#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c1d s PRO 28 N 0.00 4.36 0.46 -0.24 0.04 -1.26 -4.90 135.00 133.45 2c1d s PRO 28 Ca 0.00 2.08 -0.23 0.00 0.04 0.00 0.00 61.00 62.89 2c1d s PRO 28 Cb 0.00 -3.21 -0.08 0.00 0.04 0.00 0.00 34.50 31.26 2c1d s PRO 28 CO 0.00 -0.33 1.12 0.54 0.04 0.00 0.00 177.00 178.37 2c1d s VAL 29 N 0.43 3.33 -0.41 -0.36 0.11 -0.77 -4.99 120.40 117.73 2c1d s VAL 29 Ca 0.59 0.97 -0.29 0.00 -2.93 0.00 0.00 61.98 60.32 2c1d s VAL 29 Cb -0.37 -3.47 0.02 0.00 -1.53 0.00 0.00 36.38 31.03 2c1d s VAL 29 CO 0.36 -0.04 1.19 -0.70 -3.33 0.00 0.00 175.10 172.57 2c1d s GLU 30 N -2.76 3.81 0.18 1.54 2.56 -1.26 -4.95 118.70 117.82 2c1d s GLU 30 Ca 0.63 0.83 -0.24 0.00 0.00 0.00 0.00 54.97 56.20 2c1d s GLU 30 Cb -0.25 -3.88 0.05 0.00 2.00 0.00 0.00 34.13 32.05 2c1d s GLU 30 CO 0.31 -1.26 0.80 0.34 -0.56 0.00 0.00 175.26 174.88 2c1d s ASP 31 N 2.53 -0.30 0.05 -1.70 -1.08 -1.26 -5.18 116.67 109.72 2c1d s ASP 31 Ca 0.50 -0.36 0.04 0.00 -0.52 0.00 0.00 52.55 52.22 2c1d s ASP 31 Cb -0.10 0.59 -0.02 0.00 -1.46 0.00 0.00 42.92 41.92 2c1d s ASP 31 CO 0.27 -1.05 -0.12 -0.83 0.52 0.00 0.00 175.17 173.96 2c1d s GLY 32 N -2.84 0.72 -0.22 2.66 0.00 -1.26 -5.04 107.32 101.34 2c1d s GLY 32 Ca 0.09 -0.83 0.01 0.00 0.00 0.00 0.00 44.72 43.98 2c1d s GLY 32 CO -0.00 -0.84 -0.13 -2.27 0.00 0.00 0.00 173.10 169.85 2c1d s LEU 33 N -1.37 2.79 -0.14 0.66 2.96 -1.26 -5.07 118.68 117.26 2c1d s LEU 33 Ca -0.02 -0.91 -0.01 0.00 -0.22 0.00 0.00 54.13 52.97 2c1d s LEU 33 Cb -0.09 -1.56 0.04 0.00 0.50 0.00 0.00 46.19 45.09 2c1d s LEU 33 CO 0.01 -0.09 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.24 2c1d s VAL 34 N 1.25 0.79 -0.09 1.68 1.01 -1.26 -1.70 120.40 122.08 2c1d s VAL 34 Ca -0.00 -0.38 -0.23 0.00 0.00 0.00 0.00 61.98 61.37 2c1d s VAL 34 Cb -0.16 -1.01 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 2c1d s VAL 34 CO -0.08 0.13 0.67 -0.63 0.00 0.00 0.00 175.10 175.19 2c1d s ILE 35 N 1.77 5.05 -0.03 2.22 1.01 -0.12 -4.80 121.20 126.30 2c1d s ILE 35 Ca 0.02 1.37 -0.30 0.00 0.00 0.00 0.00 60.65 61.74 2c1d s ILE 35 Cb -0.14 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.28 2c1d s ILE 35 CO -0.07 0.23 1.17 -1.61 0.00 0.00 0.00 174.94 174.66 2c1d s GLU 36 N 0.99 4.39 0.40 2.79 2.02 -0.02 -1.26 118.70 128.01 2c1d s GLU 36 Ca 0.35 1.66 0.05 0.00 0.02 0.00 0.00 54.97 57.05 2c1d s GLU 36 Cb -0.17 -3.50 -0.02 0.00 0.10 0.00 0.00 34.13 30.53 2c1d s GLU 36 CO 0.16 -0.37 0.18 0.95 0.02 0.00 0.00 175.26 176.20 2c1d s THR 37 N 1.86 0.38 0.12 3.63 -4.23 -1.18 -1.75 115.64 114.46 2c1d s THR 37 Ca 0.56 -2.00 0.33 0.00 -1.18 0.00 0.00 61.69 59.39 2c1d s THR 37 Cb -0.25 -2.35 0.37 0.00 1.34 0.00 0.00 72.50 71.61 2c1d s THR 37 CO 0.24 0.00 1.97 0.44 -0.54 0.00 0.00 174.62 176.73 2c1d h ASP 38 N 1.84 0.00 -0.01 3.99 3.45 -2.01 -3.08 116.42 120.60 2c1d h ASP 38 Ca -0.32 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.14 2c1d h ASP 38 Cb 1.26 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 40.03 2c1d h ASP 38 CO 0.49 0.03 -0.43 -1.54 -1.57 0.00 0.00 179.24 176.23 2c1d n SER 39 N -3.14 1.81 0.00 6.45 3.41 -1.26 -5.11 113.62 115.79 2c1d n SER 39 Ca 0.00 -3.81 0.00 0.00 -0.26 0.00 0.00 58.87 54.81 2c1d n SER 39 Cb 0.32 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 2c1d n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2c1d n GLY 40 N -1.16 1.14 3.76 5.00 0.00 -1.16 -5.00 105.19 107.77 2c1d n GLY 40 Ca 0.19 -2.12 -0.41 0.00 0.00 0.00 0.00 46.02 43.68 2c1d n GLY 40 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2c1d s PRO 41 N -1.50 4.19 -0.16 1.61 0.04 -1.26 -3.13 135.00 134.80 2c1d s PRO 41 Ca 0.00 2.44 0.01 0.00 0.04 0.00 0.00 61.00 63.49 2c1d s PRO 41 Cb 0.00 -3.04 0.03 0.00 0.04 0.00 0.00 34.50 31.53 2c1d s PRO 41 CO 0.00 -0.47 -0.14 0.54 0.04 0.00 0.00 177.00 176.96 2c1d s VAL 42 N -0.54 1.65 0.20 -0.36 0.11 -0.39 -4.95 120.40 116.12 2c1d s VAL 42 Ca 0.57 -0.74 -0.30 0.00 -2.93 0.00 0.00 61.98 58.58 2c1d s VAL 42 Cb -0.45 -1.57 -0.08 0.00 -1.53 0.00 0.00 36.38 32.75 2c1d s VAL 42 CO 0.52 0.42 1.23 -1.61 -3.33 0.00 0.00 175.10 172.33 2c1d s GLU 43 N 1.44 4.46 -0.20 1.54 2.02 -1.26 -0.95 118.70 125.76 2c1d s GLU 43 Ca 0.04 1.94 -0.02 0.00 0.02 0.00 0.00 54.97 56.95 2c1d s GLU 43 Cb -0.13 -3.22 -0.00 0.00 0.10 0.00 0.00 34.13 30.88 2c1d s GLU 43 CO -0.11 -0.13 -0.10 0.42 0.02 0.00 0.00 175.26 175.37 2c1d s ILE 44 N -0.10 2.95 -0.36 -1.63 -1.09 -0.69 -4.60 121.20 115.68 2c1d s ILE 44 Ca 0.53 -0.64 -0.29 0.00 -2.23 0.00 0.00 60.65 58.02 2c1d s ILE 44 Cb -0.34 -2.31 0.00 0.00 -1.58 0.00 0.00 42.46 38.23 2c1d s ILE 44 CO 0.38 0.47 1.42 -0.69 -1.23 0.00 0.00 174.94 175.29 2c1d s VAL 45 N 1.32 3.92 -1.55 2.92 1.01 -1.26 -4.43 120.40 122.33 2c1d s VAL 45 Ca 0.04 0.98 0.13 0.00 0.00 0.00 0.00 61.98 63.13 2c1d s VAL 45 Cb -0.14 -4.11 0.09 0.00 0.00 0.00 0.00 36.38 32.22 2c1d s VAL 45 CO -0.05 -0.62 0.89 0.35 0.00 0.00 0.00 175.10 175.66 2c1d n THR 46 N 6.80 0.00 -3.68 3.92 -2.24 -1.26 -1.77 114.28 116.05 2c1d n THR 46 Ca 0.17 -0.49 -0.09 0.00 -2.27 0.00 0.00 64.05 61.36 2c1d n THR 46 Cb 0.47 1.26 -0.10 0.00 -2.10 0.00 0.00 70.33 69.86 2c1d n THR 46 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2c1d s LYS 47 N -1.09 0.45 0.18 -0.78 2.20 -1.26 -1.02 119.74 118.42 2c1d s LYS 47 Ca 0.14 0.94 -0.24 0.00 -0.36 0.00 0.00 55.97 56.46 2c1d s LYS 47 Cb 0.10 0.11 0.06 0.00 -1.51 0.00 0.00 37.83 36.59 2c1d s LYS 47 CO 0.17 -0.17 0.92 -0.08 -0.36 0.00 0.00 175.35 175.83 2c1d s THR 48 N 1.72 0.00 0.41 3.43 -1.32 -0.74 -5.02 115.64 114.12 2c1d s THR 48 Ca -0.08 -0.72 -0.25 0.00 -1.21 0.00 0.00 61.69 59.42 2c1d s THR 48 Cb -0.09 -2.03 -0.08 0.00 -1.51 0.00 0.00 72.50 68.79 2c1d s THR 48 CO -0.14 0.00 1.22 0.00 -2.21 0.00 0.00 174.62 173.48 2c1d s ALA 49 N -3.35 3.16 0.84 11.08 0.00 -1.26 -1.13 121.76 131.10 2c1d s ALA 49 Ca 0.12 1.06 -0.11 0.00 0.00 0.00 0.00 51.96 53.04 2c1d s ALA 49 Cb -0.02 -3.42 0.10 0.00 0.00 0.00 0.00 23.12 19.78 2c1d s ALA 49 CO 0.03 -0.66 1.09 -2.14 0.00 0.00 0.00 175.76 174.08 2c1d s PRO 50 N -2.33 1.67 0.79 0.00 0.02 -1.26 -4.72 135.00 129.17 2c1d s PRO 50 Ca 0.58 1.01 -0.12 0.00 0.02 0.00 0.00 61.00 62.48 2c1d s PRO 50 Cb -0.33 -1.84 0.07 0.00 0.02 0.00 0.00 34.50 32.42 2c1d s PRO 50 CO 0.42 -2.00 1.14 -1.25 -0.33 0.00 0.00 177.00 174.98 2c1d s PRO 51 N -4.90 1.92 0.35 5.54 0.04 -1.26 -4.80 135.00 131.88 2c1d s PRO 51 Ca 0.63 1.49 0.06 0.00 0.04 0.00 0.00 61.00 63.21 2c1d s PRO 51 Cb -0.18 -1.83 0.72 0.00 0.04 0.00 0.00 34.50 33.25 2c1d s PRO 51 CO 0.57 -1.95 1.94 0.00 0.04 0.00 0.00 177.00 177.60 2c1d h ALA 52 N -0.94 1.70 0.00 8.56 0.00 -1.97 0.00 119.26 126.61 2c1d h ALA 52 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2c1d h ALA 52 Cb 1.26 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2c1d h ALA 52 CO 0.48 0.16 0.00 0.27 0.00 0.00 0.00 179.25 180.16 2c1d h PHE 53 N 0.79 0.00 -0.49 0.00 -5.15 -1.99 -1.73 116.94 108.37 2c1d h PHE 53 Ca 0.35 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.12 2c1d h PHE 53 Cb 0.33 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.50 2c1d h PHE 53 CO -0.00 0.00 0.00 1.28 -2.00 0.00 0.00 178.31 177.59 2c1d n LEU 54 N -2.67 3.35 0.09 2.10 4.32 -0.02 -4.72 117.00 119.44 2c1d n LEU 54 Ca -0.01 -1.90 -0.00 0.00 -0.02 0.00 0.00 56.01 54.08 2c1d n LEU 54 Cb 0.14 -0.33 0.30 0.00 -1.62 0.00 0.00 43.42 41.91 2c1d n LEU 54 CO 0.18 0.82 0.78 0.00 -1.22 0.00 0.00 177.39 177.95 2c1d h ALA 55 N 3.18 1.30 -0.00 -1.18 0.00 -1.20 -0.84 119.26 120.52 2c1d h ALA 55 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2c1d h ALA 55 Cb 0.85 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2c1d h ALA 55 CO 0.00 0.47 -0.01 -3.47 0.00 0.00 0.00 179.25 176.25 2c1d n ASP 56 N -4.16 0.02 -0.14 0.00 2.03 -1.26 -4.29 116.55 108.76 2c1d n ASP 56 Ca -0.01 -0.20 -0.27 0.00 0.52 0.00 0.00 54.79 54.83 2c1d n ASP 56 Cb 0.36 -0.26 -0.11 0.00 -0.72 0.00 0.00 41.12 40.40 2c1d n ASP 56 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2c1d n THR 57 N -1.26 1.52 -4.48 5.18 -1.04 -0.38 -4.99 114.28 108.84 2c1d n THR 57 Ca 0.15 -0.43 -0.23 0.00 -2.04 0.00 0.00 64.05 61.50 2c1d n THR 57 Cb 0.24 -1.78 -0.14 0.00 -1.82 0.00 0.00 70.33 66.84 2c1d n THR 57 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2c1d s PHE 58 N -2.51 1.59 0.14 -1.42 0.08 -0.86 -5.01 117.98 110.00 2c1d s PHE 58 Ca -0.38 -0.37 -0.02 0.00 0.12 0.00 0.00 56.93 56.28 2c1d s PHE 58 Cb 0.13 -0.94 -0.07 0.00 -0.57 0.00 0.00 43.02 41.58 2c1d s PHE 58 CO 0.52 0.09 1.33 -0.44 -0.10 0.00 0.00 175.22 176.61 2c1d h ASP 59 N 4.77 0.43 -3.73 1.36 3.45 -1.88 -3.42 116.42 117.41 2c1d h ASP 59 Ca -0.41 -0.35 -0.15 0.00 0.43 0.00 0.00 57.03 56.55 2c1d h ASP 59 Cb 1.17 -0.13 -0.26 0.00 -0.56 0.00 0.00 39.33 39.55 2c1d h ASP 59 CO 0.43 1.15 -0.37 -0.89 -1.57 0.00 0.00 179.24 177.99 2c1d s THR 60 N -3.24 -0.01 0.08 0.35 2.01 -1.26 -4.42 