#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 4.28 0.69 0.11 0.04 -1.26 -4.87 135.00 133.98 2c1d s PRO 28 Ca 0.00 2.28 -0.12 0.00 0.04 0.00 0.00 61.00 63.20 2c1d s PRO 28 Cb 0.00 -3.12 0.01 0.00 0.04 0.00 0.00 34.50 31.44 2c1d s PRO 28 CO 0.00 -0.41 1.08 0.54 0.04 0.00 0.00 177.00 178.25 2c1d s VAL 29 N 0.02 3.63 -0.40 -0.36 0.11 -0.87 -5.03 120.40 117.49 2c1d s VAL 29 Ca 0.59 0.61 -0.20 0.00 -2.93 0.00 0.00 61.98 60.06 2c1d s VAL 29 Cb -0.41 -3.19 0.01 0.00 -1.53 0.00 0.00 36.38 31.26 2c1d s VAL 29 CO 0.43 -0.61 0.61 -1.61 -3.33 0.00 0.00 175.10 170.58 2c1d s GLU 30 N -4.65 3.42 0.18 1.54 2.02 -1.26 -4.98 118.70 114.97 2c1d s GLU 30 Ca 0.62 -0.26 -0.23 0.00 0.02 0.00 0.00 54.97 55.11 2c1d s GLU 30 Cb -0.16 -3.89 0.06 0.00 0.10 0.00 0.00 34.13 30.23 2c1d s GLU 30 CO 0.49 -0.88 0.74 0.34 0.02 0.00 0.00 175.26 175.98 2c1d s ASP 31 N 1.90 -0.37 0.03 -0.19 -1.08 -1.26 -5.17 116.67 110.53 2c1d s ASP 31 Ca 0.22 -0.28 0.04 0.00 -0.52 0.00 0.00 52.55 52.01 2c1d s ASP 31 Cb -0.15 0.60 -0.02 0.00 -1.46 0.00 0.00 42.92 41.89 2c1d s ASP 31 CO 0.17 -1.05 -0.13 -0.83 0.52 0.00 0.00 175.17 173.85 2c1d s GLY 32 N -2.81 0.74 -0.23 2.66 0.00 -1.26 -5.03 107.32 101.39 2c1d s GLY 32 Ca 0.07 -0.77 -0.02 0.00 0.00 0.00 0.00 44.72 44.00 2c1d s GLY 32 CO -0.03 -0.74 -0.08 -2.27 0.00 0.00 0.00 173.10 169.98 2c1d s LEU 33 N -1.03 2.93 -0.14 0.66 2.96 -1.26 -5.07 118.68 117.73 2c1d s LEU 33 Ca 0.01 -0.72 -0.01 0.00 -0.22 0.00 0.00 54.13 53.19 2c1d s LEU 33 Cb -0.07 -1.65 0.04 0.00 0.50 0.00 0.00 46.19 45.01 2c1d s LEU 33 CO 0.01 -0.08 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.23 2c1d s VAL 34 N 1.35 0.90 -0.06 1.68 1.01 -1.26 -1.89 120.40 122.14 2c1d s VAL 34 Ca 0.02 -0.43 -0.22 0.00 0.00 0.00 0.00 61.98 61.35 2c1d s VAL 34 Cb -0.15 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 2c1d s VAL 34 CO -0.06 0.15 0.63 -0.63 0.00 0.00 0.00 175.10 175.20 2c1d s ILE 35 N 1.73 5.03 -0.03 2.22 1.01 -0.07 -4.81 121.20 126.28 2c1d s ILE 35 Ca 0.02 1.30 -0.30 0.00 0.00 0.00 0.00 60.65 61.67 2c1d s ILE 35 Cb -0.14 -3.97 -0.03 0.00 0.01 0.00 0.00 42.46 38.33 2c1d s ILE 35 CO -0.07 0.31 1.01 -1.61 0.00 0.00 0.00 174.94 174.58 2c1d s GLU 36 N 0.49 4.50 0.25 2.79 2.02 -0.18 -1.59 118.70 126.99 2c1d s GLU 36 Ca 0.34 1.45 0.01 0.00 0.02 0.00 0.00 54.97 56.78 2c1d s GLU 36 Cb -0.17 -3.48 -0.05 0.00 0.10 0.00 0.00 34.13 30.53 2c1d s GLU 36 CO 0.16 -0.16 0.11 0.95 0.02 0.00 0.00 175.26 176.34 2c1d s THR 37 N 1.35 0.43 0.61 3.63 -4.23 -1.21 -1.45 115.64 114.77 2c1d s THR 37 Ca 0.52 -2.00 0.29 0.00 -1.18 0.00 0.00 61.69 59.32 2c1d s THR 37 Cb -0.21 -2.61 0.36 0.00 1.34 0.00 0.00 72.50 71.38 2c1d s THR 37 CO 0.25 0.00 1.97 0.44 -0.54 0.00 0.00 174.62 176.74 2c1d h ASP 38 N 2.43 0.00 -0.00 3.99 3.45 -2.01 -2.69 116.42 121.59 2c1d h ASP 38 Ca -0.38 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.08 2c1d h ASP 38 Cb 1.25 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 40.02 2c1d h ASP 38 CO 0.59 0.00 -0.30 -1.54 -1.57 0.00 0.00 179.24 176.42 2c1d n SER 39 N -3.52 1.98 0.00 6.45 3.41 -1.26 -5.11 113.62 115.57 2c1d n SER 39 Ca 0.04 -3.58 0.00 0.00 -0.26 0.00 0.00 58.87 55.06 2c1d n SER 39 Cb 0.49 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 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 -1.24 1.20 3.77 5.00 0.00 -1.01 -5.01 105.19 107.89 2c1d n GLY 40 Ca 0.18 -2.02 -0.39 0.00 0.00 0.00 0.00 46.02 43.80 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 -1.85 3.86 -0.11 1.61 0.04 -1.26 -3.34 135.00 133.96 2c1d s PRO 41 Ca 0.00 2.00 -0.00 0.00 0.04 0.00 0.00 61.00 63.04 2c1d s PRO 41 Cb 0.00 -2.62 0.02 0.00 0.04 0.00 0.00 34.50 31.95 2c1d s PRO 41 CO 0.00 -0.53 -0.08 0.54 0.04 0.00 0.00 177.00 176.97 2c1d s VAL 42 N -1.36 1.05 0.16 -0.36 0.11 -0.62 -4.94 120.40 114.43 2c1d s VAL 42 Ca 0.60 -0.31 -0.30 0.00 -2.93 0.00 0.00 61.98 59.03 2c1d s VAL 42 Cb -0.34 -1.06 -0.07 0.00 -1.53 0.00 0.00 36.38 33.38 2c1d s VAL 42 CO 0.43 0.37 1.01 -1.61 -3.33 0.00 0.00 175.10 171.98 2c1d s GLU 43 N 1.62 4.68 -0.20 1.54 2.02 -1.26 -0.89 118.70 126.21 2c1d s GLU 43 Ca 0.04 1.57 -0.03 0.00 0.02 0.00 0.00 54.97 56.56 2c1d s GLU 43 Cb -0.13 -3.32 -0.01 0.00 0.10 0.00 0.00 34.13 30.77 2c1d s GLU 43 CO -0.07 0.20 -0.06 0.42 0.02 0.00 0.00 175.26 175.77 2c1d s ILE 44 N -0.28 3.35 -0.36 -1.63 -1.09 -0.79 -4.64 121.20 115.76 2c1d s ILE 44 Ca 0.47 -0.51 -0.29 0.00 -2.23 0.00 0.00 60.65 58.09 2c1d s ILE 44 Cb -0.26 -2.50 0.01 0.00 -1.58 0.00 0.00 42.46 38.13 2c1d s ILE 44 CO 0.32 0.45 1.28 -0.69 -1.23 0.00 0.00 174.94 175.07 2c1d s VAL 45 N 1.18 4.13 -1.09 2.92 1.01 -1.26 -4.42 120.40 122.87 2c1d s VAL 45 Ca 0.02 1.23 0.10 0.00 0.00 0.00 0.00 61.98 63.33 2c1d s VAL 45 Cb -0.14 -4.27 0.04 0.00 0.00 0.00 0.00 36.38 32.00 2c1d s VAL 45 CO -0.01 -0.64 0.72 0.35 0.00 0.00 0.00 175.10 175.52 2c1d n THR 46 N 6.50 0.00 -3.68 3.92 -2.24 -1.26 -1.67 114.28 115.84 2c1d n THR 46 Ca 0.14 -0.45 -0.10 0.00 -2.27 0.00 0.00 64.05 61.38 2c1d n THR 46 Cb 0.47 1.16 -0.11 0.00 -2.10 0.00 0.00 70.33 69.76 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 0.34 0.24 -0.78 2.20 -1.26 -0.62 119.74 118.77 2c1d s LYS 47 Ca 0.10 0.88 -0.21 0.00 -0.36 0.00 0.00 55.97 56.38 2c1d s LYS 47 Cb 0.08 0.12 0.05 0.00 -1.51 0.00 0.00 37.83 36.57 2c1d s LYS 47 CO 0.19 -0.21 0.86 -0.08 -0.36 0.00 0.00 175.35 175.75 2c1d s THR 48 N 1.99 0.00 0.43 3.43 -1.32 -0.69 -5.01 115.64 114.47 2c1d s THR 48 Ca -0.05 -0.83 -0.24 