2ccg h LEU 74 N 0.56 -0.10 -0.12 0.26 5.85 -0.41 0.31 115.31 121.67 2ccg h LEU 74 Ca 0.24 -0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.82 2ccg h LEU 74 Cb 0.14 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.19 2ccg h LEU 74 CO -0.16 -0.01 -0.28 1.62 -0.34 0.00 0.00 178.44 179.27 2ccg h VAL 75 N -0.18 1.38 0.00 1.05 3.04 -0.82 0.39 116.25 121.10 2ccg h VAL 75 Ca -0.01 -1.57 0.00 0.00 -1.01 0.00 0.00 66.70 64.11 2ccg h VAL 75 Cb 0.15 2.08 0.00 0.00 -2.01 0.00 0.00 31.29 31.51 2ccg h VAL 75 CO 0.02 0.46 -0.29 0.18 -1.01 0.00 0.00 177.57 176.93 2ccg n LEU 76 N -4.43 0.68 0.00 3.16 4.77 0.13 -4.31 117.00 117.00 2ccg n LEU 76 Ca -0.07 0.39 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 2ccg n LEU 76 Cb 0.46 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 2ccg n LEU 76 CO 0.42 -0.10 -0.14 1.17 -1.33 0.00 0.00 177.39 177.42 2ccg n LYS 77 N -2.09 0.00 0.17 3.23 4.81 -0.00 -4.81 118.16 119.46 2ccg n LYS 77 Ca 0.05 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.37 2ccg n LYS 77 Cb 0.42 -0.27 -0.07 0.00 0.02 0.00 0.00 35.03 35.14 2ccg n LYS 77 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2ccg h VAL 78 N 0.00 0.46 -0.27 3.15 2.07 -0.83 -2.88 116.25 117.94 2ccg h VAL 78 Ca 0.00 -0.69 0.05 0.00 0.82 0.00 0.00 66.70 66.88 2ccg h VAL 78 Cb 0.27 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 30.71 2ccg h VAL 78 CO 0.00 0.10 -0.06 0.40 0.02 0.00 0.00 177.57 178.03 2ccg h ILE 79 N -0.96 0.74 -0.63 4.57 2.04 -0.47 -0.67 117.51 122.14 2ccg h ILE 79 Ca -0.05 -0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.90 2ccg h ILE 79 Cb 0.53 0.73 -0.07 0.00 -0.74 0.00 0.00 36.82 37.27 2ccg h ILE 79 CO 0.08 0.00 0.25 -0.65 0.00 0.00 0.00 178.15 177.83 2ccg h PRO 80 N 0.01 0.43 -0.95 2.37 0.11 -1.75 -0.56 132.00 131.66 2ccg h PRO 80 Ca 0.13 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.21 2ccg h PRO 80 Cb 0.19 -0.10 -0.05 0.00 0.11 0.00 0.00 31.00 31.16 2ccg h PRO 80 CO -0.27 0.28 0.57 0.00 -0.21 0.00 0.00 178.00 178.38 2ccg h ALA 81 N 1.42 1.22 -0.15 -0.75 0.00 -1.15 -2.30 119.26 117.55 2ccg h ALA 81 Ca 0.31 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 55.01 2ccg h ALA 81 Cb 0.38 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2ccg h ALA 81 CO -0.30 0.67 -0.37 -0.07 0.00 0.00 0.00 179.25 179.18 2ccg h LEU 82 N 1.32 0.33 -1.51 0.00 3.38 -0.15 -2.24 115.31 116.44 2ccg h LEU 82 Ca 0.34 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 2ccg h LEU 82 Cb -0.06 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 2ccg h LEU 82 CO -0.06 0.68 -0.11 0.11 0.09 0.00 0.00 178.44 179.15 2ccg h LYS 83 N 0.27 0.00 -0.59 1.13 1.57 -0.59 -2.06 116.57 116.30 2ccg h LYS 83 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2ccg h LYS 83 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.10 2ccg h LYS 83 CO 0.06 0.11 0.00 0.39 -0.57 0.00 0.00 179.45 179.44 2ccg n GLU 84 N -3.30 2.70 -2.09 3.15 1.02 -0.90 -4.94 120.64 116.28 2ccg n GLU 84 Ca -0.00 -2.04 -0.11 0.00 -0.02 0.00 0.00 57.16 54.98 2ccg n GLU 84 Cb 0.33 -1.60 -0.01 0.00 -0.02 0.00 0.00 31.44 30.13 2ccg n GLU 84 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ccg n GLY 85 N 1.10 0.09 3.94 0.62 0.00 -0.77 -5.03 105.19 105.14 2ccg n GLY 85 Ca 0.19 -0.42 -0.24 0.00 0.00 0.00 0.00 46.02 45.55 2ccg n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ccg s LYS 86 N -4.35 3.25 -0.29 1.61 1.02 -0.89 -4.33 119.74 115.75 2ccg s LYS 86 Ca 0.00 -0.36 -0.13 0.00 0.02 0.00 0.00 55.97 55.51 2ccg s LYS 86 Cb 0.00 -2.57 -0.04 0.00 -0.52 0.00 0.00 37.83 34.70 2ccg s LYS 86 CO 0.00 -0.13 0.26 0.08 -0.92 0.00 0.00 175.35 174.64 2ccg s VAL 87 N -2.51 5.26 -0.35 3.17 1.01 -0.42 -2.48 120.40 124.09 2ccg s VAL 87 Ca 0.46 0.21 -0.12 0.00 0.00 0.00 0.00 61.98 62.52 2ccg s VAL 87 Cb -0.10 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.64 2ccg s VAL 87 CO 0.38 0.15 0.23 -0.69 0.00 0.00 0.00 175.10 175.18 2ccg s VAL 88 N 1.87 5.12 -0.34 2.92 1.01 0.58 -0.77 120.40 130.78 2ccg s VAL 88 Ca 0.09 -0.35 -0.16 0.00 0.00 0.00 0.00 61.98 61.57 2ccg s VAL 88 Cb -0.16 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.54 2ccg s VAL 88 CO 0.11 -0.05 0.39 -0.76 0.00 0.00 0.00 175.10 174.79 2ccg s LEU 89 N 1.69 4.42 -0.23 3.92 1.43 -0.15 -0.51 118.68 129.25 2ccg s LEU 89 Ca 0.05 -0.19 -0.00 0.00 -1.03 0.00 0.00 54.13 52.96 2ccg s LEU 89 Cb -0.18 -2.38 0.03 0.00 0.03 0.00 0.00 46.19 43.69 2ccg s LEU 89 CO 0.09 -0.36 -0.11 0.00 0.23 0.00 0.00 176.35 176.20 2ccg s ASP 91 N 1.28 5.77 0.14 0.00 -1.08 0.41 -1.06 