115.64 109.16 2c1d s THR 60 Ca -0.05 0.03 -0.04 0.00 0.31 0.00 0.00 61.69 61.94 2c1d s THR 60 Cb 0.09 -0.44 -0.05 0.00 0.01 0.00 0.00 72.50 72.11 2c1d s THR 60 CO 0.85 0.01 0.30 0.27 -0.69 0.00 0.00 174.62 175.36 2c1d s ILE 61 N 0.42 5.27 0.01 1.82 -4.36 -0.28 -4.90 121.20 119.17 2c1d s ILE 61 Ca -0.02 -0.06 0.01 0.00 -0.26 0.00 0.00 60.65 60.32 2c1d s ILE 61 Cb -0.04 -3.61 -0.01 0.00 1.25 0.00 0.00 42.46 40.05 2c1d s ILE 61 CO -0.02 0.15 -0.04 -0.31 0.24 0.00 0.00 174.94 174.96 2c1d s TYR 62 N -1.52 0.38 0.58 1.37 1.51 -1.26 -1.79 117.35 116.62 2c1d s TYR 62 Ca 0.36 -0.18 -0.19 0.00 -1.01 0.00 0.00 57.07 56.04 2c1d s TYR 62 Cb -0.13 -0.24 -0.04 0.00 -0.11 0.00 0.00 41.96 41.44 2c1d s TYR 62 CO 0.24 -0.04 1.23 0.45 -1.11 0.00 0.00 175.55 176.32 2c1d s SER 63 N -0.48 5.23 0.63 2.29 0.15 -0.19 -4.68 113.70 116.65 2c1d s SER 63 Ca -0.02 2.45 0.33 0.00 0.70 0.00 0.00 55.95 59.40 2c1d s SER 63 Cb -0.04 -2.61 1.80 0.00 -1.71 0.00 0.00 66.02 63.47 2c1d s SER 63 CO -0.00 -1.57 2.08 1.23 1.20 0.00 0.00 173.24 176.17 2c1d h GLY 64 N 1.02 0.00 0.22 9.45 0.00 -1.91 -2.48 103.07 109.38 2c1d h GLY 64 Ca -0.50 0.00 0.18 0.00 0.00 0.00 0.00 47.33 47.00 2c1d h GLY 64 CO 0.56 0.00 0.61 -0.25 0.00 0.00 0.00 176.54 177.46 2c1d h TRP 65 N 0.00 0.99 0.00 5.60 7.01 -1.91 -1.90 115.95 125.73 2c1d h TRP 65 Ca 0.05 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.07 2c1d h TRP 65 Cb 0.51 -0.30 -0.00 0.00 -2.10 0.00 0.00 29.16 27.27 2c1d h TRP 65 CO 0.00 0.26 -0.03 0.45 -2.79 0.00 0.00 178.44 176.33 2c1d h HIS 66 N 0.74 0.00 -0.42 2.65 3.86 -1.79 -2.42 115.15 117.78 2c1d h HIS 66 Ca 0.54 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.75 2c1d h HIS 66 Cb 0.87 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.34 2c1d h HIS 66 CO -0.00 0.03 0.00 1.19 0.86 0.00 0.00 177.93 180.00 2c1d n PHE 67 N -3.28 0.54 -3.39 2.45 3.01 -0.72 -1.86 117.46 114.21 2c1d n PHE 67 Ca -0.02 -0.27 -0.24 0.00 1.01 0.00 0.00 57.45 57.93 2c1d n PHE 67 Cb 0.16 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.62 2c1d n PHE 67 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2c1d s ARG 68 N -1.46 3.50 0.85 -1.08 1.81 -0.91 -4.76 118.95 116.88 2c1d s ARG 68 Ca 0.40 -0.32 -0.11 0.00 -1.72 0.00 0.00 55.73 53.98 2c1d s ARG 68 Cb 0.23 -2.67 0.10 0.00 -0.45 0.00 0.00 34.95 32.16 2c1d s ARG 68 CO 0.32 0.16 1.09 0.16 -0.68 0.00 0.00 175.30 176.36 2c1d s ASP 69 N -3.94 3.98 0.31 0.23 1.47 -1.26 -4.76 116.67 112.70 2c1d s ASP 69 Ca 0.40 1.41 0.02 0.00 1.18 0.00 0.00 52.55 55.56 2c1d s ASP 69 Cb -0.10 -2.11 0.52 0.00 -0.34 0.00 0.00 42.92 40.89 2c1d s ASP 69 CO 0.35 -2.31 1.85 -0.78 0.68 0.00 0.00 175.17 174.96 2c1d h ASP 70 N -1.32 0.59 -0.14 2.11 3.58 -1.98 -0.78 116.42 118.47 2c1d h ASP 70 Ca -0.48 -0.11 -0.06 0.00 0.42 0.00 0.00 57.03 56.79 2c1d h ASP 70 Cb 1.28 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 42.16 2c1d h ASP 70 CO 0.57 0.64 -0.10 0.77 -2.88 0.00 0.00 179.24 178.24 2c1d h SER 71 N 0.60 0.45 0.02 2.28 4.64 -1.99 0.22 113.55 119.77 2c1d h SER 71 Ca 0.13 -0.11 -0.26 0.00 -0.47 0.00 0.00 61.79 61.08 2c1d h SER 71 Cb 0.34 -0.12 0.02 0.00 -0.31 0.00 0.00 62.40 62.33 2c1d h SER 71 CO 0.01 0.59 -1.03 0.74 -0.87 0.00 0.00 176.83 176.27 2c1d h THR 72 N 0.44 1.30 -0.92 2.95 2.02 -1.72 -3.17 112.91 113.81 2c1d h THR 72 Ca 0.09 -2.27 0.07 0.00 0.77 0.00 0.00 66.41 65.07 2c1d h THR 72 Cb 0.44 2.47 -0.06 0.00 -1.74 0.00 0.00 68.15 69.26 2c1d h THR 72 CO 0.02 0.69 0.60 0.03 0.37 0.00 0.00 175.52 177.24 2c1d h ARG 73 N 0.31 1.02 -0.05 6.66 3.08 -0.86 -1.81 114.38 122.74 2c1d h ARG 73 Ca -0.14 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 59.81 2c1d h ARG 73 Cb 1.69 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 31.50 2c1d h ARG 73 CO 0.20 0.68 -0.17 -0.44 -1.07 0.00 0.00 179.97 179.16 2c1d h ASP 74 N 1.05 0.07 0.26 7.04 3.45 -0.94 -2.29 116.42 125.06 2c1d h ASP 74 Ca 0.40 -0.01 -0.00 0.00 0.43 0.00 0.00 57.03 57.84 2c1d h ASP 74 Cb 0.20 -0.02 -0.00 0.00 -0.56 0.00 0.00 39.33 38.95 2c1d h ASP 74 CO -0.15 0.25 -0.01 -0.07 -1.57 0.00 0.00 179.24 177.69 2c1d h LEU 75 N 0.07 0.00 0.00 1.55 3.38 -1.30 -2.10 115.31 116.91 2c1d h LEU 75 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2c1d h LEU 75 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2c1d h LEU 75 CO 0.02 0.01 -0.91 1.21 0.09 0.00 0.00 178.44 178.87 2c1d n GLU 76 N -3.21 0.09 0.26 1.13 2.13 -0.86 -3.28 120.64 116.90 2c1d n GLU 76 Ca -0.02 -0.01 0.16 0.00 0.66 0.00 0.00 57.16 57.95 2c1d n GLU 76 Cb 0.14 -1.52 0.60 0.00 0.27 0.00 0.00 31.44 30.93 2c1d n GLU 76 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2c1d h ARG 77 N 0.00 0.00 -2.64 5.31 3.08 -1.39 -3.44 114.38 115.30 2c1d h ARG 77 Ca 0.00 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.95 2c1d h ARG 77 Cb 0.57 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 30.41 2c1d h ARG 77 CO 0.00 0.00 -0.13 0.16 -1.07 0.00 0.00 179.97 178.93 2c1d s ASP 78 N -5.71 -0.41 0.46 7.04 -4.77 -1.26 -0.83 116.67 111.19 2c1d s ASP 78 Ca 0.02 0.57 0.13 0.00 -3.30 0.00 0.00 52.55 49.98 2c1d s ASP 78 Cb 0.08 0.63 1.05 0.00 -1.09 0.00 0.00 42.92 43.59 2c1d s ASP 78 CO 0.56 -0.37 2.05 0.44 0.70 0.00 0.00 175.17 178.55 2c1d h ASP 79 N 4.31 0.10 -0.96 2.11 3.32 -1.63 -1.87 116.42 121.79 2c1d h ASP 79 Ca -0.28 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 56.78 2c1d h ASP 79 Cb 1.17 -0.02 -0.05 0.00 0.22 0.00 0.00 39.33 40.64 2c1d h ASP 79 CO 0.32 0.16 0.63 0.15 -1.72 0.00 0.00 179.24 178.79 2c1d h PHE 80 N 0.11 1.20 0.00 4.55 3.57 -1.96 -3.04 116.94 121.36 2c1d h PHE 80 Ca 0.03 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.55 2c1d h PHE 80 Cb 0.16 -0.40 0.00 0.00 2.79 0.00 0.00 35.95 38.50 2c1d h PHE 80 CO 0.00 0.73 -0.73 -0.25 -2.23 0.00 0.00 178.31 175.83 2c1d n ASP 81 N -4.44 0.63 -4.60 0.41 8.00 -0.75 -4.88 116.55 110.92 2c1d n ASP 81 Ca 0.12 -0.31 -0.43 0.00 0.71 0.00 0.00 54.79 54.87 2c1d n ASP 81 Cb 0.04 0.50 -0.02 0.00 -0.02 0.00 0.00 41.12 41.62 2c1d n ASP 81 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2c1d s ASN 82 N -3.38 6.65 0.61 -2.24 3.04 -0.89 -4.87 114.94 113.85 2c1d s ASN 82 Ca 0.08 0.54 0.39 0.00 0.04 0.00 0.00 52.86 53.91 2c1d s ASN 82 Cb 0.16 -2.55 1.95 0.00 -1.54 0.00 0.00 41.25 39.27 2c1d s ASN 82 CO 0.76 -1.23 2.20 -0.65 -3.04 0.00 0.00 177.10 175.14 2c1d h PRO 83 N 9.19 0.00 0.00 0.43 0.11 -1.88 -2.16 132.00 137.69 2c1d h PRO 83 Ca -0.23 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.86 2c1d h PRO 83 Cb 1.06 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2c1d h PRO 83 CO 1.12 0.01 -0.09 0.00 -0.21 0.00 0.00 178.00 178.83 2c1d h ALA 84 N 1.99 1.33 0.00 -0.75 0.00 -1.90 -3.04 119.26 116.89 2c1d h ALA 84 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2c1d h ALA 84 Cb 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2c1d h ALA 84 CO 0.00 0.11 0.00 0.52 0.00 0.00 0.00 179.25 179.88 2c1d h MET 85 N 0.00 0.00 -0.93 0.00 2.86 -1.70 -0.90 114.93 114.26 2c1d h MET 85 Ca -0.00 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2c1d h MET 85 Cb 0.25 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.86 2c1d h MET 85 CO 0.01 0.00 0.62 0.28 1.06 0.00 0.00 176.91 178.88 2c1d h VAL 86 N 0.00 1.24 0.00 -2.22 2.07 -1.74 -1.32 116.25 114.28 2c1d h VAL 86 Ca 0.00 -0.43 -0.17 0.00 0.82 0.00 0.00 66.70 66.92 2c1d h VAL 86 Cb 0.46 -0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.07 2c1d h VAL 86 CO 0.00 0.23 -1.00 -0.26 0.02 0.00 0.00 177.57 176.56 2c1d h PHE 87 N 1.26 0.00 -0.25 1.57 -1.00 -1.37 -2.13 116.94 115.01 2c1d h PHE 87 Ca 0.34 0.00 0.01 0.00 2.81 0.00 0.00 57.97 61.13 2c1d h PHE 87 Cb -0.14 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.40 2c1d h PHE 87 CO -0.01 0.72 0.15 0.28 -1.61 0.00 0.00 178.31 177.84 2c1d h VAL 88 N 0.00 1.03 -0.64 -0.55 2.07 -1.34 -0.59 116.25 116.23 2c1d h VAL 88 Ca -0.08 -0.10 -0.07 0.00 0.82 0.00 0.00 66.70 67.27 2c1d h VAL 88 Cb 1.62 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 32.06 2c1d h VAL 88 CO 0.08 0.05 0.12 -0.78 0.02 0.00 0.00 177.57 177.06 2c1d h ASP 89 N 0.30 0.98 -0.18 0.57 3.58 -1.15 -1.46 116.42 119.05 2c1d h ASP 89 Ca 0.10 -0.22 -0.10 0.00 0.42 0.00 0.00 57.03 57.23 2c1d h ASP 89 Cb -0.01 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 40.77 2c1d h ASP 89 CO -0.04 0.97 -0.20 -0.09 -2.88 0.00 0.00 179.24 176.99 2c1d h ARG 90 N 0.97 0.62 -0.98 0.28 2.43 -1.35 -1.69 114.38 114.66 2c1d h ARG 90 Ca 0.20 -0.22 0.06 0.00 -0.81 0.00 0.00 59.98 59.20 2c1d h ARG 90 Cb 0.40 -0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 29.84 2c1d h ARG 90 CO 0.01 0.78 0.64 0.78 -1.51 0.00 0.00 179.97 180.66 2c1d h GLY 91 N 0.99 1.46 1.46 2.80 0.00 -0.53 -1.61 103.07 107.64 2c1d h GLY 91 Ca 0.09 -0.47 -0.12 0.00 0.00 0.00 0.00 47.33 46.82 2c1d h GLY 91 CO 0.05 0.36 -0.34 -2.00 0.00 0.00 0.00 176.54 174.60 2c1d h LEU 92 N 1.17 0.64 -0.65 3.11 5.85 -0.52 0.08 115.31 124.99 2c1d h LEU 92 Ca 0.41 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 2c1d h LEU 92 Cb 0.13 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 2c1d h LEU 92 CO -0.15 0.93 0.33 0.44 -0.34 0.00 0.00 178.44 179.64 2c1d h ASP 93 N 0.52 0.83 0.38 1.25 3.32 -0.93 -2.22 116.42 119.57 2c1d h ASP 93 Ca 0.06 -0.11 -0.13 0.00 0.02 0.00 0.00 57.03 56.87 2c1d h ASP 93 Cb 0.83 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 2c1d h ASP 93 CO 0.07 0.71 -0.53 0.11 -1.72 0.00 0.00 179.24 177.87 2c1d h LYS 94 N 0.89 0.17 -0.63 3.56 1.57 -0.87 -1.29 116.57 119.97 2c1d h LYS 94 Ca 0.22 -0.10 -0.05 0.00 -1.87 0.00 0.00 60.65 58.86 2c1d h LYS 94 Cb 0.08 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 2c1d h LYS 94 CO -0.03 0.66 0.21 2.35 -0.57 0.00 0.00 179.45 182.07 2c1d h TRP 95 N 0.13 0.97 -0.00 -1.35 2.91 -0.74 -2.82 115.95 115.05 2c1d h TRP 95 Ca 0.00 -0.08 0.00 0.00 1.13 0.00 0.00 58.89 59.94 2c1d h TRP 95 Cb 0.99 -0.29 0.00 0.00 -0.51 0.00 0.00 29.16 29.35 2c1d h TRP 95 CO 0.01 0.77 -0.32 0.09 -1.03 0.00 0.00 178.44 177.96 2c1d n ASN 96 N -4.28 0.54 -4.74 2.65 3.02 -0.86 -2.18 115.26 109.41 2c1d n ASN 96 Ca 0.05 -0.33 -0.40 0.00 -0.03 0.00 0.00 54.58 53.87 2c1d n ASN 96 Cb 0.20 0.07 -0.05 0.00 -0.61 0.00 0.00 39.78 39.39 2c1d n ASN 96 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2c1d s ALA 97 N -2.81 3.33 -1.19 5.41 0.00 -0.52 -4.91 121.76 121.06 2c1d s ALA 97 Ca 0.17 0.45 -0.17 0.00 0.00 0.00 0.00 51.96 52.40 2c1d s ALA 97 Cb 0.18 -3.13 -0.04 0.00 0.00 0.00 0.00 23.12 20.14 2c1d s ALA 97 CO 0.60 0.07 2.08 0.00 0.00 0.00 0.00 175.76 178.52 2c1d n ALA 98 N 2.49 4.51 0.94 0.00 0.00 -1.26 -4.22 120.51 122.97 2c1d n ALA 98 Ca -0.01 -3.64 0.12 0.00 0.00 0.00 0.00 53.44 49.91 2c1d n ALA 98 Cb 0.49 -3.58 0.15 0.00 0.00 0.00 0.00 19.45 16.52 2c1d n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c1d n MET 99 N 6.62 2.30 -1.43 0.00 0.00 -0.92 -4.58 117.12 119.11 2c1d n MET 99 Ca 0.51 -1.90 -0.29 0.00 0.00 0.00 0.00 57.70 56.02 2c1d n MET 99 Cb 0.40 -1.47 0.13 0.00 0.00 0.00 0.00 33.22 32.28 2c1d n MET 99 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2c1d s GLY 100 N -1.92 1.60 0.26 3.17 0.00 -0.24 -4.90 107.32 105.28 2c1d s GLY 100 Ca 0.30 -0.32 -0.03 0.00 0.00 0.00 0.00 44.72 44.68 2c1d s GLY 100 CO 0.30 0.19 1.81 -0.39 0.00 0.00 0.00 173.10 175.02 2c1d h VAL 101 N -1.44 1.23 -0.69 1.40 -1.51 -1.50 -1.80 116.25 111.95 2c1d h VAL 101 Ca -0.50 -0.82 -0.22 0.00 -1.23 0.00 0.00 66.70 63.93 2c1d h VAL 101 Cb 1.30 0.58 -0.13 0.00 -2.13 0.00 0.00 31.29 30.91 2c1d h VAL 101 CO 0.59 0.31 0.28 0.59 -1.23 0.00 0.00 177.57 178.12 2c1d n ASN 102 N -4.27 4.49 -0.07 4.19 3.02 -1.26 -4.92 115.26 116.44 2c1d n ASN 102 Ca 0.05 -3.12 -0.01 0.00 -0.03 0.00 0.00 54.58 51.47 2c1d n ASN 102 Cb 0.22 -0.73 -0.00 0.00 -0.61 0.00 0.00 39.78 38.65 2c1d n ASN 102 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2c1d n GLY 103 N -0.17 0.48 3.77 7.41 0.00 -0.67 -5.02 105.19 110.98 2c1d n GLY 103 Ca 0.38 -0.69 -0.39 0.00 0.00 0.00 0.00 46.02 45.33 2c1d n GLY 103 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c1d s GLU 104 N -1.46 3.96 0.26 1.61 8.01 -1.26 -4.54 118.70 125.28 2c1d s GLU 104 Ca 0.00 1.97 0.09 0.00 0.01 0.00 0.00 54.97 57.04 2c1d s GLU 104 Cb 0.00 -2.67 -0.05 0.00 -4.31 0.00 0.00 34.13 27.09 2c1d s GLU 104 CO 0.00 -0.44 -0.12 -1.54 0.01 0.00 0.00 175.26 173.17 2c1d s SER 105 N -0.99 2.99 0.18 -0.19 1.04 -1.26 -1.08 113.70 114.39 2c1d s SER 105 Ca 0.58 -1.10 -0.15 0.00 0.48 0.00 0.00 55.95 55.76 2c1d s SER 105 Cb -0.34 -0.21 0.15 0.00 0.10 0.00 0.00 66.02 65.72 2c1d s SER 105 CO 0.43 -0.18 1.69 0.00 0.98 0.00 0.00 173.24 176.16 2c1d h ALA 107 N 1.39 1.52 -0.09 0.00 0.00 -1.62 -0.64 119.26 119.82 2c1d h ALA 107 Ca 0.22 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.01 2c1d h ALA 107 Cb 0.32 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2c1d h ALA 107 CO -0.36 0.21 0.07 0.66 0.00 0.00 0.00 179.25 179.83 2c1d h SER 108 N 0.00 0.00 0.00 0.00 4.64 -1.69 0.11 113.55 116.61 2c1d h SER 108 Ca -0.00 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 2c1d h SER 108 Cb 0.34 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.38 2c1d h SER 108 CO 0.02 0.00 -2.00 0.00 -0.87 0.00 0.00 176.83 173.99 2c1d n HIS 110 N -2.85 0.00 -2.45 0.00 8.25 -0.30 -5.07 115.22 112.79 2c1d n HIS 110 Ca -0.29 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.17 2c1d n HIS 110 Cb 0.87 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.98 2c1d n HIS 110 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2c1d n GLN 111 N 0.24 0.00 -0.98 -0.41 3.00 0.38 -4.58 117.38 115.02 2c1d n GLN 111 Ca 0.09 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.75 2c1d n GLN 111 Cb 0.46 0.00 0.14 0.00 0.00 0.00 0.00 30.24 30.83 2c1d n GLN 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2c1d n GLY 112 N 0.00 -0.26 0.19 1.08 0.00 -1.26 -4.28 105.19 100.66 2c1d n GLY 112 Ca 0.00 -0.56 0.14 0.00 0.00 0.00 0.00 46.02 45.61 2c1d n GLY 112 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2c1d h PRO 113 N -1.18 0.00 0.00 1.61 0.13 -1.99 -2.28 132.00 128.28 2c1d h PRO 113 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2c1d h PRO 113 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2c1d h PRO 113 CO 0.44 0.00 0.09 -0.85 -0.23 0.00 0.00 178.00 177.45 2c1d n GLU 114 N -2.61 0.10 0.26 0.86 0.00 -1.26 -1.08 120.64 116.92 2c1d n GLU 114 Ca 0.01 0.58 0.16 0.00 0.00 0.00 0.00 57.16 57.92 2c1d n GLU 114 Cb 0.26 -1.92 0.90 0.00 0.00 0.00 0.00 31.44 30.68 2c1d n GLU 114 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2c1d h SER 115 N 0.00 0.00 -0.48 -1.84 4.64 -1.65 -0.84 113.55 113.37 2c1d h SER 115 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2c1d h SER 115 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2c1d h SER 115 CO 0.00 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.19 2c1d n MET 116 N -3.76 3.29 -1.66 4.77 2.81 -0.24 -4.98 117.12 117.34 2c1d n MET 116 Ca -0.01 -2.22 -0.44 0.00 -1.81 0.00 0.00 57.70 53.22 2c1d n MET 116 Cb 0.18 -1.83 -0.01 0.00 -0.71 0.00 0.00 33.22 30.85 2c1d n MET 116 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2c1d n ALA 117 N 0.72 0.80 0.00 3.04 0.00 -0.32 -2.18 120.51 122.56 2c1d n ALA 117 Ca 0.20 0.38 0.00 0.00 0.00 0.00 0.00 53.44 54.02 2c1d n ALA 117 Cb 0.77 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 18.03 2c1d n ALA 117 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c1d n GLY 118 N 1.27 2.91 0.12 0.00 0.00 -1.19 -4.89 105.19 103.41 2c1d n GLY 118 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 2c1d n GLY 118 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2c1d h LEU 119 N 0.00 -0.18 -1.20 0.99 5.85 -1.76 -2.58 115.31 116.44 2c1d h LEU 119 Ca 0.00 -0.02 0.14 0.00 0.84 0.00 0.00 57.88 58.84 2c1d h LEU 119 Cb 0.00 0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.00 2c1d h LEU 119 CO 0.00 -0.09 0.59 -0.09 -0.34 0.00 0.00 178.44 178.51 2c1d h ARG 120 N -0.24 0.75 -0.02 1.25 9.65 -1.83 -2.03 114.38 121.91 2c1d h ARG 120 Ca -0.02 -0.04 0.01 0.00 -1.10 0.00 0.00 59.98 58.82 2c1d h ARG 120 Cb 0.19 -0.17 -0.00 0.00 -1.39 0.00 0.00 29.97 28.60 2c1d h ARG 120 CO 0.03 0.49 0.01 0.00 2.80 0.00 0.00 179.97 183.31 2c1d h ALA 121 N 1.59 2.00 -0.42 2.80 0.00 -1.78 -2.92 119.26 120.54 2c1d h ALA 121 Ca 0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.38 2c1d h ALA 121 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2c1d h ALA 121 CO -0.23 -0.02 0.00 1.33 0.00 0.00 0.00 179.25 180.32 2c1d n VAL 122 N -4.51 1.28 -3.99 0.00 0.24 -0.78 -1.14 118.33 109.43 2c1d n VAL 122 Ca -0.03 -1.15 -0.31 0.00 -2.04 0.00 0.00 64.34 60.81 2c1d n VAL 122 Cb 0.11 0.35 -0.05 0.00 -1.47 0.00 0.00 33.84 32.77 2c1d n VAL 122 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 2c1d s MET 123 N -1.36 3.20 0.76 7.34 1.00 -1.10 -4.13 119.30 125.00 2c1d s MET 123 Ca 0.33 -0.51 -0.12 0.00 0.00 0.00 0.00 55.69 55.39 2c1d s MET 123 Cb 0.19 -2.92 0.05 0.00 0.00 0.00 0.00 34.83 32.16 2c1d s MET 123 CO 0.18 0.61 1.11 -2.14 0.00 0.00 0.00 175.02 174.78 2c1d s PRO 124 N -2.26 2.25 0.13 2.03 0.02 -1.26 -4.90 135.00 131.01 2c1d s PRO 124 Ca 0.30 1.29 -0.11 0.00 0.02 0.00 0.00 61.00 62.50 2c1d s PRO 124 Cb -0.13 -1.89 0.01 0.00 0.02 0.00 0.00 34.50 32.51 2c1d s PRO 124 CO 0.22 -1.66 0.29 -0.98 -0.33 0.00 0.00 177.00 174.54 2c1d s ARG 125 N -4.63 1.04 -0.26 5.54 1.70 -0.95 -4.76 118.95 116.62 2c1d s ARG 125 Ca 0.64 -0.97 -0.29 0.00 -0.47 0.00 0.00 55.73 54.64 2c1d s ARG 125 Cb -0.19 0.40 0.01 0.00 -0.57 0.00 0.00 34.95 34.59 2c1d s ARG 125 CO 0.52 -0.38 1.12 0.08 -1.08 0.00 0.00 175.30 175.56 2c1d s VAL 126 N -3.89 4.48 0.35 4.99 1.01 -1.26 -0.78 120.40 125.31 2c1d s VAL 126 Ca 0.09 1.75 -0.29 0.00 0.00 0.00 0.00 61.98 63.53 2c1d s VAL 126 Cb 0.03 -4.28 -0.11 