0.00 -1.21 0.00 0.00 61.69 59.36 2c1d s THR 48 Cb -0.10 -2.30 -0.08 0.00 -1.51 0.00 0.00 72.50 68.51 2c1d s THR 48 CO -0.12 0.00 1.16 0.00 -2.21 0.00 0.00 174.62 173.44 2c1d s ALA 49 N -3.13 3.05 0.79 11.08 0.00 -1.26 -1.33 121.76 130.95 2c1d s ALA 49 Ca 0.14 0.93 -0.11 0.00 0.00 0.00 0.00 51.96 52.91 2c1d s ALA 49 Cb -0.04 -3.37 0.06 0.00 0.00 0.00 0.00 23.12 19.77 2c1d s ALA 49 CO 0.06 -0.57 1.08 -1.25 0.00 0.00 0.00 175.76 175.09 2c1d s PRO 50 N -2.53 2.18 0.76 0.00 0.04 -1.26 -4.70 135.00 129.49 2c1d s PRO 50 Ca 0.61 0.92 -0.14 0.00 0.04 0.00 0.00 61.00 62.42 2c1d s PRO 50 Cb -0.29 -1.91 0.06 0.00 0.04 0.00 0.00 34.50 32.40 2c1d s PRO 50 CO 0.35 -1.63 1.21 -1.25 0.04 0.00 0.00 177.00 175.73 2c1d s PRO 51 N -5.01 1.91 0.35 0.56 0.04 -1.26 -4.78 135.00 126.81 2c1d s PRO 51 Ca 0.61 1.77 0.07 0.00 0.04 0.00 0.00 61.00 63.49 2c1d s PRO 51 Cb -0.16 -1.80 0.75 0.00 0.04 0.00 0.00 34.50 33.33 2c1d s PRO 51 CO 0.56 -2.01 1.91 0.00 0.04 0.00 0.00 177.00 177.49 2c1d h ALA 52 N -0.56 1.74 0.00 8.56 0.00 -1.97 0.22 119.26 127.26 2c1d h ALA 52 Ca -0.47 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 2c1d h ALA 52 Cb 1.30 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 2c1d h ALA 52 CO 0.48 0.08 -0.01 0.27 0.00 0.00 0.00 179.25 180.07 2c1d h PHE 53 N 0.76 0.00 -0.44 0.00 -5.15 -1.99 -1.66 116.94 108.47 2c1d h PHE 53 Ca 0.39 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.16 2c1d h PHE 53 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.64 2c1d h PHE 53 CO -0.00 0.01 0.00 -0.11 -2.00 0.00 0.00 178.31 176.21 2c1d n LEU 54 N -3.27 3.24 -0.17 2.10 7.94 0.05 -4.69 117.00 122.20 2c1d n LEU 54 Ca -0.02 -1.81 0.03 0.00 -1.11 0.00 0.00 56.01 53.10 2c1d n LEU 54 Cb 0.12 -0.29 0.31 0.00 0.53 0.00 0.00 43.42 44.10 2c1d n LEU 54 CO 0.23 0.77 1.22 0.00 -1.11 0.00 0.00 177.39 178.51 2c1d h ALA 55 N 3.17 1.58 -0.15 1.96 0.00 -1.10 -1.74 119.26 123.00 2c1d h ALA 55 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2c1d h ALA 55 Cb 0.83 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2c1d h ALA 55 CO 0.00 0.35 0.00 -3.47 0.00 0.00 0.00 179.25 176.13 2c1d n ASP 56 N -4.45 1.54 -0.10 0.00 2.03 -1.26 -4.26 116.55 110.05 2c1d n ASP 56 Ca 0.08 -1.68 -0.22 0.00 0.52 0.00 0.00 54.79 53.50 2c1d n ASP 56 Cb 0.10 -0.09 -0.07 0.00 -0.72 0.00 0.00 41.12 40.34 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 0.24 1.11 -4.72 5.18 -1.04 -0.70 -5.02 114.28 109.33 2c1d n THR 57 Ca 0.16 -0.28 -0.27 0.00 -2.04 0.00 0.00 64.05 61.62 2c1d n THR 57 Cb 0.31 -1.78 -0.14 0.00 -1.82 0.00 0.00 70.33 66.90 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 -2.37 1.96 0.12 -1.42 0.08 -0.95 -5.02 117.98 110.38 2c1d s PHE 58 Ca -0.28 -0.38 -0.05 0.00 0.12 0.00 0.00 56.93 56.33 2c1d s PHE 58 Cb 0.11 -1.17 -0.12 0.00 -0.57 0.00 0.00 43.02 41.27 2c1d s PHE 58 CO 0.36 0.10 1.28 -0.44 -0.10 0.00 0.00 175.22 176.42 2c1d h ASP 59 N 4.86 0.56 -3.61 1.36 3.45 -1.87 -3.41 116.42 117.75 2c1d h ASP 59 Ca -0.44 -0.46 -0.23 0.00 0.43 0.00 0.00 57.03 56.34 2c1d h ASP 59 Cb 1.15 -0.17 -0.29 0.00 -0.56 0.00 0.00 39.33 39.46 2c1d h ASP 59 CO 0.44 1.26 -0.60 -0.89 -1.57 0.00 0.00 179.24 177.88 2c1d s THR 60 N -3.22 -0.02 0.04 0.35 2.01 -1.26 -4.40 115.64 109.13 2c1d s THR 60 Ca -0.06 0.09 -0.11 0.00 0.31 0.00 0.00 61.69 61.92 2c1d s THR 60 Cb 0.08 -0.19 -0.06 0.00 0.01 0.00 0.00 72.50 72.35 2c1d s THR 60 CO 0.87 0.04 0.38 0.27 -0.69 0.00 0.00 174.62 175.49 2c1d s ILE 61 N 0.59 5.12 0.02 1.82 -4.36 -0.44 -4.90 121.20 119.04 2c1d s ILE 61 Ca -0.04 0.52 0.06 0.00 -0.26 0.00 0.00 60.65 60.92 2c1d s ILE 61 Cb -0.06 -3.64 -0.02 0.00 1.25 0.00 0.00 42.46 39.99 2c1d s ILE 61 CO -0.03 0.39 -0.17 -0.31 0.24 0.00 0.00 174.94 175.07 2c1d s TYR 62 N -1.28 1.48 0.47 1.37 1.51 -1.26 -1.70 117.35 117.95 2c1d s TYR 62 Ca 0.29 -0.32 -0.24 0.00 -1.01 0.00 0.00 57.07 55.79 2c1d s TYR 62 Cb -0.14 -0.92 -0.08 0.00 -0.11 0.00 0.00 41.96 40.71 2c1d s TYR 62 CO 0.16 0.02 1.35 0.45 -1.11 0.00 0.00 175.55 176.42 2c1d n SER 63 N 2.27 2.87 0.00 2.29 2.88 0.21 -4.73 113.62 119.41 2c1d n SER 63 Ca -0.16 1.07 0.23 0.00 -1.33 0.00 0.00 58.87 58.68 2c1d n SER 63 Cb 0.54 -1.56 0.72 0.00 -0.75 0.00 0.00 64.21 63.16 2c1d n SER 63 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 2c1d h GLY 64 N 1.96 0.00 0.15 0.46 0.00 -1.91 -1.67 103.07 102.06 2c1d h GLY 64 Ca -0.50 0.00 0.19 0.00 0.00 0.00 0.00 47.33 47.02 2c1d h GLY 64 CO 0.59 0.00 0.61 -0.25 0.00 0.00 0.00 176.54 177.50 2c1d h TRP 65 N 0.00 1.08 0.00 5.60 7.01 -1.91 -2.07 115.95 125.66 2c1d h TRP 65 Ca 0.27 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.31 2c1d h TRP 65 Cb 1.34 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 28.07 2c1d h TRP 65 CO 0.00 0.25 0.00 0.72 -2.79 0.00 0.00 178.44 176.62 2c1d n HIS 66 N -4.76 0.56 0.57 2.65 8.25 -0.63 -2.31 115.22 119.55 2c1d n HIS 66 Ca 0.23 0.25 0.10 0.00 -0.26 0.00 0.00 57.72 58.04 2c1d n HIS 66 Cb 0.56 -0.89 0.14 0.00 1.12 0.00 0.00 29.99 30.91 2c1d n HIS 66 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2c1d n PHE 67 N -2.03 0.22 -3.66 4.41 3.01 -0.78 -2.06 117.46 116.57 2c1d n PHE 67 Ca 0.01 -0.13 -0.29 0.00 1.01 0.00 0.00 57.45 58.05 2c1d n PHE 67 Cb 0.14 -0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.57 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 -1.56 3.57 0.94 -1.08 1.81 -0.98 -4.76 118.95 116.90 2c1d s ARG 68 Ca 0.29 -0.21 -0.11 0.00 -1.72 0.00 0.00 55.73 53.98 2c1d s ARG 68 Cb 