116.67 122.13 2ccg s ASP 91 Ca 0.00 0.05 0.00 0.00 -0.52 0.00 0.00 52.55 52.09 2ccg s ASP 91 Cb -0.16 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.76 2ccg s ASP 91 CO -0.07 -2.04 0.00 0.54 0.52 0.00 0.00 175.17 174.12 2ccg n ARG 92 N 9.15 -1.39 0.00 4.34 1.74 0.09 -4.17 116.66 126.41 2ccg n ARG 92 Ca 0.12 1.03 0.00 0.00 -0.77 0.00 0.00 57.85 58.23 2ccg n ARG 92 Cb 0.50 -1.15 0.00 0.00 -1.02 0.00 0.00 32.46 30.79 2ccg n ARG 92 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 2ccg n TYR 93 N -0.74 0.00 -0.24 -1.55 9.36 -1.26 -4.65 117.16 118.07 2ccg n TYR 93 Ca 0.00 0.00 0.05 0.00 3.32 0.00 0.00 57.90 61.27 2ccg n TYR 93 Cb 0.00 0.00 0.18 0.00 -0.63 0.00 0.00 39.34 38.89 2ccg n TYR 93 CO 0.00 0.00 0.00 0.97 0.22 0.00 0.00 176.86 178.05 2ccg h ILE 94 N 0.00 0.54 -0.86 2.97 2.10 -1.99 -1.44 117.51 118.83 2ccg h ILE 94 Ca 0.00 -0.10 0.14 0.00 1.08 0.00 0.00 64.86 65.98 2ccg h ILE 94 Cb 0.00 0.23 -0.06 0.00 -1.09 0.00 0.00 36.82 35.89 2ccg h ILE 94 CO 0.00 0.05 0.56 0.44 -1.08 0.00 0.00 178.15 178.12 2ccg h ASP 95 N 0.29 0.62 -0.46 2.19 5.19 -1.99 -0.13 116.42 122.12 2ccg h ASP 95 Ca 0.41 0.03 0.03 0.00 -0.62 0.00 0.00 57.03 56.88 2ccg h ASP 95 Cb 0.68 -0.09 -0.04 0.00 0.18 0.00 0.00 39.33 40.06 2ccg h ASP 95 CO -0.49 0.32 0.25 0.28 -3.12 0.00 0.00 179.24 176.49 2ccg h SER 96 N 0.66 0.39 -0.41 6.45 0.02 -1.65 0.99 113.55 120.00 2ccg h SER 96 Ca 0.42 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.37 2ccg h SER 96 Cb 0.70 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 2ccg h SER 96 CO -0.18 0.27 0.18 0.28 -1.14 0.00 0.00 176.83 176.24 2ccg h SER 97 N 0.50 0.55 -0.50 3.07 0.02 -1.08 0.14 113.55 116.25 2ccg h SER 97 Ca 0.19 -0.15 0.05 0.00 -0.84 0.00 0.00 61.79 61.04 2ccg h SER 97 Cb 0.07 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.42 2ccg h SER 97 CO -0.12 0.55 0.24 -0.07 -1.14 0.00 0.00 176.83 176.30 2ccg h LEU 98 N 0.52 0.34 -0.05 5.07 3.38 -0.73 0.55 115.31 124.39 2ccg h LEU 98 Ca 0.14 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 2ccg h LEU 98 Cb 0.16 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2ccg h LEU 98 CO -0.01 0.23 -0.14 0.00 0.09 0.00 0.00 178.44 178.61 2ccg h ALA 99 N 1.28 0.08 0.13 1.53 0.00 -0.58 0.71 119.26 122.41 2ccg h ALA 99 Ca 0.22 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2ccg h ALA 99 Cb 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2ccg h ALA 99 CO -0.17 -0.01 -0.06 1.88 0.00 0.00 0.00 179.25 180.89 2ccg h TYR 100 N -0.36 -0.16 -0.05 0.00 -1.99 -0.68 0.37 116.97 114.10 2ccg h TYR 100 Ca -0.00 -0.00 -0.19 0.00 2.00 0.00 0.00 58.73 60.53 2ccg h TYR 100 Cb 0.75 0.05 0.01 0.00 2.00 0.00 0.00 36.73 39.54 2ccg h TYR 100 CO 0.13 -0.10 -0.71 1.96 -0.00 0.00 0.00 178.16 179.44 2ccg h GLN 101 N -1.02 0.57 0.00 4.88 7.50 -1.12 0.24 115.11 126.16 2ccg h GLN 101 Ca -0.02 -0.55 0.00 0.00 0.50 0.00 0.00 58.65 58.59 2ccg h GLN 101 Cb 0.13 0.14 0.00 0.00 0.05 0.00 0.00 27.48 27.80 2ccg h GLN 101 CO 0.03 1.17 0.00 0.41 -1.50 0.00 0.00 178.83 178.94 2ccg n GLY 102 N 0.92 -1.52 0.10 3.46 0.00 -0.44 -2.84 105.19 104.88 2ccg n GLY 102 Ca -0.09 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.89 2ccg n GLY 102 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2ccg h TYR 103 N 0.00 -0.20 -0.39 1.61 3.20 -0.81 -1.80 116.97 118.59 2ccg h TYR 103 Ca 0.00 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.92 2ccg h TYR 103 Cb 0.00 0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.28 2ccg h TYR 103 CO 0.12 -0.12 0.08 0.00 -1.64 0.00 0.00 178.16 176.59 2ccg h ALA 104 N -1.60 0.42 0.00 1.82 0.00 -0.88 -2.24 119.26 116.78 2ccg h ALA 104 Ca -0.02 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2ccg h ALA 104 Cb 0.16 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2ccg h ALA 104 CO 0.04 -0.32 -0.15 0.00 0.00 0.00 0.00 179.25 178.81 2ccg h ARG 105 N 0.21 0.00 0.00 0.00 2.47 -0.61 -3.48 114.38 112.97 2ccg h ARG 105 Ca 0.19 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.91 2ccg h ARG 105 Cb 0.22 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.54 2ccg h ARG 105 CO -0.24 0.15 0.00 0.41 0.56 0.00 0.00 179.97 180.84 2ccg n GLY 106 N 0.67 0.72 0.26 0.04 0.00 -0.84 -4.96 105.19 101.09 2ccg n GLY 106 Ca 0.02 -0.10 -0.04 0.00 0.00 0.00 0.00 46.02 45.90 2ccg n GLY 106 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2ccg h ILE 107 N 0.00 1.25 0.00 -0.61 2.04 -1.29 -3.48 117.51 115.42 2ccg h ILE 107 Ca 0.00 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 64.74 2ccg h ILE 107 Cb 0.00 