0.00 0.00 0.00 0.00 36.38 32.02 2c1d s VAL 126 CO -0.07 -0.33 1.50 -0.62 0.00 0.00 0.00 175.10 175.58 2c1d s ASP 127 N 1.70 6.38 0.43 3.32 -1.08 -0.21 -4.91 116.67 122.31 2c1d s ASP 127 Ca 0.48 2.99 0.21 0.00 -0.52 0.00 0.00 52.55 55.71 2c1d s ASP 127 Cb -0.15 -2.66 0.97 0.00 -1.46 0.00 0.00 42.92 39.62 2c1d s ASP 127 CO 0.13 -0.86 1.87 1.05 0.52 0.00 0.00 175.17 177.89 2c1d h GLU 128 N 3.55 0.00 0.03 4.34 4.11 -1.94 -1.90 114.58 122.76 2c1d h GLU 128 Ca -0.50 0.00 -0.38 0.00 0.07 0.00 0.00 59.36 58.55 2c1d h GLU 128 Cb 1.23 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.43 2c1d h GLU 128 CO 0.68 0.27 -2.36 0.72 0.07 0.00 0.00 179.01 178.39 2c1d n HIS 129 N -3.64 0.30 0.31 2.06 8.25 -1.26 -4.65 115.22 116.60 2c1d n HIS 129 Ca -0.01 0.06 0.11 0.00 -0.26 0.00 0.00 57.72 57.63 2c1d n HIS 129 Cb 0.39 -1.04 -0.07 0.00 1.12 0.00 0.00 29.99 30.39 2c1d n HIS 129 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2c1d n THR 130 N -3.30 0.16 -1.20 1.59 -2.24 -1.24 -4.98 114.28 103.08 2c1d n THR 130 Ca -0.42 -0.37 -0.07 0.00 -2.27 0.00 0.00 64.05 60.92 2c1d n THR 130 Cb 1.01 0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 69.33 2c1d n THR 130 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c1d n GLY 131 N 1.31 0.71 3.82 3.38 0.00 -0.72 -5.00 105.19 108.69 2c1d n GLY 131 Ca -0.00 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 2c1d n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c1d s LYS 132 N -2.41 4.19 0.13 1.61 1.02 -1.26 -4.71 119.74 118.31 2c1d s LYS 132 Ca 0.00 0.73 -0.31 0.00 0.02 0.00 0.00 55.97 56.41 2c1d s LYS 132 Cb 0.00 -3.13 -0.10 0.00 -0.52 0.00 0.00 37.83 34.08 2c1d s LYS 132 CO 0.00 0.57 1.67 -1.17 -0.92 0.00 0.00 175.35 175.50 2c1d s LEU 133 N -1.40 4.37 -0.08 3.17 2.96 -1.26 -1.05 118.68 125.39 2c1d s LEU 133 Ca 0.33 2.64 0.03 0.00 -0.22 0.00 0.00 54.13 56.92 2c1d s LEU 133 Cb -0.18 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 42.93 2c1d s LEU 133 CO 0.20 -0.90 -0.19 -0.04 -1.32 0.00 0.00 176.35 174.10 2c1d s MET 134 N 1.96 2.43 0.52 1.98 -1.94 0.04 -4.95 119.30 119.34 2c1d s MET 134 Ca 0.74 -0.67 0.02 0.00 -1.71 0.00 0.00 55.69 54.07 2c1d s MET 134 Cb -0.44 -1.89 0.03 0.00 2.01 0.00 0.00 34.83 34.54 2c1d s MET 134 CO 0.33 0.12 0.73 0.96 -0.01 0.00 0.00 175.02 177.15 2c1d s ILE 135 N 0.47 2.85 0.28 2.53 -4.36 -1.26 -2.25 121.20 119.46 2c1d s ILE 135 Ca -0.17 -0.70 -0.02 0.00 -0.26 0.00 0.00 60.65 59.51 2c1d s ILE 135 Cb -0.17 -3.05 0.17 0.00 1.25 0.00 0.00 42.46 40.66 2c1d s ILE 135 CO 0.07 -0.03 1.84 -0.03 0.24 0.00 0.00 174.94 177.02 2c1d h MET 136 N 0.18 0.91 -0.84 0.37 1.85 -2.00 -0.65 114.93 114.76 2c1d h MET 136 Ca -0.42 -0.16 0.13 0.00 -0.61 0.00 0.00 59.70 58.63 2c1d h MET 136 Cb 1.29 -0.15 -0.06 0.00 0.43 0.00 0.00 31.60 33.11 2c1d h MET 136 CO 0.52 0.77 0.54 0.93 -0.40 0.00 0.00 176.91 179.27 2c1d h GLU 137 N 0.88 0.64 -0.45 0.39 3.07 -1.96 -1.40 114.58 115.76 2c1d h GLU 137 Ca 0.20 -0.04 -0.12 0.00 -0.50 0.00 0.00 59.36 58.91 2c1d h GLU 137 Cb 0.22 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.98 2c1d h GLU 137 CO -0.01 0.43 -0.18 -0.44 -1.40 0.00 0.00 179.01 177.40 2c1d h ASP 138 N 0.66 0.93 -0.48 1.42 3.32 -1.50 -1.29 116.42 119.48 2c1d h ASP 138 Ca 0.41 -0.39 -0.05 0.00 0.02 0.00 0.00 57.03 57.02 2c1d h ASP 138 Cb 0.64 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 2c1d h ASP 138 CO -0.17 1.11 0.11 1.88 -1.72 0.00 0.00 179.24 180.45 2c1d h TYR 139 N 0.75 0.82 -0.12 4.55 0.99 -1.23 -1.51 116.97 121.22 2c1d h TYR 139 Ca 0.10 -0.10 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 2c1d h TYR 139 Cb 0.74 -0.23 -0.01 0.00 1.00 0.00 0.00 36.73 38.24 2c1d h TYR 139 CO 0.05 0.74 0.07 0.28 -0.00 0.00 0.00 178.16 179.30 2c1d h VAL 140 N 0.66 1.08 0.00 -2.88 2.07 -1.26 -2.63 116.25 113.29 2c1d h VAL 140 Ca 0.15 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.41 2c1d h VAL 140 Cb 0.34 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 2c1d h VAL 140 CO 0.00 0.07 -0.23 0.78 0.02 0.00 0.00 177.57 178.22 2c1d h ASN 141 N 0.11 0.00 -0.60 0.57 2.35 -1.17 -1.21 115.58 115.63 2c1d h ASN 141 Ca 0.04 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 2c1d h ASN 141 Cb 0.05 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.40 2c1d h ASN 141 CO -0.01 0.23 0.28 0.00 -1.65 0.00 0.00 177.43 176.29 2c1d h ALA 142 N 1.77 0.77 -0.09 -0.83 0.00 -0.91 -1.25 119.26 118.73 2c1d h ALA 142 Ca -0.00 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 2c1d h ALA 142 Cb 0.62 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2c1d h ALA 142 CO 0.03 0.34 -0.23 0.00 0.00 0.00 0.00 179.25 179.39 2c1d h VAL 144 N -0.15 0.51 0.00 0.00 2.07 -1.19 -0.39 116.25 117.10 2c1d h VAL 144 Ca -0.00 -0.04 -0.11 0.00 0.82 0.00 0.00 66.70 67.37 2c1d h VAL 144 Cb 0.84 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 2c1d h VAL 144 CO 0.05 0.02 -0.62 0.71 0.02 0.00 0.00 177.57 177.75 2c1d h THR 145 N 0.12 1.23 -0.01 2.57 1.35 -1.23 -2.15 112.91 114.78 2c1d h THR 145 Ca 0.31 -2.16 -0.16 0.00 -0.55 0.00 0.00 66.41 63.85 2c1d h THR 145 Cb 0.50 2.56 -0.02 0.00 -1.73 0.00 0.00 68.15 69.46 2c1d h THR 145 CO -0.51 0.42 -0.73 -0.33 -0.25 0.00 0.00 175.52 174.12 2c1d h GLU 146 N -1.00 0.09 0.00 4.72 5.08 -1.28 -3.17 114.58 119.02 2c1d h GLU 146 Ca -0.17 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 2c1d h GLU 146 Cb 1.08 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.35 2c1d h GLU 146 CO -0.10 0.78 -0.62 0.54 -1.00 0.00 0.00 179.01 178.60 2c1d n ARG 147 N -3.72 3.32 -0.00 2.33 1.74 -0.21 -4.60 116.66 115.52 2c1d n ARG 147 Ca -0.02 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 2c1d n ARG 147 Cb 0.70 -0.88 0.00 0.00 -1.02 0.00 0.00 32.46 31.27 2c1d n ARG 147 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 2c1d n MET 148 N -1.33 -0.68 -1.94 5.56 2.81 -0.85 -4.98 117.12 115.72 2c1d n MET 148 Ca 0.00 -0.60 -0.14 0.00 -1.81 0.00 0.00 57.70 55.15 2c1d n MET 148 Cb 0.09 -1.02 -0.03 0.00 -0.71 0.00 0.00 33.22 31.56 2c1d n MET 148 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2c1d n GLY 149 N 0.02 0.44 3.78 3.03 0.00 -1.16 -1.36 105.19 109.93 2c1d n GLY 149 Ca 0.00 -0.31 -0.27 0.00 0.00 0.00 0.00 46.02 45.44 2c1d n GLY 149 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c1d s LEU 150 N -3.77 3.74 0.38 0.99 1.43 -0.82 -4.72 118.68 115.91 2c1d s LEU 150 Ca 0.00 -0.13 -0.28 0.00 -1.03 0.00 0.00 54.13 52.69 2c1d s LEU 150 Cb 0.00 -2.38 -0.11 0.00 0.03 0.00 0.00 46.19 43.73 2c1d s LEU 150 CO 0.00 0.10 1.49 -0.70 0.23 0.00 0.00 176.35 177.47 2c1d s GLU 151 N -2.89 4.09 0.41 1.70 2.12 -1.26 -3.92 118.70 118.94 2c1d s GLU 151 Ca 0.30 2.59 -0.26 0.00 0.36 0.00 0.00 54.97 57.96 2c1d s GLU 151 Cb -0.11 -2.96 -0.10 0.00 0.26 0.00 0.00 34.13 31.23 2c1d s GLU 151 CO 0.22 -0.56 1.31 0.36 -0.54 0.00 0.00 175.26 176.05 2c1d n LYS 152 N 0.42 2.06 -2.43 4.30 2.85 -1.26 -4.84 118.16 119.26 2c1d n LYS 152 Ca 0.01 0.73 -0.41 0.00 -1.05 0.00 0.00 58.31 57.60 2c1d n LYS 152 Cb 0.39 -2.42 -0.04 0.00 -0.65 0.00 0.00 35.03 32.31 2c1d n LYS 152 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 2c1d s TRP 153 N -1.17 3.51 0.31 5.58 0.51 -1.26 -5.00 118.94 121.41 2c1d s TRP 153 Ca 0.59 1.62 -0.29 0.00 -2.12 0.00 0.00 56.10 55.90 2c1d s TRP 153 Cb -0.51 -3.34 -0.13 0.00 -0.81 0.00 0.00 33.47 28.68 2c1d s TRP 153 CO 0.59 -0.77 1.34 0.41 -0.51 0.00 0.00 176.95 178.01 2c1d n GLY 154 N 1.39 0.68 0.27 0.98 0.00 -1.26 -4.88 105.19 102.37 2c1d n GLY 154 Ca 0.00 0.38 0.18 0.00 0.00 0.00 0.00 46.02 46.58 2c1d n GLY 154 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2c1d h VAL 155 N 2.74 0.00 -0.10 1.61 -1.51 -1.94 -1.78 116.25 115.26 2c1d h VAL 155 Ca -0.46 -0.25 0.00 0.00 -1.23 0.00 0.00 66.70 64.76 2c1d h VAL 155 Cb 1.28 1.16 0.00 0.00 -2.13 0.00 0.00 31.29 31.60 2c1d h VAL 155 CO 0.67 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 177.36 2c1d n THR 156 N -2.89 1.71 -1.28 7.19 -2.24 -1.26 -4.72 114.28 110.77 2c1d n THR 156 Ca -0.01 -1.77 -0.33 0.00 -2.27 0.00 0.00 64.05 59.68 2c1d n THR 156 Cb 0.19 -0.01 0.10 0.00 -2.10 0.00 0.00 70.33 68.51 2c1d n THR 156 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2c1d s SER 157 N -2.05 4.06 0.27 3.42 1.04 -0.67 -4.80 113.70 114.98 2c1d s SER 157 Ca 0.27 2.20 -0.04 0.00 0.48 0.00 0.00 55.95 58.86 2c1d s SER 157 Cb 0.22 -2.57 0.35 0.00 0.10 0.00 0.00 66.02 64.12 2c1d s SER 157 CO 0.05 -2.34 1.94 0.44 0.98 0.00 0.00 173.24 174.31 2c1d h ASP 158 N -0.72 1.07 -0.62 7.02 3.45 -1.97 0.61 116.42 125.26 2c1d h ASP 158 Ca -0.46 -0.02 0.04 0.00 0.43 0.00 0.00 57.03 57.02 2c1d h ASP 158 Cb 1.27 -0.26 -0.05 0.00 -0.56 0.00 0.00 39.33 39.74 2c1d h ASP 158 CO 0.49 0.76 0.36 0.78 -1.57 0.00 0.00 179.24 180.05 2c1d h ASN 159 N 1.25 0.55 -0.11 6.45 2.35 -1.92 -0.81 115.58 123.34 2c1d h ASN 159 Ca 0.35 0.02 -0.03 0.00 -0.55 0.00 0.00 56.30 56.09 2c1d h ASN 159 