0.19 -2.83 0.16 0.00 -0.45 0.00 0.00 34.95 32.01 2c1d s ARG 68 CO 0.27 0.42 1.09 0.16 -0.68 0.00 0.00 175.30 176.56 2c1d s ASP 69 N -2.85 2.95 0.24 0.23 3.84 -1.26 -4.71 116.67 115.10 2c1d s ASP 69 Ca 0.40 1.65 -0.06 0.00 -0.00 0.00 0.00 52.55 54.54 2c1d s ASP 69 Cb -0.11 -2.29 0.24 0.00 -1.38 0.00 0.00 42.92 39.37 2c1d s ASP 69 CO 0.27 -2.99 1.83 -0.78 -0.00 0.00 0.00 175.17 173.50 2c1d h ASP 70 N -1.79 1.06 0.12 2.11 3.58 -1.98 -1.05 116.42 118.46 2c1d h ASP 70 Ca -0.50 -0.13 -0.05 0.00 0.42 0.00 0.00 57.03 56.77 2c1d h ASP 70 Cb 1.29 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 42.05 2c1d h ASP 70 CO 0.51 0.90 -0.19 0.77 -2.88 0.00 0.00 179.24 178.34 2c1d h SER 71 N 1.16 0.15 -0.02 2.28 4.64 -2.00 -0.47 113.55 119.30 2c1d h SER 71 Ca 0.28 -0.03 -0.10 0.00 -0.47 0.00 0.00 61.79 61.47 2c1d h SER 71 Cb 0.12 -0.04 0.01 0.00 -0.31 0.00 0.00 62.40 62.18 2c1d h SER 71 CO -0.03 0.36 -0.37 0.74 -0.87 0.00 0.00 176.83 176.65 2c1d h THR 72 N 0.15 1.48 -0.92 2.95 2.02 -1.81 -3.11 112.91 113.66 2c1d h THR 72 Ca 0.03 -1.93 0.18 0.00 0.77 0.00 0.00 66.41 65.46 2c1d h THR 72 Cb 0.43 2.61 -0.08 0.00 -1.74 0.00 0.00 68.15 69.38 2c1d h THR 72 CO 0.03 0.54 0.59 0.03 0.37 0.00 0.00 175.52 177.09 2c1d h ARG 73 N -0.30 0.57 -0.20 6.66 3.08 -0.90 -1.87 114.38 121.42 2c1d h ARG 73 Ca -0.04 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 2c1d h ARG 73 Cb 1.09 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.99 2c1d h ARG 73 CO 0.07 0.38 -0.22 -0.44 -1.07 0.00 0.00 179.97 178.69 2c1d h ASP 74 N 0.59 0.36 0.07 7.04 3.45 -1.02 -2.59 116.42 124.31 2c1d h ASP 74 Ca 0.49 -0.11 -0.01 0.00 0.43 0.00 0.00 57.03 57.84 2c1d h ASP 74 Cb 0.95 -0.10 -0.00 0.00 -0.56 0.00 0.00 39.33 39.62 2c1d h ASP 74 CO -0.23 0.59 -0.03 -0.07 -1.57 0.00 0.00 179.24 177.93 2c1d h LEU 75 N 0.33 0.00 0.00 1.55 3.38 -1.32 -1.20 115.31 118.04 2c1d h LEU 75 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2c1d h LEU 75 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 2c1d h LEU 75 CO 0.04 0.03 -0.50 -0.08 0.09 0.00 0.00 178.44 178.02 2c1d h GLU 76 N 0.00 0.00 0.00 1.13 4.81 -1.56 -3.12 114.58 115.85 2c1d h GLU 76 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2c1d h GLU 76 Cb 0.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.45 2c1d h GLU 76 CO 0.00 0.00 0.00 0.54 -0.73 0.00 0.00 179.01 178.82 2c1d n ARG 77 N -2.40 0.22 -3.66 1.92 1.74 -0.45 -4.71 116.66 109.33 2c1d n ARG 77 Ca 0.03 0.33 -0.15 0.00 -0.77 0.00 0.00 57.85 57.29 2c1d n ARG 77 Cb 0.47 -1.84 -0.08 0.00 -1.02 0.00 0.00 32.46 30.00 2c1d n ARG 77 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2c1d s ASP 78 N -4.36 -0.46 0.37 0.55 1.47 -1.26 -1.01 116.67 111.97 2c1d s ASP 78 Ca 0.07 0.61 0.04 0.00 1.18 0.00 0.00 52.55 54.45 2c1d s ASP 78 Cb 0.11 0.63 0.72 0.00 -0.34 0.00 0.00 42.92 44.04 2c1d s ASP 78 CO 0.48 -0.42 2.02 0.44 0.68 0.00 0.00 175.17 178.38 2c1d h ASP 79 N 4.04 0.64 -0.96 2.11 3.32 -1.53 -2.07 116.42 121.98 2c1d h ASP 79 Ca -0.28 -0.01 0.05 0.00 0.02 0.00 0.00 57.03 56.80 2c1d h ASP 79 Cb 1.16 -0.16 -0.06 0.00 0.22 0.00 0.00 39.33 40.50 2c1d h ASP 79 CO 0.32 0.46 0.62 0.15 -1.72 0.00 0.00 179.24 179.07 2c1d h PHE 80 N 0.76 1.16 0.00 4.55 3.57 -1.95 -2.89 116.94 122.13 2c1d h PHE 80 Ca 0.22 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.75 2c1d h PHE 80 Cb -0.04 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 38.31 2c1d h PHE 80 CO -0.00 0.64 -0.73 -0.44 -2.23 0.00 0.00 178.31 175.55 2c1d h ASP 81 N 1.18 0.00 -3.66 0.41 3.32 -1.69 -3.46 116.42 112.51 2c1d h ASP 81 Ca 0.39 -0.19 -0.56 0.00 0.02 0.00 0.00 57.03 56.69 2c1d h ASP 81 Cb 0.06 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.54 2c1d h ASP 81 CO -0.14 0.10 0.90 0.21 -1.72 0.00 0.00 179.24 178.58 2c1d s ASN 82 N -4.42 6.66 0.60 6.45 3.04 -0.86 -4.87 114.94 121.54 2c1d s ASN 82 Ca 0.05 0.52 0.33 0.00 0.04 0.00 0.00 52.86 53.80 2c1d s ASN 82 Cb 0.13 -2.54 1.94 0.00 -1.54 0.00 0.00 41.25 39.23 2c1d s ASN 82 CO 0.74 -1.20 2.26 -0.65 -3.04 0.00 0.00 177.10 175.22 2c1d h PRO 83 N 9.07 0.00 0.00 0.43 0.11 -1.88 -2.38 132.00 137.36 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 1.11 0.01 -0.09 0.00 -0.21 0.00 0.00 178.00 178.82 2c1d h ALA 84 N 1.99 1.66 0.00 -0.75 0.00 -1.91 -2.94 119.26 117.31 2c1d h ALA 84 Ca -0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2c1d h ALA 84 Cb 0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2c1d h ALA 84 CO 0.00 0.12 -0.02 0.52 0.00 0.00 0.00 179.25 179.87 2c1d h MET 85 N 0.00 0.00 -0.75 0.00 2.86 -1.74 0.04 114.93 115.34 2c1d h MET 85 Ca -0.00 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 2c1d h MET 85 Cb 0.19 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.81 2c1d h MET 85 CO 0.01 0.02 0.32 0.28 1.06 0.00 0.00 176.91 178.60 2c1d h VAL 86 N 0.00 1.25 0.00 -2.22 2.07 -1.72 -1.71 116.25 113.91 2c1d h VAL 86 Ca -0.00 -0.75 -0.19 0.00 0.82 0.00 0.00 66.70 66.59 2c1d h VAL 86 Cb 0.13 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.21 2c1d h VAL 86 CO 0.00 0.31 -1.02 -0.26 0.02 0.00 0.00 177.57 176.62 2c1d h PHE 87 N 1.07 0.00 -0.47 1.57 -1.00 -1.20 -1.74 116.94 115.18 2c1d h PHE 87 Ca 0.25 0.00 0.02 0.00 2.81 0.00 0.00 57.97 61.05 2c1d h PHE 87 Cb 0.17 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.70 2c1d h PHE 87 CO 0.02 0.81 0.29 0.28 -1.61 0.00 0.00 178.31 178.10 2c1d h VAL 88 N 0.00 1.07 -0.58 -0.55 2.07 -1.29 -0.45 116.25 116.52 2c1d h VAL 88 Ca -0.07 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 2c1d h VAL 88 Cb 1.68 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 2c1d h VAL 88 CO 0.09 0.11 0.31 0.44 0.02 0.00 0.00 177.57 178.54 2c1d h ASP 89 N 0.59 0.73 -0.35 0.57 5.19 -1.22 -1.17 116.42 120.75 2c1d h ASP 89 Ca 0.18 -0.10 -0.08 0.00 -0.62 0.00 0.00 57.03 56.40 2c1d h ASP 89 Cb -0.02 -0.19 -0.02 0.00 0.18 0.00 0.00 39.33 39.29 2c1d h ASP 89 CO -0.07 0.62 -0.07 -0.09 -3.12 0.00 0.00 179.24 176.51 2c1d h ARG 90 N 0.78 0.76 -0.94 3.56 2.43 -1.20 -2.04 114.38 117.73 2c1d h ARG 90 Ca 0.20 -0.23 0.06 0.00 -0.81 0.00 0.00 59.98 59.20 2c1d h ARG 90 Cb 0.06 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.48 2c1d h ARG 90 CO -0.03 0.82 0.60 0.78 -1.51 0.00 0.00 179.97 180.62 2c1d h GLY 91 N 0.97 1.42 0.99 2.80 0.00 -0.33 -2.07 103.07 106.85 2c1d h GLY 91 Ca 0.13 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 2c1d h GLY 91 CO 0.03 0.31 0.29 -2.00 0.00 0.00 0.00 176.54 175.17 2c1d h LEU 92 N 1.09 0.63 -0.64 3.11 5.85 -0.57 0.90 115.31 125.67 2c1d h LEU 92 Ca 0.40 -0.08 0.05 0.00 0.84 0.00 0.00 57.88 59.09 2c1d h LEU 92 Cb 0.16 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 2c1d h LEU 92 CO -0.17 0.53 0.37 0.44 -0.34 0.00 0.00 178.44 179.27 2c1d h ASP 93 N 0.69 0.57 -0.55 1.25 3.32 -1.02 -1.33 116.42 119.34 2c1d h ASP 93 Ca 0.18 0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.15 2c1d h ASP 93 Cb 0.03 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2c1d h ASP 93 CO -0.03 0.38 -0.05 0.11 -1.72 0.00 0.00 179.24 177.93 2c1d h LYS 94 N 0.70 1.00 -0.81 3.56 1.57 -0.96 -1.50 116.57 120.13 2c1d h LYS 94 Ca 0.28 -0.35 0.09 0.00 -1.87 0.00 0.00 60.65 58.80 2c1d h LYS 94 Cb 0.13 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.30 2c1d h LYS 94 CO -0.15 1.02 0.53 2.35 -0.57 0.00 0.00 179.45 182.63 2c1d h TRP 95 N 0.88 0.83 -0.01 -1.35 2.91 -0.40 -2.24 115.95 116.57 2c1d h TRP 95 Ca 0.15 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.19 2c1d h TRP 95 Cb 0.61 -0.27 0.00 0.00 -0.51 0.00 0.00 29.16 28.98 2c1d h TRP 95 CO 0.04 0.40 -0.25 0.09 -1.03 0.00 0.00 178.44 177.70 2c1d n ASN 96 N -4.50 0.98 -4.79 2.65 3.02 -0.54 -1.90 115.26 110.18 2c1d n ASN 96 Ca 0.13 -0.86 -0.39 0.00 -0.03 0.00 0.00 54.58 53.43 2c1d n ASN 96 Cb 0.30 0.12 -0.06 0.00 -0.61 0.00 0.00 39.78 39.53 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 -2.50 3.50 -1.30 5.41 0.00 -0.60 -4.90 121.76 121.37 2c1d s ALA 97 Ca 0.25 0.24 -0.18 0.00 0.00 0.00 0.00 51.96 52.26 2c1d s ALA 97 Cb 0.19 -2.84 0.03 0.00 0.00 0.00 0.00 23.12 20.51 2c1d s ALA 97 CO 0.52 0.32 1.87 0.00 0.00 0.00 0.00 175.76 178.47 2c1d n ALA 98 N 1.72 3.74 0.40 0.00 0.00 -1.26 -4.09 120.51 121.01 2c1d n ALA 98 Ca -0.07 -3.73 0.11 0.00 0.00 0.00 0.00 53.44 49.74 2c1d n ALA 98 Cb 0.49 -3.58 -0.15 0.00 0.00 0.00 0.00 19.45 16.22 2c1d n ALA 98 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2c1d n MET 99 N 7.85 0.41 -1.66 0.00 2.81 -0.43 -4.73 117.12 121.37 2c1d n MET 99 Ca 0.49 -0.12 -0.26 0.00 -1.81 0.00 0.00 57.70 56.00 2c1d n MET 99 Cb 0.44 -1.51 0.19 0.00 -0.71 0.00 0.00 33.22 31.63 2c1d n MET 99 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2c1d n GLY 100 N 1.36 -1.55 0.14 3.03 0.00 -0.14 -4.87 105.19 103.15 2c1d n GLY 100 Ca -0.01 -1.69 -0.16 0.00 0.00 0.00 0.00 46.02 44.16 2c1d n GLY 100 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2c1d h VAL 101 N -1.75 1.42 -0.84 1.61 -1.51 -1.76 -2.53 116.25 110.89 2c1d h VAL 101 Ca -0.39 -2.69 -0.45 0.00 -1.23 0.00 0.00 66.70 61.94 2c1d h VAL 101 Cb 1.07 2.68 -0.26 0.00 -2.13 0.00 0.00 31.29 32.65 2c1d h VAL 101 CO 0.27 0.80 0.58 0.59 -1.23 0.00 0.00 177.57 178.58 2c1d n ASN 102 N -3.67 4.13 -1.00 4.19 3.02 -1.26 -4.89 115.26 115.77 2c1d n ASN 102 Ca -0.09 -3.38 -0.11 0.00 -0.03 0.00 0.00 54.58 50.98 2c1d n ASN 102 Cb 0.93 -0.81 -0.03 0.00 -0.61 0.00 0.00 39.78 39.26 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 -0.83 0.71 3.77 7.41 0.00 -0.95 -5.00 105.19 110.30 2c1d n GLY 103 Ca 0.51 -0.49 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 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 -3.56 3.87 0.38 1.61 8.01 -1.26 -4.49 118.70 123.26 2c1d s GLU 104 Ca 0.00 1.84 0.08 0.00 0.01 0.00 0.00 54.97 56.90 2c1d s GLU 104 Cb 0.00 -2.54 -0.07 0.00 -4.31 0.00 0.00 34.13 27.22 2c1d s GLU 104 CO 0.00 -0.47 0.00 -1.54 0.01 0.00 0.00 175.26 173.26 2c1d s SER 105 N -1.21 3.97 0.25 -0.19 1.04 -1.26 -0.97 113.70 115.33 2c1d s SER 105 Ca 0.61 -1.22 -0.06 0.00 0.48 0.00 0.00 55.95 55.76 2c1d s SER 105 Cb -0.30 -0.42 0.28 0.00 0.10 0.00 0.00 66.02 65.67 2c1d s SER 105 CO 0.38 -0.36 1.93 0.00 0.98 0.00 0.00 173.24 176.17 2c1d h ALA 107 N 1.38 1.36 -0.89 0.00 0.00 -1.57 -0.86 119.26 118.69 2c1d h ALA 107 Ca 0.36 -0.20 0.22 0.00 0.00 0.00 0.00 54.91 55.29 2c1d h ALA 107 Cb -0.15 -0.03 -0.12 0.00 0.00 0.00 0.00 17.79 17.48 2c1d h ALA 107 CO -0.08 0.27 0.37 0.77 0.00 0.00 0.00 179.25 180.58 2c1d h SER 108 N 0.00 0.29 0.00 0.00 0.02 -1.77 -0.52 113.55 111.57 2c1d h SER 108 Ca -0.00 0.16 -0.30 0.00 -0.84 0.00 0.00 61.79 60.81 2c1d h SER 108 Cb 0.47 0.15 -0.05 0.00 0.14 0.00 0.00 62.40 63.10 2c1d h SER 108 CO 0.03 -0.01 -2.12 0.00 -1.14 0.00 0.00 176.83 173.58 2c1d n HIS 110 N -2.89 0.00 -2.35 0.00 8.25 -0.36 -5.07 115.22 112.80 2c1d n HIS 110 Ca -0.32 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.14 2c1d n HIS 110 Cb 0.93 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 