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 2ccg h ILE 107 CO 0.00 0.38 0.00 0.61 0.00 0.00 0.00 178.15 179.14 2ccg n GLY 108 N -0.51 2.53 0.31 5.37 0.00 -0.72 -4.81 105.19 107.36 2ccg n GLY 108 Ca 0.01 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.06 2ccg n GLY 108 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2ccg h VAL 109 N 0.00 0.19 -0.13 1.61 2.07 -1.84 -1.16 116.25 116.98 2ccg h VAL 109 Ca 0.00 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.43 2ccg h VAL 109 Cb 0.00 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 29.95 2ccg h VAL 109 CO 0.00 0.00 -0.33 -0.33 0.02 0.00 0.00 177.57 176.93 2ccg h GLU 110 N -0.04 0.26 -0.43 1.57 4.39 -1.95 0.74 114.58 119.12 2ccg h GLU 110 Ca 0.34 -0.10 -0.12 0.00 0.34 0.00 0.00 59.36 59.82 2ccg h GLU 110 Cb 0.57 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.19 2ccg h GLU 110 CO -0.79 0.56 -0.22 1.49 -1.16 0.00 0.00 179.01 178.89 2ccg h GLU 111 N 0.23 0.86 0.00 2.33 4.81 -1.56 -1.04 114.58 120.20 2ccg h GLU 111 Ca 0.03 -0.36 -0.18 0.00 -0.13 0.00 0.00 59.36 58.72 2ccg h GLU 111 Cb 0.69 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.02 2ccg h GLU 111 CO 0.05 1.00 -0.82 0.28 -0.73 0.00 0.00 179.01 178.79 2ccg h VAL 112 N 0.75 1.55 -0.21 0.32 2.07 -1.09 -2.72 116.25 116.92 2ccg h VAL 112 Ca 0.10 -2.70 -0.11 0.00 0.82 0.00 0.00 66.70 64.81 2ccg h VAL 112 Cb 0.76 2.47 -0.01 0.00 -1.52 0.00 0.00 31.29 32.99 2ccg h VAL 112 CO 0.06 0.78 -0.34 -0.09 0.02 0.00 0.00 177.57 178.00 2ccg h ARG 113 N 0.04 0.44 -0.43 1.57 2.43 -0.55 -1.99 114.38 115.89 2ccg h ARG 113 Ca -0.02 -0.19 -0.13 0.00 -0.81 0.00 0.00 59.98 58.83 2ccg h ARG 113 Cb 1.44 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.97 2ccg h ARG 113 CO 0.11 0.72 -0.24 0.00 -1.51 0.00 0.00 179.97 179.06 2ccg h ALA 114 N 1.27 0.61 -0.14 2.80 0.00 -1.11 -1.39 119.26 121.30 2ccg h ALA 114 Ca 0.04 -0.40 0.01 0.00 0.00 0.00 0.00 54.91 54.57 2ccg h ALA 114 Cb 0.77 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2ccg h ALA 114 CO 0.06 0.61 0.05 1.25 0.00 0.00 0.00 179.25 181.22 2ccg h LEU 115 N 0.75 0.05 -1.45 0.00 5.85 -1.27 -2.70 115.31 116.55 2ccg h LEU 115 Ca 0.09 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.79 2ccg h LEU 115 Cb 0.82 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.85 2ccg h LEU 115 CO 0.07 0.05 -0.15 0.78 -0.34 0.00 0.00 178.44 178.86 2ccg h ASN 116 N 0.12 0.00 -0.17 1.25 2.35 -1.26 -2.51 115.58 115.35 2ccg h ASN 116 Ca 0.06 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.73 2ccg h ASN 116 Cb 0.03 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 2ccg h ASN 116 CO -0.06 0.15 -0.15 -0.33 -1.65 0.00 0.00 177.43 175.39 2ccg h GLU 117 N 0.00 0.57 -0.14 0.81 5.08 -0.92 0.42 114.58 120.40 2ccg h GLU 117 Ca -0.00 -0.18 -0.10 0.00 -1.00 0.00 0.00 59.36 58.08 2ccg h GLU 117 Cb 0.57 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 2ccg h GLU 117 CO 0.02 0.70 -0.35 0.35 -1.00 0.00 0.00 179.01 178.73 2ccg h PHE 118 N 0.52 0.32 0.01 4.33 3.57 -1.31 0.84 116.94 125.22 2ccg h PHE 118 Ca 0.09 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 2ccg h PHE 118 Cb 0.56 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.22 2ccg h PHE 118 CO 0.02 0.60 -0.08 0.00 -2.23 0.00 0.00 178.31 176.61 2ccg h ALA 119 N 1.40 -0.01 -0.00 2.41 0.00 -1.09 -3.36 119.26 118.61 2ccg h ALA 119 Ca 0.03 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2ccg h ALA 119 Cb 0.73 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2ccg h ALA 119 CO 0.06 0.02 -0.30 0.44 0.00 0.00 0.00 179.25 179.47 2ccg n ILE 120 N -4.57 0.00 -3.95 0.00 -5.35 0.13 -4.61 119.36 101.00 2ccg n ILE 120 Ca -0.10 -0.01 -0.31 0.00 -0.27 0.00 0.00 62.75 62.06 2ccg n ILE 120 Cb 0.50 0.01 0.02 0.00 -1.74 0.00 0.00 39.64 38.42 2ccg n ILE 120 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 2ccg n ASN 121 N -1.40 -4.23 0.00 7.28 3.02 0.29 -0.91 115.26 119.31 2ccg n ASN 121 Ca 0.07 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 53.80 2ccg n ASN 121 Cb 0.33 -3.69 0.00 0.00 -0.61 0.00 0.00 39.78 35.81 2ccg n ASN 121 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ccg n GLY 122 N -1.65 0.85 3.57 7.41 0.00 -1.24 -4.95 105.19 109.18 2ccg n GLY 122 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 2ccg n GLY 122 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ccg s LEU 123 N 0.00 3.84 0.47 0.99 2.96 -0.08 -4.98 118.68 121.87 2ccg s LEU 123 Ca 0.00 -2.25 -0.07 0.00 -0.22 0.00 0.00 54.13 51.59 2ccg s LEU 123 Cb 0.00 -2.57 -0.05 0.00 0.50 0.00 0.00 