Cb -0.11 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.16 2c1d h ASN 159 CO -0.08 0.37 -0.04 -0.03 -1.65 0.00 0.00 177.43 175.99 2c1d h MET 160 N 0.68 0.22 -0.67 0.81 4.05 -1.63 -2.07 114.93 116.32 2c1d h MET 160 Ca 0.26 -0.09 -0.08 0.00 -0.28 0.00 0.00 59.70 59.52 2c1d h MET 160 Cb 0.11 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 30.87 2c1d h MET 160 CO -0.14 0.56 0.12 0.87 0.23 0.00 0.00 176.91 178.54 2c1d h LYS 161 N -0.13 1.09 -0.52 0.39 1.57 -0.77 0.03 116.57 118.24 2c1d h LYS 161 Ca 0.02 -0.29 -0.06 0.00 -1.87 0.00 0.00 60.65 58.46 2c1d h LYS 161 Cb 0.49 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.64 2c1d h LYS 161 CO 0.01 1.00 0.11 -0.44 -0.57 0.00 0.00 179.45 179.56 2c1d h ASP 162 N 1.02 0.80 -0.41 0.86 3.32 -1.21 -1.24 116.42 119.56 2c1d h ASP 162 Ca 0.20 -0.24 -0.06 0.00 0.02 0.00 0.00 57.03 56.95 2c1d h ASP 162 Cb 0.42 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 2c1d h ASP 162 CO 0.01 0.84 0.01 -0.03 -1.72 0.00 0.00 179.24 178.35 2c1d h MET 163 N 0.73 0.72 -0.52 3.56 4.05 -0.99 -1.45 114.93 121.02 2c1d h MET 163 Ca 0.16 -0.22 -0.02 0.00 -0.28 0.00 0.00 59.70 59.34 2c1d h MET 163 Cb 0.36 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 31.07 2c1d h MET 163 CO 0.01 0.79 0.26 -0.07 0.23 0.00 0.00 176.91 178.13 2c1d h LEU 164 N 0.55 0.65 0.11 3.39 3.38 -0.93 -0.65 115.31 121.81 2c1d h LEU 164 Ca 0.12 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2c1d h LEU 164 Cb 0.46 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2c1d h LEU 164 CO 0.02 0.55 -0.05 0.28 0.09 0.00 0.00 178.44 179.33 2c1d h SER 165 N 0.73 -0.12 -0.42 -0.43 0.02 -0.88 0.87 113.55 113.31 2c1d h SER 165 Ca 0.18 -0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.13 2c1d h SER 165 Cb 0.07 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.60 2c1d h SER 165 CO -0.03 -0.03 0.19 0.25 -1.14 0.00 0.00 176.83 176.07 2c1d h LEU 166 N -0.21 0.26 -0.52 5.07 5.85 -0.92 -1.97 115.31 122.88 2c1d h LEU 166 Ca -0.02 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.64 2c1d h LEU 166 Cb 0.17 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 2c1d h LEU 166 CO 0.02 0.19 -0.03 0.40 -0.34 0.00 0.00 178.44 178.68 2c1d h ILE 167 N 0.39 1.27 -0.63 4.05 2.04 -1.00 -2.88 117.51 120.74 2c1d h ILE 167 Ca 0.19 -1.14 -0.02 0.00 1.00 0.00 0.00 64.86 64.88 2c1d h ILE 167 Cb 0.12 0.96 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 2c1d h ILE 167 CO -0.15 0.40 0.32 -1.28 0.00 0.00 0.00 178.15 177.44 2c1d h SER 168 N 0.81 0.79 0.02 1.72 0.87 -0.54 -1.12 113.55 116.11 2c1d h SER 168 Ca 0.14 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2c1d h SER 168 Cb 0.57 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 62.33 2c1d h SER 168 CO 0.03 0.66 -0.01 0.25 -0.53 0.00 0.00 176.83 177.24 2c1d h LEU 169 N 0.89 0.00 0.00 2.23 5.85 -1.14 -1.90 115.31 121.24 2c1d h LEU 169 Ca 0.22 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.94 2c1d h LEU 169 Cb 0.06 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.09 2c1d h LEU 169 CO -0.03 0.01 0.00 0.00 -0.34 0.00 0.00 178.44 178.07 2c1d n GLN 170 N -3.82 0.41 0.00 1.25 1.13 -0.42 -2.31 117.38 113.62 2c1d n GLN 170 Ca -0.03 0.06 0.00 0.00 -1.94 0.00 0.00 57.00 55.09 2c1d n GLN 170 Cb 0.09 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 28.94 2c1d n GLN 170 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 2c1d n SER 171 N -1.22 1.91 -4.70 1.08 7.64 -0.72 -3.16 113.62 114.45 2c1d n SER 171 Ca 0.12 -1.92 -0.44 0.00 1.01 0.00 0.00 58.87 57.65 2c1d n SER 171 Cb 0.15 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.33 2c1d n SER 171 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2c1d n ARG 172 N -0.46 2.38 0.00 1.43 0.63 -0.98 -1.21 116.66 118.46 2c1d n ARG 172 Ca 0.00 0.85 0.00 0.00 -0.92 0.00 0.00 57.85 57.78 2c1d n ARG 172 Cb 0.23 -2.60 0.00 0.00 0.45 0.00 0.00 32.46 30.55 2c1d n ARG 172 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2c1d n GLY 173 N 2.65 2.77 3.79 5.14 0.00 -0.28 -4.98 105.19 114.27 2c1d n GLY 173 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 2c1d n GLY 173 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2c1d s MET 174 N -0.37 4.22 0.07 1.61 -1.94 -0.35 -4.76 119.30 117.78 2c1d s MET 174 Ca 0.00 1.42 -0.31 0.00 -1.71 0.00 0.00 55.69 55.09 2c1d s MET 174 Cb 0.00 -2.50 -0.07 0.00 2.01 0.00 0.00 34.83 34.27 2c1d s MET 174 CO 0.00 -0.08 1.36 0.00 -0.01 0.00 0.00 175.02 176.29 2c1d s ALA 175 N -1.74 3.55 0.12 3.03 0.00 -1.26 -0.37 121.76 125.09 2c1d s ALA 175 Ca 0.58 1.00 -0.35 0.00 0.00 0.00 0.00 51.96 53.19 2c1d s ALA 175 Cb -0.19 -3.54 -0.15 0.00 0.00 0.00 0.00 23.12 19.24 2c1d s ALA 175 CO 0.24 -0.67 1.51 0.28 0.00 0.00 0.00 175.76 177.12 2c1d n VAL 176 N 4.16 0.02 -2.96 0.00 0.31 0.55 -4.82 118.33 115.59 2c1d n VAL 176 Ca 0.12 -0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.30 2c1d n VAL 176 Cb 0.43 -1.31 -0.01 0.00 -0.91 0.00 0.00 33.84 32.04 2c1d n VAL 176 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2c1d n ASN 177 N 3.24 -1.88 -4.76 4.52 5.15 -0.29 -1.31 115.26 119.92 2c1d n ASN 177 Ca 0.18 -2.94 -0.37 0.00 -0.60 0.00 0.00 54.58 50.84 2c1d n ASN 177 Cb 0.25 0.84 -0.06 0.00 -0.53 0.00 0.00 39.78 40.28 2c1d n ASN 177 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2c1d s VAL 178 N 0.15 5.17 0.09 3.44 -7.23 -1.26 -4.43 120.40 116.34 2c1d s VAL 178 Ca 0.33 0.80 -0.31 0.00 -1.81 0.00 0.00 61.98 60.99 2c1d s VAL 178 Cb 0.14 -3.73 -0.06 0.00 0.56 0.00 0.00 36.38 33.29 2c1d s VAL 178 CO -0.17 0.43 1.21 -0.75 -0.31 0.00 0.00 175.10 175.52 2c1d s LYS 179 N -0.02 4.44 0.00 4.82 2.20 -1.26 -4.89 119.74 125.03 2c1d s LYS 179 Ca 0.23 1.81 0.00 0.00 -0.36 0.00 0.00 55.97 57.65 2c1d s LYS 179 Cb -0.15 -3.32 0.00 0.00 -1.51 0.00 0.00 37.83 32.86 2c1d s LYS 179 CO 0.10 -0.23 0.37 0.44 -0.36 0.00 0.00 175.35 175.67 2c1d n ILE 180 N 3.61 0.00 -3.52 5.43 -5.35 -1.26 -4.87 119.36 113.40 2c1d n ILE 180 Ca 0.08 -0.50 -0.11 0.00 -0.27 0.00 0.00 62.75 61.95 2c1d n ILE 180 Cb 0.46 1.01 0.01 0.00 -1.74 0.00 0.00 39.64 39.37 2c1d n ILE 180 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2c1d n ASP 181 N -0.27 1.58 0.00 7.28 3.85 -1.26 -3.26 116.55 124.47 2c1d n ASP 181 Ca 0.00 -1.81 0.00 0.00 -0.71 0.00 0.00 54.79 52.28 2c1d n ASP 181 Cb 0.01 -0.06 0.00 0.00 -1.35 0.00 0.00 41.12 39.72 2c1d n ASP 181 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2c1d n GLY 182 N 2.01 2.50 0.32 6.12 0.00 -1.26 -2.33 105.19 112.56 2c1d n GLY 182 Ca 0.01 -0.45 0.20 0.00 0.00 0.00 0.00 46.02 45.78 2c1d n GLY 182 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2c1d h PRO 183 N 0.00 0.00 0.00 1.61 0.11 -2.00 -1.69 132.00 130.02 2c1d h PRO 183 Ca 0.00 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.06 2c1d h PRO 183 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 2c1d h PRO 183 CO 0.00 0.01 -0.23 0.00 -0.21 0.00 0.00 178.00 177.57 2c1d h ALA 184 N 1.99 1.10 -0.65 -0.75 0.00 -1.75 -3.37 119.26 115.83 2c1d h ALA 184 Ca -0.00 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.75 2c1d h ALA 184 Cb 0.05 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 2c1d h ALA 184 CO 0.00 0.28 0.38 0.00 0.00 0.00 0.00 179.25 179.92 2c1d h ALA 185 N 1.77 0.86 -0.47 0.00 0.00 -1.28 -0.72 119.26 119.42 2c1d h ALA 185 Ca -0.00 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 2c1d h ALA 185 Cb 0.65 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2c1d h ALA 185 CO 0.03 0.10 -0.23 -1.35 0.00 0.00 0.00 179.25 177.80 2c1d h PRO 186 N 0.73 0.98 -0.45 0.00 0.11 -1.79 -0.24 132.00 131.34 2c1d h PRO 186 Ca 0.28 -0.42 0.02 0.00 0.11 0.00 0.00 66.00 65.98 2c1d h PRO 186 Cb 0.10 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.16 2c1d h PRO 186 CO -0.14 1.09 0.27 1.88 -0.21 0.00 0.00 178.00 180.89 2c1d h TYR 187 N 0.84 0.50 -0.40 0.65 -1.99 -1.72 -1.63 116.97 113.22 2c1d h TYR 187 Ca 0.11 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.81 2c1d h TYR 187 Cb 0.81 -0.16 -0.02 0.00 2.00 0.00 0.00 36.73 39.36 2c1d h TYR 187 CO 0.05 0.29 0.10 2.35 -0.00 0.00 0.00 178.16 180.95 2c1d h TRP 188 N 0.53 0.66 -0.86 4.88 7.01 -0.86 -1.41 115.95 125.90 2c1d h TRP 188 Ca 0.18 -0.08 0.01 0.00 2.11 0.00 0.00 58.89 61.11 2c1d h TRP 188 Cb 0.01 -0.19 -0.04 0.00 -2.10 0.00 0.00 29.16 26.84 2c1d h TRP 188 CO -0.07 0.63 0.57 0.93 -2.79 0.00 0.00 178.44 177.71 2c1d h GLU 189 N 0.50 1.14 -0.66 2.65 4.39 -0.97 0.12 114.58 121.74 2c1d h GLU 189 Ca 0.13 -0.07 -0.08 0.00 0.34 0.00 0.00 59.36 59.68 2c1d h GLU 189 Cb 0.30 -0.26 -0.03 0.00 -0.10 0.00 0.00 28.75 28.66 2c1d h GLU 189 CO 0.00 0.75 0.11 1.25 -1.16 0.00 0.00 179.01 179.96 2c1d h HIS 190 N 1.17 1.16 -0.38 4.33 2.76 -0.64 -1.97 115.15 121.58 2c1d h HIS 190 Ca 0.32 -0.16 -0.14 0.00 -2.20 0.00 0.00 60.37 58.18 2c1d h HIS 190 Cb -0.14 -0.32 -0.01 0.00 1.55 0.00 0.00 27.41 28.50 2c1d h HIS 190 CO 0.00 