32.02 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 -0.04 0.00 -1.34 -0.41 3.00 -0.21 -4.57 117.38 113.82 2c1d n GLN 111 Ca 0.11 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.79 2c1d n GLN 111 Cb 0.45 0.00 0.10 0.00 0.00 0.00 0.00 30.24 30.79 2c1d n GLN 111 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 2c1d s GLY 112 N -0.47 1.64 0.33 1.08 0.00 -1.26 -4.31 107.32 104.33 2c1d s GLY 112 Ca 0.00 0.02 0.26 0.00 0.00 0.00 0.00 44.72 45.01 2c1d s GLY 112 CO 0.00 0.43 1.78 -0.56 0.00 0.00 0.00 173.10 174.76 2c1d h PRO 113 N -1.23 0.00 0.00 2.90 0.13 -1.99 -1.87 132.00 129.94 2c1d h PRO 113 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2c1d h PRO 113 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2c1d h PRO 113 CO 0.55 0.00 0.14 1.05 -0.23 0.00 0.00 178.00 179.51 2c1d h GLU 114 N 0.00 0.00 -0.71 0.86 9.09 -1.92 -0.33 114.58 121.57 2c1d h GLU 114 Ca 0.00 0.00 0.21 0.00 0.05 0.00 0.00 59.36 59.62 2c1d h GLU 114 Cb 0.46 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.53 2c1d h GLU 114 CO 0.00 0.00 0.51 0.66 0.05 0.00 0.00 179.01 180.23 2c1d h SER 115 N 0.00 0.01 -0.51 3.06 4.64 -1.58 -1.65 113.55 117.52 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 0.28 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 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 -4.33 3.60 -1.56 4.77 2.81 -0.13 -4.98 117.12 117.31 2c1d n MET 116 Ca 0.14 -2.43 -0.49 0.00 -1.81 0.00 0.00 57.70 53.12 2c1d n MET 116 Cb 0.78 -1.92 -0.04 0.00 -0.71 0.00 0.00 33.22 31.33 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 0.74 -1.13 0.00 3.04 0.00 -0.62 -2.08 120.51 120.46 2c1d n ALA 117 Ca 0.22 0.46 0.00 0.00 0.00 0.00 0.00 53.44 54.12 2c1d n ALA 117 Cb 0.86 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 18.34 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 1.89 3.08 0.07 0.00 0.00 -1.15 -4.89 105.19 104.20 2c1d n GLY 118 Ca 0.15 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 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 0.10 -1.19 0.99 5.85 -1.73 -2.83 115.31 116.50 2c1d h LEU 119 Ca 0.00 -0.28 0.14 0.00 0.84 0.00 0.00 57.88 58.59 2c1d h LEU 119 Cb 0.00 -0.03 -0.08 0.00 0.37 0.00 0.00 40.66 40.93 2c1d h LEU 119 CO 0.00 0.35 0.60 -0.09 -0.34 0.00 0.00 178.44 178.96 2c1d h ARG 120 N -0.16 0.75 0.00 1.25 9.65 -1.83 -1.45 114.38 122.59 2c1d h ARG 120 Ca 0.02 -0.05 -0.02 0.00 -1.10 0.00 0.00 59.98 58.84 2c1d h ARG 120 Cb 0.30 -0.17 -0.00 0.00 -1.39 0.00 0.00 29.97 28.71 2c1d h ARG 120 CO 0.00 0.50 -0.07 0.00 2.80 0.00 0.00 179.97 183.19 2c1d h ALA 121 N 1.59 1.15 -0.27 2.80 0.00 -1.82 -2.89 119.26 119.81 2c1d h ALA 121 Ca 0.48 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.32 2c1d h ALA 121 Cb 0.69 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2c1d h ALA 121 CO -0.24 0.09 0.00 1.33 0.00 0.00 0.00 179.25 180.43 2c1d n VAL 122 N -3.40 1.45 -4.00 0.00 0.24 -0.56 -0.53 118.33 111.53 2c1d n VAL 122 Ca -0.01 -1.34 -0.30 0.00 -2.04 0.00 0.00 64.34 60.65 2c1d n VAL 122 Cb 0.23 0.23 -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 -1.67 3.10 0.88 7.34 1.00 -1.09 -4.27 119.30 124.58 2c1d s MET 123 Ca 0.28 -0.62 -0.11 0.00 0.00 0.00 0.00 55.69 55.24 2c1d s MET 123 Cb 0.19 -2.84 0.12 0.00 0.00 0.00 0.00 34.83 32.30 2c1d s MET 123 CO 0.12 0.57 1.09 -2.14 0.00 0.00 0.00 175.02 174.66 2c1d s PRO 124 N -2.53 1.41 0.16 2.03 0.02 -1.26 -4.90 135.00 129.92 2c1d s PRO 124 Ca 0.32 0.93 -0.18 0.00 0.02 0.00 0.00 61.00 62.09 2c1d s PRO 124 Cb -0.12 -1.82 0.04 0.00 0.02 0.00 0.00 34.50 32.62 2c1d s PRO 124 CO 0.24 -2.17 0.49 -0.98 -0.33 0.00 0.00 177.00 174.25 2c1d s ARG 125 N -4.90 1.24 -0.20 5.54 1.70 -0.95 -4.78 118.95 116.60 2c1d s ARG 125 Ca 0.63 -0.74 -0.25 0.00 -0.47 0.00 0.00 55.73 54.91 2c1d s ARG 125 Cb -0.18 0.51 -0.01 0.00 -0.57 0.00 0.00 34.95 34.70 2c1d s ARG 125 CO 0.57 -0.51 0.83 0.14 -1.08 0.00 0.00 175.30 175.25 2c1d s VAL 126 N -3.83 4.86 0.36 4.99 -7.23 -1.26 -0.79 120.40 117.51 2c1d s VAL 126 Ca 0.05 1.61 -0.28 0.00 -1.81 0.00 0.00 61.98 61.55 2c1d s VAL 126 Cb 0.00 -4.13 -0.11 0.00 0.56 0.00 0.00 36.38 32.70 2c1d s VAL 126 CO -0.08 -0.01 1.46 -0.62 -0.31 0.00 0.00 175.10 175.54 2c1d s ASP 127 N 1.22 6.42 0.39 4.85 -1.08 -0.35 -4.89 116.67 123.24 2c1d s ASP 127 Ca 0.37 2.98 0.16 0.00 -0.52 0.00 0.00 52.55 55.53 2c1d s ASP 127 Cb -0.16 -2.66 0.82 0.00 -1.46 0.00 0.00 42.92 39.46 2c1d s ASP 127 CO 0.10 -0.82 1.85 1.05 0.52 0.00 0.00 175.17 177.88 2c1d h GLU 128 N 3.24 0.00 0.05 4.34 4.11 -1.94 -1.79 114.58 122.58 2c1d h GLU 128 Ca -0.50 0.00 -0.36 0.00 0.07 0.00 0.00 59.36 58.57 2c1d h GLU 128 Cb 1.24 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.44 2c1d h GLU 128 CO 0.66 0.33 -2.03 0.72 0.07 0.00 0.00 179.01 178.76 2c1d n HIS 129 N -3.96 0.72 0.08 2.06 8.25 -1.26 -4.64 115.22 116.47 2c1d n HIS 129 Ca -0.02 0.20 0.11 0.00 -0.26 0.00 0.00 57.72 57.76 2c1d n HIS 129 Cb 0.39 -1.09 -0.08 0.00 1.12 0.00 0.00 29.99 30.34 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 -3.76 0.32 -1.16 1.59 -2.24 -1.24 -4.97 114.28 102.83 2c1d n THR 130 Ca -0.39 -0.51 -0.05 0.00 -2.27 0.00 0.00 64.05 60.83 2c1d n THR 130 Cb 0.93 -0.16 -0.02 0.00 -2.10 0.00 0.00 70.33 68.98 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 1.23 0.70 3.85 3.38 0.00 -0.67 -5.00 105.19 108.68 2c1d n GLY 131 Ca -0.02 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.01 3.83 0.11 1.61 1.02 -1.26 -4.72 119.74 