46.19 44.08 2ccg s LEU 123 CO 0.00 -1.22 0.80 -0.31 -1.32 0.00 0.00 176.35 174.30 2ccg s TYR 124 N 4.26 3.54 0.48 5.38 1.51 -1.26 -4.97 117.35 126.28 2ccg s TYR 124 Ca 0.51 0.93 -0.24 0.00 -1.01 0.00 0.00 57.07 57.27 2ccg s TYR 124 Cb 0.03 -2.39 -0.07 0.00 -0.11 0.00 0.00 41.96 39.42 2ccg s TYR 124 CO 0.03 -0.26 1.35 -2.14 -1.11 0.00 0.00 175.55 173.43 2ccg s PRO 125 N -4.47 3.55 0.20 -1.71 0.02 -1.26 -4.93 135.00 126.39 2ccg s PRO 125 Ca 0.49 2.23 -0.04 0.00 0.02 0.00 0.00 61.00 63.71 2ccg s PRO 125 Cb -0.10 -2.50 0.13 0.00 0.02 0.00 0.00 34.50 32.05 2ccg s PRO 125 CO 0.41 -0.87 1.55 -0.44 -0.33 0.00 0.00 177.00 177.32 2ccg h ASP 126 N 2.04 0.70 -4.02 2.53 3.32 -0.38 -3.44 116.42 117.17 2ccg h ASP 126 Ca -0.50 -0.33 -0.19 0.00 0.02 0.00 0.00 57.03 56.03 2ccg h ASP 126 Cb 1.27 -0.20 -0.26 0.00 0.22 0.00 0.00 39.33 40.37 2ccg h ASP 126 CO 0.60 1.04 -0.59 -0.22 -1.72 0.00 0.00 179.24 178.34 2ccg s LEU 127 N -8.57 1.65 -0.17 1.55 2.96 -1.02 -4.80 118.68 110.28 2ccg s LEU 127 Ca -0.08 0.10 -0.01 0.00 -0.22 0.00 0.00 54.13 53.91 2ccg s LEU 127 Cb 0.12 0.38 0.05 0.00 0.50 0.00 0.00 46.19 47.24 2ccg s LEU 127 CO 0.84 -0.10 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.87 2ccg s THR 128 N -0.25 0.79 -0.14 3.68 2.01 0.57 -0.97 115.64 121.33 2ccg s THR 128 Ca -0.03 -0.54 -0.25 0.00 0.31 0.00 0.00 61.69 61.17 2ccg s THR 128 Cb -0.02 -1.12 -0.02 0.00 0.01 0.00 0.00 72.50 71.35 2ccg s THR 128 CO 0.00 -0.02 0.81 -0.63 -0.69 0.00 0.00 174.62 174.09 2ccg s ILE 129 N 1.76 4.92 -0.26 1.82 -1.09 0.75 -1.71 121.20 127.39 2ccg s ILE 129 Ca 0.00 1.60 -0.05 0.00 -2.23 0.00 0.00 60.65 59.98 2ccg s ILE 129 Cb -0.16 -4.12 0.00 0.00 -1.58 0.00 0.00 42.46 36.60 2ccg s ILE 129 CO -0.07 0.09 0.01 -0.47 -1.23 0.00 0.00 174.94 173.27 2ccg s TYR 130 N 1.76 3.06 -0.87 3.97 5.04 -0.79 -0.95 117.35 128.58 2ccg s TYR 130 Ca 0.39 -1.03 -0.22 0.00 -2.44 0.00 0.00 57.07 53.77 2ccg s TYR 130 Cb -0.17 -2.16 0.08 0.00 0.35 0.00 0.00 41.96 40.06 2ccg s TYR 130 CO 0.15 -0.58 1.20 -0.51 -1.34 0.00 0.00 175.55 174.47 2ccg s LEU 131 N 1.47 4.25 -0.89 6.97 1.43 -0.42 -0.91 118.68 130.59 2ccg s LEU 131 Ca 0.03 -1.46 -0.25 0.00 -1.03 0.00 0.00 54.13 51.42 2ccg s LEU 131 Cb -0.16 -2.47 0.04 0.00 0.03 0.00 0.00 46.19 43.63 2ccg s LEU 131 CO -0.01 -1.36 1.38 0.21 0.23 0.00 0.00 176.35 176.81 2ccg s ASN 132 N 4.04 6.32 0.07 2.29 3.04 0.53 -4.45 114.94 126.78 2ccg s ASN 132 Ca 0.34 -0.97 0.05 0.00 0.04 0.00 0.00 52.86 52.32 2ccg s ASN 132 Cb -0.06 -2.56 -0.04 0.00 -1.54 0.00 0.00 41.25 37.04 2ccg s ASN 132 CO -0.03 -1.68 -0.05 0.54 -3.04 0.00 0.00 177.10 172.84 2ccg s VAL 133 N 5.43 3.71 0.56 -5.21 0.11 -1.26 -0.83 120.40 122.90 2ccg s VAL 133 Ca 0.42 -1.00 -0.14 0.00 -2.93 0.00 0.00 61.98 58.33 2ccg s VAL 133 Cb -0.04 -2.71 -0.06 0.00 -1.53 0.00 0.00 36.38 32.04 2ccg s VAL 133 CO 0.02 0.21 0.99 -0.94 -3.33 0.00 0.00 175.10 172.05 2ccg s SER 134 N -1.99 6.44 0.22 3.54 1.04 -1.26 -4.87 113.70 116.82 2ccg s SER 134 Ca 0.22 1.48 -0.08 0.00 0.48 0.00 0.00 55.95 58.04 2ccg s SER 134 Cb -0.11 -2.48 0.31 0.00 0.10 0.00 0.00 66.02 63.84 2ccg s SER 134 CO 0.13 -0.71 1.75 0.00 0.98 0.00 0.00 173.24 175.39 2ccg h ALA 135 N 0.36 0.85 -0.35 5.32 0.00 -1.96 0.63 119.26 124.11 2ccg h ALA 135 Ca -0.46 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 2ccg h ALA 135 Cb 1.19 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 2ccg h ALA 135 CO 0.62 -0.17 0.20 0.93 0.00 0.00 0.00 179.25 180.82 2ccg h GLU 136 N 0.44 0.49 -0.45 0.00 3.07 -1.99 0.21 114.58 116.36 2ccg h GLU 136 Ca 0.33 -0.06 -0.07 0.00 -0.50 0.00 0.00 59.36 59.06 2ccg h GLU 136 Cb 0.41 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.21 2ccg h GLU 136 CO -0.32 0.40 -0.01 0.28 -1.40 0.00 0.00 179.01 177.96 2ccg h VAL 137 N 0.45 1.26 -0.23 3.13 2.07 -1.86 -2.24 116.25 118.83 2ccg h VAL 137 Ca 0.13 -1.06 0.05 0.00 0.82 0.00 0.00 66.70 66.63 2ccg h VAL 137 Cb 0.05 1.06 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 2ccg h VAL 137 CO -0.02 0.36 -0.06 1.23 0.02 0.00 0.00 177.57 179.11 2ccg h GLY 138 N 0.64 0.16 0.42 2.17 0.00 -0.54 -1.71 103.07 104.21 2ccg h GLY 138 Ca 0.13 0.08 0.10 0.00 0.00 0.00 0.00 47.33 47.64 2ccg h GLY 138 CO 0.02 -0.09 0.38 -0.09 0.00 0.00 0.00 176.54 176.77 2ccg h ARG 139 N -0.00 0.61 -0.71 4.80 2.43 -0.40 -0.69 114.38 120.42 2ccg h ARG 139 Ca 0.11 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.18 2ccg h ARG 139 Cb 0.17 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 2ccg h ARG 139 CO -0.24 0.40 0.19 0.93 -1.51 0.00 0.00 179.97 