0.97 -0.33 0.78 -1.30 0.00 0.00 177.93 178.05 2c1d h GLY 191 N 1.05 0.94 0.77 5.26 0.00 -0.69 -2.99 103.07 107.41 2c1d h GLY 191 Ca 0.20 -0.90 0.04 0.00 0.00 0.00 0.00 47.33 46.66 2c1d h GLY 191 CO 0.01 0.82 0.23 1.70 0.00 0.00 0.00 176.54 179.30 2c1d h LYS 192 N 0.72 0.45 -0.59 4.80 3.64 -0.50 -1.02 116.57 124.07 2c1d h LYS 192 Ca 0.07 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.47 2c1d h LYS 192 Cb 0.89 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.56 2c1d h LYS 192 CO 0.08 0.30 0.32 1.49 -2.27 0.00 0.00 179.45 179.37 2c1d h GLU 193 N 0.46 0.60 -0.48 1.90 4.81 -1.28 -1.95 114.58 118.65 2c1d h GLU 193 Ca 0.20 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.41 2c1d h GLU 193 Cb 0.10 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 2c1d h GLU 193 CO -0.13 0.39 0.29 0.82 -0.73 0.00 0.00 179.01 179.65 2c1d h ILE 194 N 0.61 1.07 -0.81 2.32 2.04 -1.30 -1.86 117.51 119.60 2c1d h ILE 194 Ca 0.26 -0.20 0.10 0.00 1.00 0.00 0.00 64.86 66.02 2c1d h ILE 194 Cb 0.14 0.43 -0.06 0.00 -0.74 0.00 0.00 36.82 36.59 2c1d h ILE 194 CO -0.16 0.11 0.53 0.22 0.00 0.00 0.00 178.15 178.84 2c1d h TYR 195 N 0.59 0.78 -0.19 1.37 3.20 -0.42 -1.78 116.97 120.52 2c1d h TYR 195 Ca 0.19 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.08 2c1d h TYR 195 Cb -0.01 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.01 2c1d h TYR 195 CO -0.06 0.35 0.00 0.66 -1.64 0.00 0.00 178.16 177.47 2c1d n TYR 196 N -4.51 0.22 -2.80 -3.82 4.02 -1.03 -2.30 117.16 106.94 2c1d n TYR 196 Ca 0.14 -0.12 -0.41 0.00 -0.01 0.00 0.00 57.90 57.50 2c1d n TYR 196 Cb 0.35 -0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.63 2c1d n TYR 196 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2c1d s THR 197 N -1.67 4.71 -0.68 -0.72 2.01 -0.67 -4.85 115.64 113.77 2c1d s THR 197 Ca 0.31 1.93 -0.18 0.00 0.31 0.00 0.00 61.69 64.06 2c1d s THR 197 Cb 0.20 -4.26 0.13 0.00 0.01 0.00 0.00 72.50 68.59 2c1d s THR 197 CO 0.29 0.27 0.76 -0.13 -0.69 0.00 0.00 174.62 175.13 2c1d s ARG 198 N 0.37 3.23 0.57 4.92 0.52 -1.26 -3.83 118.95 123.47 2c1d s ARG 198 Ca 0.46 -1.65 -0.10 0.00 -0.52 0.00 0.00 55.73 53.92 2c1d s ARG 198 Cb -0.22 -4.40 -0.05 0.00 0.52 0.00 0.00 34.95 30.81 2c1d s ARG 198 CO 0.27 -1.51 0.96 0.71 0.02 0.00 0.00 175.30 175.75 2c1d s TYR 199 N 2.09 3.59 0.04 -0.53 1.51 -0.59 -4.29 117.35 119.17 2c1d s TYR 199 Ca 0.15 1.20 0.00 0.00 -1.01 0.00 0.00 57.07 57.42 2c1d s TYR 199 Cb -0.19 -2.63 0.00 0.00 -0.11 0.00 0.00 41.96 39.03 2c1d s TYR 199 CO 0.01 -0.54 0.00 0.41 -1.11 0.00 0.00 175.55 174.32 2c1d n GLY 200 N -2.44 -1.40 0.21 0.71 0.00 -1.26 -1.51 105.19 99.51 2c1d n GLY 200 Ca 0.05 -1.49 0.05 0.00 0.00 0.00 0.00 46.02 44.62 2c1d n GLY 200 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2c1d h GLN 201 N -0.14 0.00 0.00 1.61 4.15 -0.84 -2.22 115.11 117.66 2c1d h GLN 201 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2c1d h GLN 201 Cb 0.14 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.83 2c1d h GLN 201 CO 0.00 0.25 0.00 1.28 -1.93 0.00 0.00 178.83 178.43 2c1d n LEU 202 N -4.14 0.65 -3.44 -2.39 4.77 -0.54 -4.96 117.00 106.96 2c1d n LEU 202 Ca -0.02 0.59 -0.21 0.00 -0.03 0.00 0.00 56.01 56.34 2c1d n LEU 202 Cb 0.31 -0.42 0.05 0.00 -2.33 0.00 0.00 43.42 41.03 2c1d n LEU 202 CO 0.36 -0.29 0.00 -0.62 -1.33 0.00 0.00 177.39 175.52 2c1d n GLU 203 N -2.15 -1.72 -4.33 3.23 1.02 -0.57 -5.01 120.64 111.12 2c1d n GLU 203 Ca 0.05 0.73 -0.20 0.00 -0.02 0.00 0.00 57.16 57.72 2c1d n GLU 203 Cb 0.35 -5.01 -0.16 0.00 -0.02 0.00 0.00 31.44 26.60 2c1d n GLU 203 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2c1d s MET 204 N -5.00 0.89 0.26 3.49 -1.94 -0.69 -4.73 119.30 111.59 2c1d s MET 204 Ca 0.43 -0.26 0.08 0.00 -1.71 0.00 0.00 55.69 54.23 2c1d s MET 204 Cb -0.10 -0.84 -0.04 0.00 2.01 0.00 0.00 34.83 35.86 2c1d s MET 204 CO 0.80 0.08 0.14 -1.54 -0.01 0.00 0.00 175.02 174.49 2c1d s SER 205 N 0.29 5.21 0.26 3.03 1.04 -1.25 -1.54 113.70 120.74 2c1d s SER 205 Ca -0.04 -0.39 -0.07 0.00 0.48 0.00 0.00 55.95 55.94 2c1d s SER 205 Cb -0.09 -1.21 0.47 0.00 0.10 0.00 0.00 66.02 65.29 2c1d s SER 205 CO 0.00 -0.05 1.61 0.00 0.98 0.00 0.00 173.24 175.79 2c1d h ALA 207 N 1.80 1.31 -0.78 0.00 0.00 -1.89 0.45 119.26 120.14 2c1d h ALA 207 Ca 0.44 -0.18 0.10 0.00 0.00 0.00 0.00 54.91 55.27 2c1d h ALA 207 Cb 0.78 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.29 2c1d h ALA 207 CO -0.78 0.49 0.42 -0.91 0.00 0.00 0.00 179.25 178.47 2c1d h ASN 208 N 0.70 0.56 0.00 0.00 2.35 -1.57 0.10 115.58 117.72 2c1d h ASN 208 Ca 0.16 0.06 -0.13 0.00 -0.55 0.00 0.00 56.30 55.84 2c1d h ASN 208 Cb 0.26 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 2c1d h ASN 208 CO -0.00 0.30 -0.78 0.00 -1.65 0.00 0.00 177.43 175.30 2c1d h HIS 210 N -1.00 0.00 0.00 0.00 3.86 -0.95 -2.85 115.15 114.21 2c1d h HIS 210 Ca -0.20 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 58.86 2c1d h HIS 210 Cb 1.08 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.52 2c1d h HIS 210 CO 0.11 0.00 -1.37 -1.91 0.86 0.00 0.00 177.93 175.62 2c1d n GLU 211 N -2.73 0.42 0.19 2.45 2.13 -0.16 -4.20 120.64 118.75 2c1d n GLU 211 Ca 0.02 0.18 0.06 0.00 0.66 0.00 0.00 57.16 58.08 2c1d n GLU 211 Cb 0.52 -1.23 0.36 0.00 0.27 0.00 0.00 31.44 31.37 2c1d n GLU 211 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 2c1d h ASP 212 N -0.76 0.00 0.00 4.31 3.32 -0.98 -3.33 116.42 118.98 2c1d h ASP 212 Ca -0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.82 2c1d h ASP 212 Cb 1.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.61 2c1d h ASP 212 CO -0.14 0.36 -0.12 0.59 -1.72 0.00 0.00 179.24 178.21 2c1d n ASN 213 N -3.58 1.48 -4.70 6.45 3.02 -1.08 -5.03 115.26 111.82 2c1d n ASN 213 Ca -0.00 -2.38 -0.43 0.00 -0.03 0.00 0.00 54.58 51.73 2c1d n ASN 213 Cb 0.48 -0.24 -0.03 0.00 -0.61 0.00 0.00 39.78 39.38 2c1d n ASN 213 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2c1d n ALA 214 N -0.75 2.24 0.00 5.41 0.00 -1.16 -1.54 120.51 124.71 2c1d n ALA 214 Ca 0.07 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.93 2c1d n ALA 214 Cb 0.56 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.56 2c1d n ALA 214 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c1d n GLY 215 N 3.47 3.07 3.93 0.00 0.00 -0.10 -4.93 105.19 110.63 2c1d n GLY 215 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 2c1d n GLY 215 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2c1d s ASN 216 N -1.13 5.38 -0.25 1.61 0.01 -0.59 0.77 114.94 120.75 2c1d s ASN 216 Ca 0.00 0.47 -0.11 0.00 -0.71 0.00 0.00 52.86 52.52 2c1d s ASN 216 Cb 0.00 -1.40 -0.05 0.00 0.41 0.00 0.00 41.25 40.21 2c1d s ASN 216 CO 0.00 -1.16 0.17 -0.04 -1.51 0.00 0.00 177.10 174.56 2c1d s MET 217 N -4.95 4.03 -0.37 -0.60 -1.94 -1.26 -0.88 119.30 113.33 2c1d s MET 217 Ca 0.55 -0.29 -0.09 0.00 -1.71 0.00 0.00 55.69 54.16 2c1d s MET 217 Cb -0.10 -3.56 0.04 0.00 2.01 0.00 0.00 34.83 33.21 2c1d s MET 217 CO 0.43 -0.01 0.17 -1.50 -0.01 0.00 0.00 175.02 174.10 2c1d s ILE 218 N 1.25 4.16 0.00 2.53 2.07 0.04 -4.97 121.20 126.28 2c1d s ILE 218 Ca 0.07 -1.08 0.00 0.00 -1.41 0.00 0.00 60.65 58.23 2c1d s ILE 218 Cb -0.14 -3.38 0.00 0.00 0.13 0.00 0.00 42.46 39.07 2c1d s ILE 218 CO 0.06 -0.26 0.00 -1.14 -1.91 0.00 0.00 174.94 171.69 2c1d n ARG 219 N 4.90 0.00 0.00 3.50 3.00 -1.26 -1.28 116.66 125.52 2c1d n ARG 219 Ca -0.12 0.00 0.15 0.00 -0.00 0.00 0.00 57.85 57.88 2c1d n ARG 219 Cb 0.45 0.00 0.70 0.00 0.00 0.00 0.00 32.46 33.61 2c1d n ARG 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2c1d n ALA 220 N 8.94 2.66 -2.72 5.13 0.00 -1.26 -4.82 120.51 128.44 2c1d n ALA 220 Ca 0.00 -0.23 -0.37 0.00 0.00 0.00 0.00 53.44 52.85 2c1d n ALA 220 Cb 0.00 -1.40 -0.07 0.00 0.00 0.00 0.00 19.45 17.98 2c1d n ALA 220 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2c1d s ASP 221 N -2.43 6.48 -0.38 0.00 1.01 -0.40 -5.06 116.67 115.89 2c1d s ASP 221 Ca 0.31 0.57 -0.23 0.00 0.71 0.00 0.00 52.55 53.91 2c1d s ASP 221 Cb 0.20 -2.20 0.01 0.00 1.01 0.00 0.00 42.92 41.95 2c1d s ASP 221 CO 0.45 0.10 0.80 -2.28 0.21 0.00 0.00 175.17 174.45 2c1d s HIS 222 N 0.40 3.08 0.08 4.23 5.65 -1.26 -0.78 115.29 126.69 2c1d s HIS 222 Ca 0.18 0.49 -0.31 0.00 0.25 0.00 0.00 55.06 55.68 2c1d s HIS 222 Cb -0.13 -3.48 -0.07 0.00 -1.18 0.00 0.00 32.58 27.72 2c1d s HIS 222 CO 0.05 -0.79 1.32 -0.51 -0.65 0.00 0.00 174.74 174.16 2c1d s LEU 223 N 3.18 4.36 0.00 8.88 1.43 -0.06 -4.94 118.68 131.53 2c1d s LEU 223 Ca 0.32 2.18 0.01 0.00 -1.03 0.00 0.00 54.13 55.61 2c1d s LEU 223 Cb -0.13 -3.58 0.03 0.00 0.03 0.00 0.00 46.19 42.54 2c1d s LEU 223 CO 0.18 -0.60 0.22 -1.54 0.23 0.00 0.00 176.35 174.84 2c1d n SER 224 N 4.15 0.43 -0.31 2.29 3.41 -1.26 -0.93 113.62 121.40 2c1d n SER 224 Ca 0.11 -1.33 0.05 0.00 -0.26 0.00 0.00 58.87 57.44 2c1d n SER 224 Cb 0.44 -0.13 0.21 0.00 -0.26 0.00 0.00 64.21 64.47 2c1d n SER 224 