118.32 2c1d s LYS 132 Ca 0.00 0.28 -0.31 0.00 0.02 0.00 0.00 55.97 55.96 2c1d s LYS 132 Cb 0.00 -3.08 -0.08 0.00 -0.52 0.00 0.00 37.83 34.15 2c1d s LYS 132 CO 0.00 0.61 1.47 -1.17 -0.92 0.00 0.00 175.35 175.34 2c1d s LEU 133 N -1.58 4.36 -0.07 3.17 0.20 -1.26 -1.21 118.68 122.29 2c1d s LEU 133 Ca 0.29 2.40 0.03 0.00 0.69 0.00 0.00 54.13 57.54 2c1d s LEU 133 Cb -0.15 -3.58 0.01 0.00 -0.43 0.00 0.00 46.19 42.04 2c1d s LEU 133 CO 0.16 -0.73 -0.15 -0.04 -0.29 0.00 0.00 176.35 175.30 2c1d s MET 134 N 1.42 1.99 0.51 1.98 -1.94 0.03 -4.95 119.30 118.35 2c1d s MET 134 Ca 0.67 -0.51 -0.01 0.00 -1.71 0.00 0.00 55.69 54.13 2c1d s MET 134 Cb -0.38 -1.61 0.01 0.00 2.01 0.00 0.00 34.83 34.86 2c1d s MET 134 CO 0.30 0.05 0.76 0.96 -0.01 0.00 0.00 175.02 177.08 2c1d s ILE 135 N 0.62 3.61 0.33 2.53 -4.36 -1.26 -2.24 121.20 120.44 2c1d s ILE 135 Ca -0.15 -0.39 0.03 0.00 -0.26 0.00 0.00 60.65 59.88 2c1d s ILE 135 Cb -0.16 -3.37 0.28 0.00 1.25 0.00 0.00 42.46 40.46 2c1d s ILE 135 CO 0.04 -0.30 1.95 -0.03 0.24 0.00 0.00 174.94 176.85 2c1d h MET 136 N 0.16 0.88 -0.78 0.37 1.85 -2.00 -1.11 114.93 114.29 2c1d h MET 136 Ca -0.45 -0.05 0.11 0.00 -0.61 0.00 0.00 59.70 58.69 2c1d h MET 136 Cb 1.26 -0.20 -0.05 0.00 0.43 0.00 0.00 31.60 33.04 2c1d h MET 136 CO 0.57 0.58 0.51 0.93 -0.40 0.00 0.00 176.91 179.10 2c1d h GLU 137 N 0.90 0.63 -0.40 0.39 3.07 -1.96 -1.11 114.58 116.10 2c1d h GLU 137 Ca 0.32 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 59.12 2c1d h GLU 137 Cb 0.13 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 27.88 2c1d h GLU 137 CO -0.10 0.42 0.14 -0.44 -1.40 0.00 0.00 179.01 177.62 2c1d h ASP 138 N 0.65 0.57 -0.73 1.42 3.32 -1.58 -1.21 116.42 118.85 2c1d h ASP 138 Ca 0.37 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 57.20 2c1d h ASP 138 Cb 0.54 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 2c1d h ASP 138 CO -0.14 0.61 0.35 1.88 -1.72 0.00 0.00 179.24 180.22 2c1d h TYR 139 N 0.50 1.06 -0.08 4.55 0.99 -1.17 -0.71 116.97 122.10 2c1d h TYR 139 Ca 0.13 -0.05 -0.01 0.00 2.00 0.00 0.00 58.73 60.80 2c1d h TYR 139 Cb 0.23 -0.33 -0.00 0.00 1.00 0.00 0.00 36.73 37.63 2c1d h TYR 139 CO 0.01 0.78 0.02 0.28 -0.00 0.00 0.00 178.16 179.25 2c1d h VAL 140 N 1.03 1.19 0.00 -2.88 2.07 -1.19 -2.78 116.25 113.68 2c1d h VAL 140 Ca 0.25 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 67.15 2c1d h VAL 140 Cb 0.12 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 2c1d h VAL 140 CO -0.03 0.16 -0.20 0.78 0.02 0.00 0.00 177.57 178.31 2c1d h ASN 141 N -0.07 0.00 -0.62 0.57 2.35 -1.13 -0.90 115.58 115.78 2c1d h ASN 141 Ca 0.03 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.71 2c1d h ASN 141 Cb 0.24 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 2c1d h ASN 141 CO 0.00 0.20 0.11 0.00 -1.65 0.00 0.00 177.43 176.09 2c1d h ALA 142 N 1.80 0.82 -0.13 -0.83 0.00 -0.89 -0.73 119.26 119.31 2c1d h ALA 142 Ca -0.00 -0.26 -0.21 0.00 0.00 0.00 0.00 54.91 54.44 2c1d h ALA 142 Cb 0.61 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.18 2c1d h ALA 142 CO 0.03 0.57 -0.75 0.00 0.00 0.00 0.00 179.25 179.09 2c1d h VAL 144 N 0.45 1.05 0.00 0.00 2.07 -1.06 -0.90 116.25 117.86 2c1d h VAL 144 Ca -0.06 -0.22 -0.10 0.00 0.82 0.00 0.00 66.70 67.15 2c1d h VAL 144 Cb 1.39 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 2c1d h VAL 144 CO 0.16 0.11 -0.65 0.71 0.02 0.00 0.00 177.57 177.92 2c1d h THR 145 N 0.63 0.72 -0.28 2.57 1.35 -1.18 -1.03 112.91 115.68 2c1d h THR 145 Ca 0.21 -1.74 -0.13 0.00 -0.55 0.00 0.00 66.41 64.21 2c1d h THR 145 Cb 0.03 1.56 -0.01 0.00 -1.73 0.00 0.00 68.15 68.00 2c1d h THR 145 CO -0.10 0.24 -0.35 -0.33 -0.25 0.00 0.00 175.52 174.74 2c1d h GLU 146 N -1.00 0.62 0.00 4.72 5.08 -1.38 -3.01 114.58 119.61 2c1d h GLU 146 Ca -0.14 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2c1d h GLU 146 Cb 0.86 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.10 2c1d h GLU 146 CO -0.09 0.88 -1.32 0.54 -1.00 0.00 0.00 179.01 178.02 2c1d n ARG 147 N -4.06 0.71 -0.03 2.33 1.74 -0.66 -4.47 116.66 112.21 2c1d n ARG 147 Ca -0.01 -0.08 0.05 0.00 -0.77 0.00 0.00 57.85 57.04 2c1d n ARG 147 Cb 0.49 -1.19 0.06 0.00 -1.02 0.00 0.00 32.46 30.80 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 -1.76 0.89 -1.89 5.56 2.81 -0.43 -4.96 117.12 117.34 2c1d n MET 148 Ca -0.01 -1.27 -0.20 0.00 -1.81 0.00 0.00 57.70 54.40 2c1d n MET 148 Cb 0.23 -1.20 -0.06 0.00 -0.71 0.00 0.00 33.22 31.49 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 0.52 1.00 3.94 3.03 0.00 -1.14 -2.19 105.19 110.35 2c1d n GLY 149 Ca 0.07 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.88 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 -5.17 4.20 0.45 0.99 1.43 -0.40 -4.86 118.68 115.32 2c1d s LEU 150 Ca 0.00 -0.01 -0.25 0.00 -1.03 0.00 0.00 54.13 52.84 2c1d s LEU 150 Cb 0.00 -2.75 -0.08 0.00 0.03 0.00 0.00 46.19 43.40 2c1d s LEU 150 CO 0.00 -0.08 1.31 -0.70 0.23 0.00 0.00 176.35 177.11 2c1d s GLU 151 N -3.96 3.74 0.44 1.70 2.12 -1.26 -3.93 118.70 117.55 2c1d s GLU 151 Ca 0.34 2.15 -0.25 0.00 0.36 0.00 0.00 54.97 57.57 2c1d s GLU 151 Cb -0.09 -2.60 -0.09 0.00 0.26 0.00 0.00 34.13 31.62 2c1d s GLU 151 CO 0.28 -0.68 1.33 0.36 -0.54 0.00 0.00 175.26 176.02 2c1d n LYS 152 N -0.23 2.02 -2.57 4.30 2.85 -1.26 -4.84 118.16 118.44 2c1d n LYS 152 Ca 0.06 0.72 -0.41 0.00 -1.05 0.00 0.00 58.31 57.63 2c1d n LYS 152 Cb 0.44 -2.48 -0.05 0.00 -0.65 0.00 0.00 35.03 32.30 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 -1.20 3.70 0.37 5.58 0.51 -1.26 -5.01 118.94 121.62 2c1d s TRP 153 Ca 0.62 1.72 -0.26 0.00 -2.12 0.00 0.00 56.10 56.06 2c1d s TRP 153 Cb -0.48 -3.19 -0.12 0.00 -0.81 0.00 0.00 33.47 28.87 2c1d s TRP 153 CO 0.57 -0.28 1.06 0.41 -0.51 0.00 0.00 176.95 178.21 2c1d n GLY 154 N 1.66 -0.08 0.26 0.98 0.00 -1.26 -4.88 105.19 101.88 2c1d n GLY 154 Ca 0.00 0.23 0.13 0.00 0.00 0.00 0.00 46.02 46.38 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 1.86 0.52 -0.17 1.61 -1.51 -1.95 -2.36 116.25 114.24 2c1d h VAL 155 Ca -0.43 -0.63 0.00 0.00 -1.23 0.00 0.00 66.70 64.40 2c1d h VAL 155 Cb 1.33 1.43 0.00 0.00 -2.13 0.00 0.00 31.29 31.91 2c1d h VAL 155 CO 0.59 0.13 0.00 0.35 -1.23 0.00 0.00 177.57 177.41 2c1d n THR 156 N -3.54 2.11 -1.19 7.19 -2.24 -1.26 -4.72 114.28 110.64 2c1d n THR 156 Ca -0.01 -1.98 -0.32 0.00 -2.27 0.00 0.00 64.05 59.47 2c1d n THR 156 Cb 0.27 -0.22 0.11 0.00 -2.10 0.00 0.00 70.33 68.39 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 -2.22 4.06 0.22 3.42 1.04 -0.89 -4.80 113.70 114.53 2c1d s SER 157 Ca 0.38 2.04 -0.09 0.00 0.48 0.00 0.00 55.95 58.76 2c1d s SER 157 Cb 0.31 -2.55 0.22 0.00 0.10 0.00 0.00 66.02 64.10 2c1d s SER 157 CO 0.07 -2.34 1.85 0.44 0.98 0.00 0.00 173.24 174.24 2c1d h ASP 158 N -1.06 0.77 -0.59 7.02 3.45 -1.96 -0.70 116.42 123.35 2c1d h ASP 158 Ca -0.44 0.00 0.08 0.00 0.43 0.00 0.00 57.03 57.09 2c1d h ASP 158 Cb 1.25 -0.16 -0.06 0.00 -0.56 0.00 0.00 39.33 39.80 2c1d h ASP 158 CO 0.48 0.52 0.25 0.78 -1.57 0.00 0.00 179.24 179.71 2c1d h ASN 159 N 0.91 0.29 -0.23 6.45 2.35 -1.92 -1.34 115.58 122.09 2c1d h ASN 159 Ca 0.30 0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 56.05 2c1d h ASN 159 Cb 0.04 0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 2c1d h ASN 159 CO -0.12 0.18 -0.11 -0.03 -1.65 0.00 0.00 177.43 175.71 2c1d h MET 160 N 0.46 0.47 -0.58 0.81 4.05 -1.67 -1.78 114.93 116.69 2c1d h MET 160 Ca 0.28 -0.20 -0.11 0.00 -0.28 0.00 0.00 59.70 59.39 2c1d h MET 160 Cb 0.30 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.07 2c1d h MET 160 CO -0.26 0.74 -0.06 0.87 0.23 0.00 0.00 176.91 178.44 2c1d h LYS 161 N 0.18 1.07 -0.69 0.39 1.57 -0.93 0.22 116.57 118.38 2c1d h LYS 161 Ca 0.05 -0.37 -0.06 0.00 -1.87 0.00 0.00 60.65 58.40 2c1d h LYS 161 Cb 0.60 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.80 2c1d h LYS 161 CO 0.03 1.07 0.18 -0.44 -0.57 0.00 0.00 179.45 179.73 2c1d h ASP 162 N 0.96 1.02 -0.30 0.86 3.32 -1.29 -1.05 116.42 119.93 2c1d h ASP 162 Ca 0.16 -0.20 -0.12 0.00 0.02 0.00 0.00 57.03 56.88 2c1d h ASP 162 Cb 0.63 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 2c1d h ASP 162 CO 0.04 0.97 -0.29 -0.03 -1.72 0.00 0.00 179.24 178.21 2c1d h MET 163 N 1.03 0.73 -0.49 3.56 4.05 -0.97 -1.79 114.93 121.06 2c1d h MET 163 Ca 0.22 -0.38 -0.03 0.00 -0.28 0.00 0.00 59.70 59.23 2c1d h MET 163 Cb 0.34 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.12 2c1d h MET 163 CO -0.00 1.00 0.20 -0.07 0.23 0.00 0.00 176.91 178.27 2c1d h LEU 164 N 0.48 0.63 -0.19 3.39 3.38 -0.86 -0.41 115.31 121.75 2c1d h LEU 164 Ca 0.05 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 2c1d h LEU 164 Cb 0.86 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2c1d h LEU 164 CO 0.07 0.57 0.06 0.28 0.09 0.00 0.00 178.44 179.51 2c1d h SER 165 N 0.69 0.27 -0.33 -0.43 0.02 -0.96 0.01 113.55 112.82 2c1d h SER 165 Ca 0.17 -0.21 0.01 0.00 -0.84 0.00 0.00 61.79 60.92 2c1d h SER 165 Cb 0.14 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 2c1d h SER 165 CO -0.02 0.41 0.21 0.25 -1.14 0.00 0.00 176.83 176.55 2c1d h LEU 166 N 0.12 0.36 -0.53 5.07 5.85 -1.01 -2.13 115.31 123.05 2c1d h LEU 166 Ca 0.06 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.69 2c1d h LEU 166 Cb 0.24 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 2c1d h LEU 166 CO -0.00 0.26 -0.02 0.40 -0.34 0.00 0.00 178.44 178.75 2c1d h ILE 167 N 0.44 1.26 -0.83 4.05 2.04 -0.97 -2.89 117.51 120.61 2c1d h ILE 167 Ca 0.13 -1.12 0.04 0.00 1.00 0.00 0.00 64.86 64.91 2c1d h ILE 167 Cb -0.04 0.94 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 2c1d h ILE 167 CO -0.04 0.40 0.55 -1.28 0.00 0.00 0.00 178.15 177.78 2c1d h SER 168 N 0.81 0.86 0.13 1.72 0.87 -0.74 -1.49 113.55 115.72 2c1d h SER 168 Ca 0.15 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.69 2c1d h SER 168 Cb 0.55 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.31 2c1d h SER 168 CO 0.03 0.58 -0.08 0.25 -0.53 0.00 0.00 176.83 177.09 2c1d h LEU 169 N 1.00 0.00 0.00 2.23 6.46 -1.17 -2.12 115.31 121.71 2c1d h LEU 169 Ca 0.34 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 58.10 2c1d h LEU 169 Cb 0.09 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.02 2c1d h LEU 169 CO -0.11 0.08 0.00 0.00 -0.62 0.00 0.00 178.44 177.79 2c1d n GLN 170 N -4.07 0.60 -0.01 1.25 1.13 -0.56 -2.00 117.38 113.73 2c1d n GLN 170 Ca -0.03 0.02 0.01 0.00 -1.94 0.00 0.00 57.00 55.07 2c1d n GLN 170 Cb 0.16 -1.50 0.02 0.00 0.11 0.00 0.00 30.24 29.03 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 -1.09 2.05 -4.73 1.08 7.64 -0.80 -2.91 113.62 114.85 2c1d n SER 171 Ca 0.15 -2.16 -0.42 0.00 1.01 0.00 0.00 58.87 57.45 2c1d n SER 171 Cb 0.11 -0.06 -0.02 0.00 -1.01 0.00 0.00 64.21 63.23 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 -0.64 2.74 0.00 1.43 0.63 -0.85 -1.06 116.66 118.91 2c1d n ARG 172 Ca 0.02 0.98 0.00 0.00 -0.92 0.00 0.00 57.85 57.94 2c1d n ARG 172 Cb 0.31 -2.80 