179.74 2ccg h GLU 140 N 0.63 1.12 -0.48 0.20 4.39 -0.79 -1.55 114.58 118.09 2ccg h GLU 140 Ca 0.38 -0.26 -0.09 0.00 0.34 0.00 0.00 59.36 59.72 2ccg h GLU 140 Cb 0.42 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 2ccg h GLU 140 CO -0.29 0.98 -0.08 0.00 -1.16 0.00 0.00 179.01 178.47 2ccg h ARG 141 N 1.06 0.86 -0.60 2.33 3.08 -0.63 -2.57 114.38 117.91 2ccg h ARG 141 Ca 0.22 -0.28 -0.08 0.00 0.07 0.00 0.00 59.98 59.91 2ccg h ARG 141 Cb 0.35 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 2ccg h ARG 141 CO -0.00 0.91 0.07 0.82 -1.07 0.00 0.00 179.97 180.70 2ccg h ILE 142 N 0.78 1.26 -0.13 2.04 2.04 -0.80 -3.10 117.51 119.60 2ccg h ILE 142 Ca 0.13 -1.05 -0.15 0.00 1.00 0.00 0.00 64.86 64.79 2ccg h ILE 142 Cb 0.58 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 2ccg h ILE 142 CO 0.04 0.38 -0.58 0.40 0.00 0.00 0.00 178.15 178.39 2ccg h ILE 143 N 0.92 1.35 0.00 -0.67 2.04 -1.21 -2.82 117.51 117.11 2ccg h ILE 143 Ca 0.18 -1.88 0.00 0.00 1.00 0.00 0.00 64.86 64.16 2ccg h ILE 143 Cb 0.47 1.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.43 2ccg h ILE 143 CO 0.02 0.57 0.00 2.29 0.00 0.00 0.00 178.15 181.03 2ccg n LYS 144 N -3.92 0.09 -0.25 2.37 2.85 -0.98 0.15 118.16 118.47 2ccg n LYS 144 Ca -0.03 0.24 0.09 0.00 -1.05 0.00 0.00 58.31 57.56 2ccg n LYS 144 Cb 0.61 -1.50 0.22 0.00 -0.65 0.00 0.00 35.03 33.71 2ccg n LYS 144 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2ccg n ASN 145 N -1.39 3.36 0.00 -5.58 3.02 -1.06 -4.53 115.26 109.07 2ccg n ASN 145 Ca 0.04 -1.98 0.00 0.00 -0.03 0.00 0.00 54.58 52.62 2ccg n ASN 145 Cb 0.11 -0.33 0.00 0.00 -0.61 0.00 0.00 39.78 38.95 2ccg n ASN 145 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2ccg n SER 146 N 1.07 0.00 -3.57 6.41 3.41 -0.84 -5.05 113.62 115.04 2ccg n SER 146 Ca 0.17 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.51 2ccg n SER 146 Cb 0.52 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.41 2ccg n SER 146 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2ccg n ARG 147 N -0.15 -0.83 -2.72 4.33 1.74 0.40 -4.77 116.66 114.67 2ccg n ARG 147 Ca 0.00 0.09 -0.07 0.00 -0.77 0.00 0.00 57.85 57.10 2ccg n ARG 147 Cb 0.00 -3.07 0.07 0.00 -1.02 0.00 0.00 32.46 28.45 2ccg n ARG 147 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2ccg n ASP 148 N -1.45 -2.20 -4.51 0.55 8.00 -1.26 -5.08 116.55 110.59 2ccg n ASP 148 Ca 0.04 -2.91 -0.37 0.00 0.71 0.00 0.00 54.79 52.26 2ccg n ASP 148 Cb 0.33 1.54 -0.14 0.00 -0.02 0.00 0.00 41.12 42.83 2ccg n ASP 148 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ccg n GLN 149 N 1.12 0.19 0.00 -1.24 10.64 -1.26 -4.54 117.38 122.29 2ccg n GLN 149 Ca 0.05 -0.03 0.00 0.00 -1.83 0.00 0.00 57.00 55.19 2ccg n GLN 149 Cb 0.68 -1.83 0.00 0.00 -0.86 0.00 0.00 30.24 28.23 2ccg n GLN 149 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 2ccg n ASN 150 N 11.03 0.63 0.00 2.61 2.85 -1.26 -4.67 115.26 126.46 2ccg n ASN 150 Ca 0.61 0.00 0.07 0.00 -0.11 0.00 0.00 54.58 55.15 2ccg n ASN 150 Cb 0.14 0.00 0.44 0.00 1.24 0.00 0.00 39.78 41.60 2ccg n ASN 150 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 2ccg n ARG 151 N -1.99 0.62 -3.82 1.20 0.63 -1.26 -4.18 116.66 107.86 2ccg n ARG 151 Ca 0.00 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.63 2ccg n ARG 151 Cb 0.11 -1.37 -0.14 0.00 0.45 0.00 0.00 32.46 31.51 2ccg n ARG 151 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2ccg s LEU 152 N -1.74 3.14 0.00 6.15 1.43 -1.26 -4.89 118.68 121.52 2ccg s LEU 152 Ca 0.22 -2.10 0.00 0.00 -1.03 0.00 0.00 54.13 51.22 2ccg s LEU 152 Cb 0.10 -1.16 0.00 0.00 0.03 0.00 0.00 46.19 45.17 2ccg s LEU 152 CO 0.17 -0.36 0.00 0.47 0.23 0.00 0.00 176.35 176.86 2ccg n ASP 153 N 4.27 1.59 0.02 2.29 8.00 -1.26 -4.93 116.55 126.54 2ccg n ASP 153 Ca 0.02 -0.80 -0.10 0.00 0.71 0.00 0.00 54.79 54.62 2ccg n ASP 153 Cb 0.40 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.43 2ccg n ASP 153 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 2ccg h GLN 154 N 0.00 -0.40 0.41 -1.24 5.75 -1.99 0.23 115.11 117.87 2ccg h GLN 154 Ca 0.00 0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.52 2ccg h GLN 154 Cb 0.00 0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.63 2ccg h GLN 154 CO 0.00 -0.27 -0.27 1.05 -2.65 0.00 0.00 178.83 176.69 2ccg h GLU 155 N -0.42 -0.64 -0.79 1.69 4.11 -1.97 -0.21 114.58 116.36 2ccg h GLU 155 Ca 0.01 0.04 0.16 0.00 0.07 0.00 0.00 59.36 59.64 2ccg h GLU 155 Cb 0.47 0.15 -0.15 0.00 0.50 0.00 0.00 28.75 29.71 2ccg h GLU 155 CO -0.26 -0.43 -0.21 -0.44 0.07 0.00 