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c1d n GLN 225 N -1.38 1.39 -3.57 4.33 6.02 -1.26 -4.47 117.38 118.44 2c1d n GLN 225 Ca 0.04 -0.60 -0.21 0.00 -0.01 0.00 0.00 57.00 56.23 2c1d n GLN 225 Cb 0.15 -1.20 0.07 0.00 1.02 0.00 0.00 30.24 30.27 2c1d n GLN 225 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2c1d n GLY 226 N 0.84 -0.39 3.87 1.08 0.00 -1.26 -4.82 105.19 104.51 2c1d n GLY 226 Ca 0.09 0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 2c1d n GLY 226 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c1d s GLN 227 N -5.80 3.81 -0.06 1.61 -1.52 -1.26 -5.01 119.66 111.42 2c1d s GLN 227 Ca 0.17 0.61 0.10 0.00 -1.95 0.00 0.00 55.36 54.28 2c1d s GLN 227 Cb -0.08 -2.31 0.21 0.00 -0.22 0.00 0.00 33.01 30.62 2c1d s GLN 227 CO 0.76 -0.13 1.15 0.44 -0.25 0.00 0.00 175.29 177.26 2c1d n ILE 228 N -1.48 1.45 0.27 1.08 -5.35 -1.26 -4.67 119.36 109.40 2c1d n ILE 228 Ca 0.04 -1.51 0.15 0.00 -0.27 0.00 0.00 62.75 61.16 2c1d n ILE 228 Cb 0.54 0.17 0.75 0.00 -1.74 0.00 0.00 39.64 39.36 2c1d n ILE 228 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2c1d h ASN 229 N 0.60 0.00 0.06 7.28 7.08 -1.90 -2.56 115.58 126.15 2c1d h ASN 229 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 2c1d h ASN 229 Cb 0.82 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.06 2c1d h ASN 229 CO 0.03 0.00 -0.36 0.61 -2.08 0.00 0.00 177.43 175.63 2c1d n GLY 230 N -0.81 -0.10 3.84 9.14 0.00 -1.26 -2.16 105.19 113.85 2c1d n GLY 230 Ca -0.01 -0.57 -0.32 0.00 0.00 0.00 0.00 46.02 45.12 2c1d n GLY 230 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2c1d s PHE 231 N -2.44 3.42 0.62 1.61 0.40 -0.97 -1.94 117.98 118.69 2c1d s PHE 231 Ca 0.22 1.39 -0.17 0.00 -0.60 0.00 0.00 56.93 57.77 2c1d s PHE 231 Cb 0.19 -2.72 -0.02 0.00 0.51 0.00 0.00 43.02 40.98 2c1d s PHE 231 CO 0.53 -0.23 1.17 -2.14 0.70 0.00 0.00 175.22 175.25 2c1d s PRO 232 N -3.78 2.86 -0.04 0.24 0.02 -1.26 -4.77 135.00 128.28 2c1d s PRO 232 Ca 0.58 1.68 0.04 0.00 0.02 0.00 0.00 61.00 63.32 2c1d s PRO 232 Cb -0.10 -1.93 -0.00 0.00 0.02 0.00 0.00 34.50 32.49 2c1d s PRO 232 CO 0.27 -1.26 -0.17 0.99 -0.33 0.00 0.00 177.00 176.51 2c1d s THR 233 N -1.85 1.38 -0.32 0.99 2.01 -0.71 -2.63 115.64 114.51 2c1d s THR 233 Ca 0.74 -0.69 -0.21 0.00 0.31 0.00 0.00 61.69 61.84 2c1d s THR 233 Cb -0.27 -1.19 -0.01 0.00 0.01 0.00 0.00 72.50 71.04 2c1d s THR 233 CO 0.36 0.40 0.65 -0.47 -0.69 0.00 0.00 174.62 174.87 2c1d s TYR 234 N 0.07 3.20 -0.24 4.92 6.14 -0.19 -0.56 117.35 130.68 2c1d s TYR 234 Ca -0.04 0.56 -0.18 0.00 0.64 0.00 0.00 57.07 58.05 2c1d s TYR 234 Cb -0.11 -3.05 -0.03 0.00 0.42 0.00 0.00 41.96 39.19 2c1d s TYR 234 CO 0.02 -0.52 0.51 1.03 0.64 0.00 0.00 175.55 177.23 2c1d s ARG 235 N 2.67 4.10 0.39 4.97 0.52 -0.77 -1.75 118.95 129.08 2c1d s ARG 235 Ca 0.26 0.33 0.07 0.00 -0.52 0.00 0.00 55.73 55.88 2c1d s ARG 235 Cb -0.15 -3.62 0.82 0.00 0.52 0.00 0.00 34.95 32.52 2c1d s ARG 235 CO 0.13 -0.29 2.00 -0.07 0.02 0.00 0.00 175.30 177.09 2c1d h LEU 236 N 8.52 0.55 -0.60 2.53 3.38 -1.31 -1.32 115.31 127.06 2c1d h LEU 236 Ca -0.30 -0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.76 2c1d h LEU 236 Cb 1.14 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.70 2c1d h LEU 236 CO 0.72 0.37 0.21 0.50 0.09 0.00 0.00 178.44 180.33 2c1d h LYS 237 N 0.64 0.37 0.00 1.13 3.64 -1.83 -3.12 116.57 117.40 2c1d h LYS 237 Ca 0.25 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 2c1d h LYS 237 Cb 0.19 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2c1d h LYS 237 CO -0.07 0.24 -0.99 -0.25 -2.27 0.00 0.00 179.45 176.11 2c1d n ASP 238 N -5.02 0.70 -3.87 4.20 8.00 -0.77 -4.97 116.55 114.80 2c1d n ASP 238 Ca 0.09 -0.51 -0.29 0.00 0.71 0.00 0.00 54.79 54.79 2c1d n ASP 238 Cb 0.28 0.87 0.03 0.00 -0.02 0.00 0.00 41.12 42.28 2c1d n ASP 238 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2c1d n SER 239 N -1.71 -4.41 -3.49 -2.24 7.64 -0.57 -4.95 113.62 103.89 2c1d n SER 239 Ca 0.03 -0.77 -0.04 0.00 1.01 0.00 0.00 58.87 59.10 2c1d n SER 239 Cb 0.39 -3.96 0.01 0.00 -1.01 0.00 0.00 64.21 59.63 2c1d n SER 239 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2c1d s GLY 240 N -3.45 -0.01 0.45 0.23 0.00 -1.23 -5.02 107.32 98.29 2c1d s GLY 240 Ca 0.57 -0.18 -0.17 0.00 0.00 0.00 0.00 44.72 44.95 2c1d s GLY 240 CO 0.82 1.18 0.92 1.06 0.00 0.00 0.00 173.10 177.08 2c1d s MET 241 N -2.63 4.03 -0.00 2.90 -1.94 -1.26 -1.85 119.30 118.54 2c1d s MET 241 Ca 0.17 0.92 0.01 0.00 -1.71 0.00 0.00 55.69 55.08 2c1d s MET 241 Cb -0.02 -2.22 -0.00 0.00 2.01 0.00 0.00 34.83 34.60 2c1d s MET 241 CO 0.05 -0.11 -0.03 0.08 -0.01 0.00 0.00 175.02 174.99 2c1d s VAL 242 N -2.37 0.25 0.38 -6.03 1.01 0.28 -4.91 120.40 109.01 2c1d s VAL 242 Ca 0.58 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.45 2c1d s VAL 242 Cb -0.10 -0.22 -0.02 0.00 0.00 0.00 0.00 36.38 36.04 2c1d s VAL 242 CO 0.23 0.08 0.58 0.42 0.00 0.00 0.00 175.10 176.41 2c1d s THR 243 N -0.02 4.67 0.39 3.92 -4.23 -1.26 -1.75 115.64 117.37 2c1d s THR 243 Ca 0.01 -0.53 0.06 0.00 -1.18 0.00 0.00 61.69 60.05 2c1d s THR 243 Cb -0.02 -3.71 0.26 0.00 1.34 0.00 0.00 72.50 70.37 2c1d s THR 243 CO -0.00 -0.45 2.04 0.00 -0.54 0.00 0.00 174.62 175.66 2c1d h ALA 244 N 0.66 1.64 -0.68 3.99 0.00 -1.96 -1.41 119.26 121.50 2c1d h ALA 244 Ca -0.48 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.35 2c1d h ALA 244 Cb 1.23 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 2c1d h ALA 244 CO 0.59 0.32 0.29 1.96 0.00 0.00 0.00 179.25 182.41 2c1d h GLN 245 N 0.63 1.00 -0.12 0.00 1.08 -1.94 -1.73 115.11 114.03 2c1d h GLN 245 Ca 0.17 -0.17 -0.17 0.00 -1.45 0.00 0.00 58.65 57.03 2c1d h GLN 245 Cb -0.05 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.21 2c1d h GLN 245 CO -0.03 0.82 -0.64 1.25 -0.95 0.00 0.00 178.83 179.28 2c1d h HIS 246 N 0.95 0.58 0.08 2.96 2.76 -1.80 -2.53 115.15 118.15 2c1d h HIS 246 Ca 0.23 -0.23 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2c1d h HIS 246 Cb 0.18 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.03 2c1d h HIS 246 CO 0.01 0.96 -0.09 -0.09 -1.30 0.00 0.00 177.93 177.42 2c1d h ARG 247 N 0.33 -0.19 -0.77 5.26 9.65 -0.94 -2.82 114.38 124.89 2c1d h ARG 247 Ca -0.01 0.01 0.13 0.00 -1.10 0.00 0.00 59.98 59.01 2c1d h ARG 247 Cb 1.19 0.04 -0.09 0.00 -1.39 0.00 0.00 29.97 29.73 2c1d h ARG 247 CO 0.11 -0.13 0.36 0.74 2.80 0.00 0.00 179.97 183.85 2c1d h PHE 248 N -0.20 0.63 -0.38 2.20 0.05 -1.27 -2.21 116.94 115.76 2c1d h PHE 248 Ca 0.01 0.03 0.07 0.00 3.82 0.00 0.00 57.97 61.91 2c1d h PHE 248 Cb 0.20 -0.16 -0.07 0.00 2.00 0.00 0.00 35.95 37.91 2c1d h PHE 248 CO -0.12 0.15 -0.06 0.28 -0.18 0.00 0.00 178.31 178.38 2c1d h VAL 249 N 0.55 0.65 0.00 -0.55 2.07 -1.20 -2.36 116.25 115.40 2c1d h VAL 249 Ca 0.41 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.92 2c1d h VAL 249 Cb 0.56 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2c1d h VAL 249 CO -0.35 0.01 0.00 0.61 0.02 0.00 0.00 177.57 177.85 2c1d n GLY 250 N -1.29 0.64 0.00 2.17 0.00 -0.83 -2.06 105.19 103.83 2c1d n GLY 250 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2c1d n GLY 250 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2c1d n VAL 252 N 0.97 0.00 -0.31 1.61 0.24 -0.89 -1.62 118.33 118.33 2c1d n VAL 252 Ca 0.00 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.35 2c1d n VAL 252 Cb 0.15 0.00 0.19 0.00 -1.47 0.00 0.00 33.84 32.71 2c1d n VAL 252 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 2c1d h ARG 253 N 0.00 0.80 0.00 7.34 2.43 -1.63 -2.27 114.38 121.05 2c1d h ARG 253 Ca 0.00 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2c1d h ARG 253 Cb 0.00 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.37 2c1d h ARG 253 CO 0.00 0.53 0.00 -0.25 -1.51 0.00 0.00 179.97 178.74 2c1d n ASP 254 N -4.72 0.00 -0.11 -3.80 8.00 -0.64 -1.30 116.55 113.97 2c1d n ASP 254 Ca 0.15 -0.48 0.01 0.00 0.71 0.00 0.00 54.79 55.18 2c1d n ASP 254 Cb 0.32 -0.14 0.05 0.00 -0.02 0.00 0.00 41.12 41.32 2c1d n ASP 254 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2c1d n THR 255 N -1.14 0.08 -3.32 -3.53 -2.24 -0.85 -4.90 114.28 98.38 2c1d n THR 255 Ca 0.17 -0.08 -0.16 0.00 -2.27 0.00 0.00 64.05 61.71 2c1d n THR 255 Cb 0.15 0.03 0.08 0.00 -2.10 0.00 0.00 70.33 68.49 2c1d n THR 255 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2c1d n ARG 256 N -0.33 -4.95 -4.39 -0.78 1.74 -0.42 -1.46 116.66 106.06 2c1d n ARG 256 Ca 0.03 0.83 -0.20 0.00 -0.77 0.00 0.00 57.85 57.73 2c1d n ARG 256 Cb 0.05 -5.74 -0.10 0.00 -1.02 0.00 0.00 32.46 25.65 2c1d n ARG 256 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2c1d s ALA 257 N -3.36 2.21 -0.11 7.54 0.00 -1.12 -1.18 121.76 125.74 2c1d s ALA 257 Ca 0.15 -1.80 -0.29 0.00 0.00 0.00 0.00 51.96 50.02 2c1d s ALA 257 Cb -0.02 0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 2c1d s ALA 257 CO 0.71 -0.01 1.43 -2.00 0.00 0.00 0.00 175.76 175.89 