0.00 179.01 177.74 2ccg h ASP 156 N -0.66 -0.76 -0.15 3.06 3.32 -1.87 0.73 116.42 120.08 2ccg h ASP 156 Ca -0.04 0.24 -0.11 0.00 0.02 0.00 0.00 57.03 57.14 2ccg h ASP 156 Cb 0.56 0.50 -0.01 0.00 0.22 0.00 0.00 39.33 40.59 2ccg h ASP 156 CO 0.03 -0.26 -0.27 0.25 -1.72 0.00 0.00 179.24 177.27 2ccg h LEU 157 N -0.01 0.63 -0.53 1.55 5.85 -0.71 -1.98 115.31 120.11 2ccg h LEU 157 Ca 0.37 -0.23 -0.10 0.00 0.84 0.00 0.00 57.88 58.77 2ccg h LEU 157 Cb 0.58 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 2ccg h LEU 157 CO -0.81 0.88 -0.45 0.11 -0.34 0.00 0.00 178.44 177.82 2ccg h LYS 158 N 0.54 0.00 -0.16 1.25 1.79 0.11 -2.71 116.57 117.38 2ccg h LYS 158 Ca 0.07 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.38 2ccg h LYS 158 Cb 0.74 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.40 2ccg h LYS 158 CO 0.06 0.45 -0.55 0.35 -1.08 0.00 0.00 179.45 178.69 2ccg h PHE 159 N 0.00 0.85 0.00 -1.35 3.04 0.57 -1.90 116.94 118.15 2ccg h PHE 159 Ca -0.00 -0.35 -0.02 0.00 3.98 0.00 0.00 57.97 61.58 2ccg h PHE 159 Cb 1.13 -0.14 -0.00 0.00 2.56 0.00 0.00 35.95 39.50 2ccg h PHE 159 CO 0.00 1.14 -0.09 0.45 -2.02 0.00 0.00 178.31 177.79 2ccg h HIS 160 N 0.32 0.00 0.03 0.41 3.86 -1.26 -0.89 115.15 117.62 2ccg h HIS 160 Ca -0.02 0.00 -0.22 0.00 -1.16 0.00 0.00 60.37 58.97 2ccg h HIS 160 Cb 1.17 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.66 2ccg h HIS 160 CO 0.10 0.09 -0.87 0.93 0.86 0.00 0.00 177.93 179.04 2ccg h GLU 161 N 0.00 0.54 -0.93 2.45 5.08 -1.23 -3.02 114.58 117.46 2ccg h GLU 161 Ca -0.00 -0.62 0.01 0.00 -1.00 0.00 0.00 59.36 57.75 2ccg h GLU 161 Cb 0.19 0.18 -0.05 0.00 0.50 0.00 0.00 28.75 29.58 2ccg h GLU 161 CO 0.01 1.24 0.60 -0.22 -1.00 0.00 0.00 179.01 179.64 2ccg h LYS 162 N 0.11 1.24 -0.11 2.33 3.64 -0.56 -0.45 116.57 122.77 2ccg h LYS 162 Ca -0.12 -0.09 0.04 0.00 -1.27 0.00 0.00 60.65 59.21 2ccg h LYS 162 Cb 1.56 -0.27 -0.04 0.00 -0.41 0.00 0.00 32.23 33.07 2ccg h LYS 162 CO 0.17 0.83 -0.12 0.28 -2.27 0.00 0.00 179.45 178.35 2ccg h VAL 163 N 1.27 0.68 -0.72 2.00 2.07 -1.22 0.51 116.25 120.83 2ccg h VAL 163 Ca 0.34 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.90 2ccg h VAL 163 Cb -0.12 0.68 -0.05 0.00 -1.52 0.00 0.00 31.29 30.28 2ccg h VAL 163 CO -0.07 0.00 0.44 0.40 0.02 0.00 0.00 177.57 178.36 2ccg h ILE 164 N -0.14 1.07 -0.22 4.57 2.04 -1.30 0.22 117.51 123.75 2ccg h ILE 164 Ca 0.08 -0.29 0.01 0.00 1.00 0.00 0.00 64.86 65.66 2ccg h ILE 164 Cb 0.26 0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.47 2ccg h ILE 164 CO -0.20 0.15 0.10 -0.08 0.00 0.00 0.00 178.15 178.13 2ccg h GLU 165 N 0.85 0.22 -0.39 2.37 4.81 -0.41 0.70 114.58 122.73 2ccg h GLU 165 Ca 0.30 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.57 2ccg h GLU 165 Cb 0.07 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.35 2ccg h GLU 165 CO -0.13 0.14 0.09 0.78 -0.73 0.00 0.00 179.01 179.17 2ccg h GLY 166 N 0.22 0.47 0.94 1.92 0.00 0.12 -1.52 103.07 105.22 2ccg h GLY 166 Ca 0.09 -0.04 0.01 0.00 0.00 0.00 0.00 47.33 47.40 2ccg h GLY 166 CO -0.06 -0.02 0.32 -0.97 0.00 0.00 0.00 176.54 175.81 2ccg h TYR 167 N 0.23 0.60 -0.99 5.60 0.05 -0.07 -1.88 116.97 120.50 2ccg h TYR 167 Ca 0.18 0.02 0.14 0.00 0.05 0.00 0.00 58.73 59.12 2ccg h TYR 167 Cb 0.21 -0.20 -0.09 0.00 1.01 0.00 0.00 36.73 37.66 2ccg h TYR 167 CO -0.18 0.36 0.62 1.96 -1.05 0.00 0.00 178.16 179.87 2ccg h GLN 168 N 0.64 0.87 -0.09 4.88 1.08 -0.12 0.82 115.11 123.19 2ccg h GLN 168 Ca 0.19 -0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.33 2ccg h GLN 168 Cb -0.03 -0.20 -0.00 0.00 -0.05 0.00 0.00 27.48 27.20 2ccg h GLN 168 CO -0.07 0.58 0.00 0.93 -0.95 0.00 0.00 178.83 179.32 2ccg h GLU 169 N 0.90 0.15 -0.57 1.46 4.39 -0.56 -1.61 114.58 118.74 2ccg h GLU 169 Ca 0.52 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 60.12 2ccg h GLU 169 Cb 0.64 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.25 2ccg h GLU 169 CO -0.29 0.41 0.17 0.82 -1.16 0.00 0.00 179.01 178.96 2ccg h ILE 170 N -0.13 1.24 -0.00 3.13 2.04 -0.70 -2.63 117.51 120.47 2ccg h ILE 170 Ca 0.02 -0.83 -0.08 0.00 1.00 0.00 0.00 64.86 64.98 2ccg h ILE 170 Cb 0.34 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 2ccg h ILE 170 CO 0.00 0.31 -0.36 0.40 0.00 0.00 0.00 178.15 178.51 2ccg h ILE 171 N 0.80 1.26 0.65 -0.67 2.04 -0.89 -2.44 117.51 118.26 2ccg h ILE 171 Ca 0.18 -1.23 -0.03 0.00 1.00 0.00 0.00 64.86 64.78 2ccg h ILE 171 Cb 0.30 1.66 0.01 0.00 -0.74 0.00 0.00 36.82 38.05 2ccg h ILE 171 CO -0.00 0.35 -0.31 0.45 0.00 0.00 0.00 178.15 178.63 2ccg h HIS 172 N 0.00 -0.81 0.15 1.37 3.86 -0.93 -3.32 115.15 115.47 2ccg h HIS 172 Ca -0.00 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 2ccg h HIS 172 Cb 0.64 0.27 -0.01 0.00 1.06 0.00 0.00 27.41 29.37 2ccg h HIS 172 CO 0.00 -0.47 -0.11 -0.97 0.86 0.00 0.00 177.93 177.24 2ccg h ASN 173 N -1.10 -0.28 -3.34 2.45 -1.24 -1.46 -3.40 115.58 107.20 2ccg h ASN 173 Ca -0.09 0.02 -0.65 0.00 0.71 0.00 0.00 56.30 56.30 2ccg h ASN 173 Cb 0.71 0.09 -0.24 0.00 0.73 0.00 0.00 38.32 39.61 2ccg h ASN 173 CO 0.15 -0.18 -0.70 -1.61 -1.29 0.00 0.00 177.43 173.80 2ccg s GLU 174 N -6.15 3.55 0.00 6.67 2.02 -0.92 -4.87 118.70 119.00 2ccg s GLU 174 Ca -0.14 -0.58 0.00 0.00 0.02 0.00 0.00 54.97 54.27 2ccg s GLU 174 Cb 0.06 -2.88 0.00 0.00 0.10 0.00 0.00 34.13 31.41 2ccg s GLU 174 CO 0.65 0.14 0.70 -1.13 0.02 0.00 0.00 175.26 175.64 2ccg n SER 175 N 3.81 0.00 0.04 -0.19 3.41 -1.25 -4.19 113.62 115.25 2ccg n SER 175 Ca -0.18 -1.45 -0.19 0.00 -0.26 0.00 0.00 58.87 56.79 2ccg n SER 175 Cb 0.52 -0.09 -0.13 0.00 -0.26 0.00 0.00 64.21 64.25 2ccg n SER 175 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2ccg h GLN 176 N 0.00 0.38 0.00 4.33 4.20 -1.91 -3.33 115.11 118.78 2ccg h GLN 176 Ca 0.00 -0.52 0.00 0.00 0.06 0.00 0.00 58.65 58.19 2ccg h GLN 176 Cb 1.18 0.17 0.00 0.00 0.30 0.00 0.00 27.48 29.13 2ccg h GLN 176 CO 0.00 1.20 -1.26 2.89 -0.67 0.00 0.00 178.83 180.99 2ccg n ARG 177 N -4.13 0.58 -2.98 1.46 1.85 -1.26 -4.96 116.66 107.22 2ccg n ARG 177 Ca -0.12 -0.06 -0.40 0.00 -1.00 0.00 0.00 57.85 56.26 2ccg n ARG 177 Cb 0.78 -1.44 -0.05 0.00 -1.05 0.00 0.00 32.46 30.70 2ccg n ARG 177 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2ccg s PHE 178 N -3.03 3.72 -0.16 2.89 0.40 -1.25 -0.32 117.98 120.23 2ccg s PHE 178 Ca 0.02 1.46 -0.02 0.00 -0.60 0.00 0.00 56.93 57.79 2ccg s PHE 178 Cb 0.14 -2.83 0.05 0.00 0.51 0.00 0.00 43.02 40.89 2ccg s PHE 178 CO 0.81 0.25 0.01 0.21 0.70 0.00 0.00 175.22 177.19 2ccg s LYS 179 N 0.06 0.84 0.39 0.44 2.47 -0.69 -4.80 119.74 118.45 2ccg s LYS 179 Ca 0.39 -0.34 -0.08 0.00 -1.56 0.00 0.00 55.97 54.38 2ccg s LYS 179 Cb -0.20 -1.84 -0.05 0.00 -1.46 0.00 0.00 37.83 34.27 2ccg s LYS 179 CO 0.23 -0.52 0.71 0.45 0.16 0.00 0.00 175.35 176.38 2ccg s SER 180 N 1.82 6.45 0.01 1.43 0.15 -1.26 -1.88 113.70 120.42 2ccg s SER 180 Ca 0.01 0.96 0.01 0.00 0.70 0.00 0.00 55.95 57.63 2ccg s SER 180 Cb -0.16 -2.25 -0.01 0.00 -1.71 0.00 0.00 66.02 61.89 2ccg s SER 180 CO -0.07 -0.37 -0.03 -0.69 1.20 0.00 0.00 173.24 173.27 2ccg s VAL 181 N -2.36 0.19 -0.73 4.45 1.01 -0.09 -4.88 120.40 117.99 2ccg s VAL 181 Ca 0.48 -0.46 -0.26 0.00 0.00 0.00 0.00 61.98 61.73 2ccg s VAL 181 Cb -0.10 -0.23 0.04 0.00 0.00 0.00 0.00 36.38 36.08 2ccg s VAL 181 CO 0.33 -0.18 1.24 0.21 0.00 0.00 0.00 175.10 176.70 2ccg s ASN 182 N -0.68 6.16 0.00 3.32 3.84 -1.26 -0.34 114.94 125.98 2ccg s ASN 182 Ca -0.06 -0.52 0.18 0.00 0.21 0.00 0.00 52.86 52.68 2ccg s ASN 182 Cb -0.05 -2.54 0.91 0.00 -0.55 0.00 0.00 41.25 39.03 2ccg s ASN 182 CO -0.00 -1.78 1.61 0.00 -2.79 0.00 0.00 177.10 174.14 2ccg n ALA 183 N 9.15 2.57 0.56 1.71 0.00 -0.01 -3.39 120.51 131.10 2ccg n ALA 183 Ca 0.02 -0.27 0.13 0.00 0.00 0.00 0.00 53.44 53.32 2ccg n ALA 183 Cb 0.49 -1.20 0.35 0.00 0.00 0.00 0.00 19.45 19.08 2ccg n ALA 183 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2ccg h ASP 184 N 0.86 0.00 -4.24 0.00 3.45 -1.89 -3.44 116.42 111.17 2ccg h ASP 184 Ca 0.00 -0.02 -0.46 0.00 0.43 0.00 0.00 57.03 56.98 2ccg h ASP 184 Cb 0.19 0.00 0.13 0.00 -0.56 0.00 0.00 39.33 39.09 2ccg h ASP 184 CO 0.00 0.01 0.34 -1.10 -1.57 0.00 0.00 179.24 176.92 2ccg s GLN 185 N -3.12 1.05 0.59 3.56 -0.21 -1.22 -5.00 119.66 115.31 2ccg s GLN 185 Ca 0.10 0.06 -0.19 0.00 0.02 0.00 0.00 55.36 55.35 2ccg s GLN 185 Cb 0.11 -1.85 -0.04 0.00 1.00 0.00 0.00 33.01 32.24 2ccg s GLN 185 CO 0.62 -2.21 1.19 -2.14 -2.12 0.00 0.00 175.29 170.63 2ccg s PRO 186 N -5.51 3.00 0.49 2.91 0.02 -1.26 -4.75 135.00 129.90 2ccg s PRO 186 Ca 0.66 1.76 0.22 0.00 0.02 0.00 0.00 61.00 63.66 2ccg s PRO 186 Cb -0.11 -1.94 1.27 0.00 0.02 0.00 0.00 34.50 33.74 2ccg s PRO 186 CO 0.52 -1.16 1.96 -0.07 -0.33 0.00 0.00 177.00 177.92 2ccg h LEU 187 N 0.85 0.15 -1.29 -5.54 3.38 -1.94 -0.82 115.31 110.11 2ccg h LEU 187 Ca -0.50 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.46 2ccg h LEU 187 Cb 1.29 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 2ccg h LEU 187 CO 0.55 0.08 0.23 -0.33 0.09 0.00 0.00 178.44 179.05 2ccg h GLU 188 N 0.16 0.72 0.08 1.13 5.08 -2.00 -1.20 114.58 118.54 2ccg