2c1d s GLU 258 N -3.69 4.22 0.68 0.00 2.12 -1.26 -4.45 118.70 116.31 2c1d s GLU 258 Ca 0.27 1.89 -0.00 0.00 0.36 0.00 0.00 54.97 57.49 2c1d s GLU 258 Cb 0.02 -3.84 0.10 0.00 0.26 0.00 0.00 34.13 30.66 2c1d s GLU 258 CO 0.10 -0.75 0.94 -0.08 -0.54 0.00 0.00 175.26 174.92 2c1d s THR 259 N 3.65 2.26 0.23 -1.70 -1.32 -1.26 -4.87 115.64 112.63 2c1d s THR 259 Ca 0.63 -0.61 0.05 0.00 -1.21 0.00 0.00 61.69 60.55 2c1d s THR 259 Cb -0.27 -2.65 -0.03 0.00 -1.51 0.00 0.00 72.50 68.04 2c1d s THR 259 CO 0.21 0.00 0.31 -0.36 -2.21 0.00 0.00 174.62 172.57 2c1d s PHE 260 N -3.04 3.37 0.16 9.09 0.40 -1.26 -5.06 117.98 121.64 2c1d s PHE 260 Ca 0.64 -0.02 -0.30 0.00 -0.60 0.00 0.00 56.93 56.65 2c1d s PHE 260 Cb -0.07 -1.55 -0.07 0.00 0.51 0.00 0.00 43.02 41.84 2c1d s PHE 260 CO 0.43 0.47 1.14 0.21 0.70 0.00 0.00 175.22 178.16 2c1d s LYS 261 N -3.82 4.54 0.10 0.44 2.47 -1.26 -4.72 119.74 117.49 2c1d s LYS 261 Ca 0.34 1.76 -0.34 0.00 -1.56 0.00 0.00 55.97 56.16 2c1d s LYS 261 Cb -0.09 -3.28 -0.14 0.00 -1.46 0.00 0.00 37.83 32.86 2c1d s LYS 261 CO 0.28 -0.02 1.62 0.00 0.16 0.00 0.00 175.35 177.39 2c1d n ALA 262 N 2.69 1.03 -0.87 3.13 0.00 -1.26 -1.30 120.51 123.93 2c1d n ALA 262 Ca 0.04 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.90 2c1d n ALA 262 Cb 0.46 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.55 2c1d n ALA 262 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c1d n GLY 263 N 3.55 0.88 3.74 0.00 0.00 -1.26 -4.97 105.19 107.13 2c1d n GLY 263 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2c1d n GLY 263 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2c1d s SER 264 N -2.84 4.68 0.26 1.61 1.04 -0.42 -4.74 113.70 113.29 2c1d s SER 264 Ca 0.00 2.36 -0.02 0.00 0.48 0.00 0.00 55.95 58.77 2c1d s SER 264 Cb 0.00 -2.59 0.54 0.00 0.10 0.00 0.00 66.02 64.06 2c1d s SER 264 CO 0.00 -1.93 1.70 0.44 0.98 0.00 0.00 173.24 174.43 2c1d h ASP 265 N 0.25 0.17 -0.40 7.02 3.32 -1.96 0.16 116.42 124.98 2c1d h ASP 265 Ca -0.49 0.14 -0.09 0.00 0.02 0.00 0.00 57.03 56.61 2c1d h ASP 265 Cb 1.30 0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.98 2c1d h ASP 265 CO 0.52 0.01 -0.07 0.44 -1.72 0.00 0.00 179.24 178.42 2c1d h ASP 266 N 0.36 0.82 1.50 6.45 5.19 -1.94 -0.97 116.42 127.82 2c1d h ASP 266 Ca 0.46 -0.23 -0.07 0.00 -0.62 0.00 0.00 57.03 56.57 2c1d h ASP 266 Cb 0.78 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 40.06 2c1d h ASP 266 CO -0.49 0.92 -0.31 -0.26 -3.12 0.00 0.00 179.24 175.98 2c1d h PHE 267 N 0.76 0.00 -0.30 4.55 0.05 -1.48 -0.56 116.94 119.97 2c1d h PHE 267 Ca 0.13 0.00 -0.08 0.00 3.82 0.00 0.00 57.97 61.84 2c1d h PHE 267 Cb 0.56 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.51 2c1d h PHE 267 CO 0.03 0.31 -0.13 0.87 -0.18 0.00 0.00 178.31 179.21 2c1d h LYS 268 N 0.00 0.61 -0.75 1.51 1.57 -0.43 -0.31 116.57 118.77 2c1d h LYS 268 Ca -0.00 -0.26 -0.02 0.00 -1.87 0.00 0.00 60.65 58.50 2c1d h LYS 268 Cb 1.14 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.40 2c1d h LYS 268 CO 0.04 0.84 0.41 0.00 -0.57 0.00 0.00 179.45 180.17 2c1d h ALA 269 N 0.76 0.96 -0.62 3.86 0.00 -1.05 -1.82 119.26 121.36 2c1d h ALA 269 Ca 0.07 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2c1d h ALA 269 Cb 0.65 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2c1d h ALA 269 CO 0.04 0.48 0.27 1.25 0.00 0.00 0.00 179.25 181.29 2c1d h LEU 270 N 1.04 0.83 -1.14 0.00 5.85 -1.04 -1.39 115.31 119.46 2c1d h LEU 270 Ca 0.26 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 2c1d h LEU 270 Cb 0.04 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 2c1d h LEU 270 CO -0.04 0.75 0.31 -0.08 -0.34 0.00 0.00 178.44 179.05 2c1d h GLU 271 N 0.85 0.92 -0.21 1.25 4.81 -0.73 0.11 114.58 121.59 2c1d h GLU 271 Ca 0.21 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.31 2c1d h GLU 271 Cb 0.16 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 2c1d h GLU 271 CO -0.02 0.71 0.08 1.25 -0.73 0.00 0.00 179.01 180.29 2c1d h LEU 272 N 0.92 0.29 -0.15 1.64 5.85 -1.02 -0.74 115.31 122.10 2c1d h LEU 272 Ca 0.23 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 2c1d h LEU 272 Cb 0.09 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2c1d h LEU 272 CO -0.03 0.39 0.01 0.22 -0.34 0.00 0.00 178.44 178.69 2c1d h TYR 273 N 0.18 0.29 -0.40 1.25 3.20 -0.86 -2.77 116.97 117.85 2c1d h TYR 273 Ca 0.07 -0.05 -0.14 0.00 3.14 0.00 0.00 58.73 61.75 2c1d h TYR 273 Cb 0.20 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 2c1d h TYR 273 CO -0.01 0.48 -0.30 0.28 -1.64 0.00 0.00 178.16 176.97 2c1d h VAL 274 N 0.02 1.27 -0.71 1.81 2.07 -0.80 -2.61 116.25 117.30 2c1d h VAL 274 Ca 0.04 -1.47 0.14 0.00 0.82 0.00 0.00 66.70 66.24 2c1d h VAL 274 Cb 0.36 1.32 -0.10 0.00 -1.52 0.00 0.00 31.29 31.35 2c1d h VAL 274 CO 0.01 0.49 0.22 0.00 0.02 0.00 0.00 177.57 178.31 2c1d h ALA 275 N 0.79 0.94 0.00 1.67 0.00 -1.14 -1.85 119.26 119.68 2c1d h ALA 275 Ca 0.08 0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 2c1d h ALA 275 Cb 0.89 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2c1d h ALA 275 CO 0.08 -0.28 -0.24 0.66 0.00 0.00 0.00 179.25 179.47 2c1d h SER 276 N 0.34 0.00 0.32 0.00 4.64 -1.17 -2.11 113.55 115.56 2c1d h SER 276 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2c1d h SER 276 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 2c1d h SER 276 CO -0.44 0.24 0.00 0.03 -0.87 0.00 0.00 176.83 175.78 2c1d h ARG 277 N 0.00 0.00 -0.38 4.77 3.08 -1.06 -2.09 114.38 118.70 2c1d h ARG 277 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2c1d h ARG 277 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.69 2c1d h ARG 277 CO 0.03 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.34 2c1d n GLY 278 N -0.74 3.51 3.67 0.04 0.00 -0.79 -4.75 105.19 106.13 2c1d n GLY 278 Ca -0.02 -0.90 -0.49 0.00 0.00 0.00 0.00 46.02 44.61 2c1d n GLY 278 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2c1d n ASN 279 N 0.04 2.88 0.00 1.61 3.02 -0.79 -1.49 115.26 120.53 2c1d n ASN 279 Ca 0.22 1.05 0.00 0.00 -0.03 0.00 0.00 54.58 55.82 2c1d n ASN 279 Cb 0.88 -1.33 0.00 0.00 -0.61 0.00 0.00 39.78 38.72 2c1d n ASN 279 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2c1d n GLY 280 N 3.70 2.37 3.75 7.41 0.00 -0.43 -4.30 105.19 117.69 2c1d n GLY 280 Ca 0.20 -0.40 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 2c1d n GLY 280 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c1d s LEU 281 N 0.00 3.40 0.42 0.99 1.43 -0.56 -4.67 118.68 119.70 2c1d s LEU 281 Ca 0.00 2.19 -0.22 0.00 -1.03 0.00 0.00 54.13 55.07 2c1d s LEU 281 Cb 0.00 -4.57 -0.10 0.00 0.03 0.00 0.00 46.19 41.55 2c1d s LEU 281 CO 0.00 -1.88 1.00 -0.44 0.23 0.00 0.00 176.35 175.26 2c1d s SER 282 N -2.22 6.79 0.03 2.29 0.01 -0.73 -0.33 113.70 119.54 2c1d s SER 282 Ca 0.71 1.86 -0.30 0.00 1.31 0.00 0.00 55.95 59.53 2c1d s SER 282 Cb -0.25 -2.56 -0.08 0.00 0.21 0.00 0.00 66.02 63.33 2c1d s SER 282 CO 0.41 -0.46 1.88 -0.69 0.41 0.00 0.00 173.24 174.79 2c1d s VAL 283 N -1.93 3.06 -0.33 3.43 1.01 0.50 -4.72 120.40 121.43 2c1d s VAL 283 Ca 0.61 0.17 0.26 0.00 0.00 0.00 0.00 61.98 63.01 2c1d s VAL 283 Cb -0.15 -3.11 0.35 0.00 0.00 0.00 0.00 36.38 33.47 2c1d s VAL 283 CO 0.20 -0.01 1.72 -0.33 0.00 0.00 0.00 175.10 176.68 2c1d h GLU 284 N 10.05 0.00 0.00 2.72 5.08 -1.75 -0.74 114.58 129.95 2c1d h GLU 284 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 2c1d h GLU 284 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 2c1d h GLU 284 CO 0.94 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 179.36 2c1d n GLY 285 N 0.81 1.16 2.84 -3.84 0.00 -1.26 -4.71 105.19 100.19 2c1d n GLY 285 Ca 0.03 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 45.34 2c1d n GLY 285 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2c1d s VAL 286 N 0.00 0.78 0.48 1.61 -7.23 -1.26 -4.02 120.40 110.76 2c1d s VAL 286 Ca 0.00 -0.31 0.02 0.00 -1.81 0.00 0.00 61.98 59.88 2c1d s VAL 286 Cb 0.00 -0.96 0.01 0.00 0.56 0.00 0.00 36.38 35.99 2c1d s VAL 286 CO 0.00 0.18 0.69 -0.94 -0.31 0.00 0.00 175.10 174.73 2c1d s SER 287 N 1.79 5.58 -0.10 4.85 1.04 -0.82 -4.92 113.70 121.13 2c1d s SER 287 Ca 0.03 0.07 0.04 0.00 0.48 0.00 0.00 55.95 56.56 2c1d s SER 287 Cb -0.14 -1.15 0.00 0.00 0.10 0.00 0.00 66.02 64.83 2c1d s SER 287 CO -0.07 -0.88 -0.22 -0.69 0.98 0.00 0.00 173.24 172.36 2c1d s VAL 288 N -2.60 1.93 0.25 5.02 1.01 -1.26 -1.03 120.40 123.71 2c1d s VAL 288 Ca 0.53 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.58 2c1d s VAL 288 Cb -0.10 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 2c1d s VAL 288 CO 0.37 0.53 0.14 -0.13 0.00 0.00 0.00 175.10 176.02 2c1d s ARG 289 N 0.44 1.39 0.00 2.72 1.81 -0.72 -4.88 118.95 119.71 2c1d s ARG 289 Ca -0.17 -1.76 0.11 0.00 -1.72 0.00 0.00 55.73 52.18 2c1d s ARG 289 Cb -0.17 0.07 0.64 0.00 -0.45 0.00 0.00 34.95 35.04 2c1d s ARG 289 CO 0.07 -0.41 1.08 1.58 -0.68 0.00 0.00 175.30 176.94