h GLU 188 Ca 0.31 -0.09 -0.27 0.00 -1.00 0.00 0.00 59.36 58.31 2ccg h GLU 188 Cb 1.00 -0.14 0.02 0.00 0.50 0.00 0.00 28.75 30.13 2ccg h GLU 188 CO -0.05 0.57 -1.14 -0.91 -1.00 0.00 0.00 179.01 176.48 2ccg h ASN 189 N 0.72 0.71 -0.96 1.42 2.35 -1.52 -2.66 115.58 115.64 2ccg h ASN 189 Ca 0.18 -0.64 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 2ccg h ASN 189 Cb 0.11 -0.22 -0.05 0.00 0.05 0.00 0.00 38.32 38.21 2ccg h ASN 189 CO -0.02 1.45 0.61 0.58 -1.65 0.00 0.00 177.43 178.40 2ccg h VAL 190 N 0.24 1.25 -0.19 2.81 2.07 -1.01 -0.90 116.25 120.53 2ccg h VAL 190 Ca -0.14 -0.50 -0.03 0.00 0.82 0.00 0.00 66.70 66.84 2ccg h VAL 190 Cb 1.81 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 2ccg h VAL 190 CO 0.21 0.26 -0.00 0.58 0.02 0.00 0.00 177.57 178.63 2ccg h VAL 191 N 1.31 1.25 -0.12 2.57 2.07 -1.22 -1.01 116.25 121.11 2ccg h VAL 191 Ca 0.35 -0.87 0.02 0.00 0.82 0.00 0.00 66.70 67.03 2ccg h VAL 191 Cb -0.11 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 2ccg h VAL 191 CO -0.07 0.26 -0.03 -0.08 0.02 0.00 0.00 177.57 177.67 2ccg h GLU 192 N 0.08 -0.00 -0.52 1.57 4.57 -1.19 0.30 114.58 119.39 2ccg h GLU 192 Ca 0.05 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.25 2ccg h GLU 192 Cb 0.39 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.95 2ccg h GLU 192 CO 0.01 -0.00 0.32 -0.44 -1.18 0.00 0.00 179.01 177.72 2ccg h ASP 193 N -0.00 0.53 -0.09 1.04 3.32 -1.14 0.15 116.42 120.23 2ccg h ASP 193 Ca 0.06 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2ccg h ASP 193 Cb 0.09 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.52 2ccg h ASP 193 CO -0.12 0.38 0.05 0.74 -1.72 0.00 0.00 179.24 178.57 2ccg h THR 194 N 0.65 1.09 -0.15 0.35 2.02 -0.81 -1.12 112.91 114.93 2ccg h THR 194 Ca 0.20 -0.24 0.04 0.00 0.77 0.00 0.00 66.41 67.18 2ccg h THR 194 Cb -0.02 1.09 -0.05 0.00 -1.74 0.00 0.00 68.15 67.43 2ccg h THR 194 CO -0.07 0.08 -0.15 0.22 0.37 0.00 0.00 175.52 175.96 2ccg h TYR 195 N 0.05 -0.38 -0.54 3.16 5.03 0.00 -1.98 116.97 122.31 2ccg h TYR 195 Ca 0.03 0.02 0.06 0.00 2.58 0.00 0.00 58.73 61.43 2ccg h TYR 195 Cb 0.08 0.19 -0.05 0.00 1.55 0.00 0.00 36.73 38.50 2ccg h TYR 195 CO -0.04 -0.22 0.25 1.96 -1.32 0.00 0.00 178.16 178.78 2ccg h GLN 196 N -0.18 0.46 -0.86 1.82 1.08 -0.79 -0.24 115.11 116.41 2ccg h GLN 196 Ca 0.10 -0.03 0.09 0.00 -1.45 0.00 0.00 58.65 57.37 2ccg h GLN 196 Cb 0.33 -0.10 -0.07 0.00 -0.05 0.00 0.00 27.48 27.58 2ccg h GLN 196 CO -0.26 0.30 0.50 1.15 -0.95 0.00 0.00 178.83 179.58 2ccg h THR 197 N 0.47 0.93 -0.04 -0.54 2.02 -0.79 -0.87 112.91 114.10 2ccg h THR 197 Ca 0.25 -0.29 -0.21 0.00 0.77 0.00 0.00 66.41 66.93 2ccg h THR 197 Cb 0.21 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.63 2ccg h THR 197 CO -0.20 0.15 -0.86 0.40 0.37 0.00 0.00 175.52 175.38 2ccg h ILE 198 N 0.85 1.38 -0.61 3.11 2.04 -0.60 -2.82 117.51 120.85 2ccg h ILE 198 Ca 0.41 -2.29 -0.09 0.00 1.00 0.00 0.00 64.86 63.88 2ccg h ILE 198 Cb 0.35 2.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.68 2ccg h ILE 198 CO -0.24 0.69 0.02 0.40 0.00 0.00 0.00 178.15 179.03 2ccg h ILE 199 N 0.28 1.27 -0.18 -0.67 1.08 -0.62 -1.37 117.51 117.29 2ccg h ILE 199 Ca -0.06 -1.12 0.01 0.00 -0.39 0.00 0.00 64.86 63.30 2ccg h ILE 199 Cb 1.47 0.78 -0.01 0.00 -3.07 0.00 0.00 36.82 35.99 2ccg h ILE 199 CO 0.15 0.41 0.09 0.11 -0.69 0.00 0.00 178.15 178.22 2ccg h LYS 200 N 0.96 0.19 -0.41 2.37 1.57 -1.18 -1.97 116.57 118.11 2ccg h LYS 200 Ca 0.18 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 2ccg h LYS 200 Cb 0.53 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 2ccg h LYS 200 CO 0.03 0.12 0.20 -0.92 -0.57 0.00 0.00 179.45 178.31 2ccg h TYR 201 N 0.19 0.55 -0.04 -1.35 3.20 -1.31 -1.64 116.97 116.56 2ccg h TYR 201 Ca 0.07 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.93 2ccg h TYR 201 Cb 0.01 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.11 2ccg h TYR 201 CO -0.09 0.40 0.00 1.28 -1.64 0.00 0.00 178.16 178.11 2ccg n LEU 202 N -4.41 0.45 0.01 2.82 4.77 -0.53 -4.26 117.00 115.85 2ccg n LEU 202 Ca 0.03 -0.19 -0.03 0.00 -0.03 0.00 0.00 56.01 55.79 2ccg n LEU 202 Cb 0.11 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.17 2ccg n LEU 202 CO 0.36 0.09 -0.27 -0.62 -1.33 0.00 0.00 177.39 175.62 2ccg n GLU 203 N -0.49 0.13 0.00 3.23 -0.58 -0.66 -5.05 120.64 117.22 2ccg n GLU 203 Ca 0.14 0.05 0.00 0.00 -0.42 0.00 0.00 57.16 56.94 2ccg n GLU 203 Cb 0.14 -0.72 0.00 0.00 -0.57 0.00 0.00 31.44 30.28 2ccg n GLU 203 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82