0.00 0.00 0.45 0.00 0.00 32.46 30.42 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 3.07 2.40 3.83 5.14 0.00 -0.40 -5.00 105.19 114.23 2c1d n GLY 173 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.42 4.11 0.13 1.61 -1.94 -0.23 -4.78 119.30 117.79 2c1d s MET 174 Ca 0.00 1.06 -0.30 0.00 -1.71 0.00 0.00 55.69 54.74 2c1d s MET 174 Cb 0.00 -2.16 -0.07 0.00 2.01 0.00 0.00 34.83 34.61 2c1d s MET 174 CO 0.00 -0.13 1.21 0.00 -0.01 0.00 0.00 175.02 176.09 2c1d s ALA 175 N -2.35 3.43 0.11 3.03 0.00 -1.26 -1.12 121.76 123.61 2c1d s ALA 175 Ca 0.61 0.92 -0.34 0.00 0.00 0.00 0.00 51.96 53.16 2c1d s ALA 175 Cb -0.09 -3.43 -0.13 0.00 0.00 0.00 0.00 23.12 19.46 2c1d s ALA 175 CO 0.20 -0.41 1.67 0.28 0.00 0.00 0.00 175.76 177.50 2c1d n VAL 176 N 3.15 0.15 -3.01 0.00 0.31 0.34 -4.81 118.33 114.45 2c1d n VAL 176 Ca 0.07 -0.03 -0.18 0.00 -0.01 0.00 0.00 64.34 64.19 2c1d n VAL 176 Cb 0.45 -1.69 -0.02 0.00 -0.91 0.00 0.00 33.84 31.67 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 4.29 -1.03 -4.64 4.52 5.15 0.31 -1.66 115.26 122.19 2c1d n ASN 177 Ca 0.18 -2.95 -0.40 0.00 -0.60 0.00 0.00 54.58 50.81 2c1d n ASN 177 Cb 0.30 0.35 -0.06 0.00 -0.53 0.00 0.00 39.78 39.84 2c1d n ASN 177 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2c1d s VAL 178 N -0.47 5.02 0.13 3.44 1.01 -1.26 -4.48 120.40 123.79 2c1d s VAL 178 Ca 0.34 1.11 -0.31 0.00 0.00 0.00 0.00 61.98 63.11 2c1d s VAL 178 Cb 0.20 -3.92 -0.09 0.00 0.00 0.00 0.00 36.38 32.57 2c1d s VAL 178 CO -0.16 0.08 1.50 -0.75 0.00 0.00 0.00 175.10 175.76 2c1d s LYS 179 N 2.20 4.26 0.00 2.72 2.20 -1.26 -4.89 119.74 124.96 2c1d s LYS 179 Ca 0.26 2.23 0.00 0.00 -0.36 0.00 0.00 55.97 58.10 2c1d s LYS 179 Cb -0.16 -3.25 0.00 0.00 -1.51 0.00 0.00 37.83 32.91 2c1d s LYS 179 CO 0.09 -0.55 0.31 0.44 -0.36 0.00 0.00 175.35 175.28 2c1d n ILE 180 N 4.07 0.00 -3.68 5.43 -5.35 -1.26 -4.86 119.36 113.71 2c1d n ILE 180 Ca 0.13 -0.45 -0.20 0.00 -0.27 0.00 0.00 62.75 61.96 2c1d n ILE 180 Cb 0.40 1.08 0.01 0.00 -1.74 0.00 0.00 39.64 39.39 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 2.30 0.00 7.28 3.85 -1.26 -3.10 116.55 125.35 2c1d n ASP 181 Ca 0.00 -2.48 0.00 0.00 -0.71 0.00 0.00 54.79 51.60 2c1d n ASP 181 Cb 0.02 -0.09 0.00 0.00 -1.35 0.00 0.00 41.12 39.70 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 -0.43 2.58 0.33 6.12 0.00 -1.26 -2.77 105.19 109.76 2c1d n GLY 182 Ca 0.01 -0.45 0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.51 132.00 130.21 2c1d h PRO 183 Ca 0.00 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.00 2c1d h PRO 183 Cb 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 2c1d h PRO 183 CO 0.00 0.00 -0.51 0.00 -0.21 0.00 0.00 178.00 177.28 2c1d h ALA 184 N 2.00 0.86 -0.65 -0.75 0.00 -1.81 -3.39 119.26 115.52 2c1d h ALA 184 Ca 0.00 -0.46 0.14 0.00 0.00 0.00 0.00 54.91 54.58 2c1d h ALA 184 Cb 0.10 -0.08 -0.11 0.00 0.00 0.00 0.00 17.79 17.70 2c1d h ALA 184 CO 0.00 0.64 0.01 0.00 0.00 0.00 0.00 179.25 179.90 2c1d h ALA 185 N 1.49 0.66 -0.27 0.00 0.00 -1.20 -0.43 119.26 119.51 2c1d h ALA 185 Ca -0.01 0.20 -0.11 0.00 0.00 0.00 0.00 54.91 55.00 2c1d h ALA 185 Cb 1.12 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 2c1d h ALA 185 CO 0.07 -0.39 -0.28 -1.35 0.00 0.00 0.00 179.25 177.29 2c1d h PRO 186 N 0.12 0.54 -0.60 0.00 0.11 -1.79 0.12 132.00 130.51 2c1d h PRO 186 Ca 0.35 -0.22 -0.09 0.00 0.11 0.00 0.00 66.00 66.14 2c1d h PRO 186 Cb 0.57 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.63 2c1d h PRO 186 CO -0.56 0.77 0.02 1.88 -0.21 0.00 0.00 178.00 179.91 2c1d h TYR 187 N 0.47 1.13 -0.60 0.65 -1.99 -1.66 -2.10 116.97 112.88 2c1d h TYR 187 Ca 0.06 -0.19 -0.08 0.00 2.00 0.00 0.00 58.73 60.52 2c1d h TYR 187 Cb 0.73 -0.30 -0.02 0.00 2.00 0.00 0.00 36.73 39.14 2c1d h TYR 187 CO 0.03 0.99 0.05 2.35 -0.00 0.00 0.00 178.16 181.58 2c1d h TRP 188 N 0.94 1.10 -0.07 4.88 7.01 -0.67 -1.32 115.95 127.82 2c1d h TRP 188 Ca 0.17 -0.17 -0.09 0.00 2.11 0.00 0.00 58.89 60.91 2c1d h TRP 188 Cb 0.53 -0.29 -0.01 0.00 -2.10 0.00 0.00 29.16 27.28 2c1d h TRP 188 CO 0.04 0.96 -0.39 0.93 -2.79 0.00 0.00 178.44 177.19 2c1d h GLU 189 N 0.92 0.15 -0.31 2.65 4.39 -0.92 0.11 114.58 121.56 2c1d h GLU 189 Ca 0.17 -0.06 -0.14 0.00 0.34 0.00 0.00 59.36 59.67 2c1d h GLU 189 Cb 0.49 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.13 2c1d h GLU 189 CO 0.02 0.52 -0.35 1.25 -1.16 0.00 0.00 179.01 179.29 2c1d h HIS 190 N 0.13 0.96 -0.30 4.33 2.76 -0.96 -1.71 115.15 120.35 2c1d h HIS 190 Ca 0.01 -0.30 -0.13 0.00 -2.20 0.00 0.00 60.37 57.76 2c1d h HIS 190 Cb 0.75 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.50 2c1d h HIS 190 CO 0.01 1.08 -0.34 0.78 -1.30 0.00 0.00 177.93 178.16 2c1d h GLY 191 N 0.56 0.72 0.99 5.26 0.00 -0.88 -2.78 103.07 106.94 2c1d h GLY 191 Ca 0.05 -0.68 -0.00 0.00 0.00 0.00 0.00 47.33 46.70 2c1d h GLY 191 CO 0.09 0.61 0.28 1.70 0.00 0.00 0.00 176.54 179.22 2c1d h LYS 192 N 0.56 0.63 -0.61 4.80 3.64 -0.63 -1.02 116.57 123.94 2c1d h LYS 192 Ca 0.06 -0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.41 2c1d h LYS 192 Cb 0.84 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.49 2c1d h LYS 192 CO 0.07 0.46 0.37 1.49 -2.27 0.00 0.00 179.45 179.57 2c1d h GLU 193 N 0.61 0.70 -0.70 1.90 4.81 -1.22 -2.03 114.58 118.66 2c1d h GLU 193 Ca 0.17 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 2c1d h GLU 193 Cb -0.01 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.18 2c1d h GLU 193 CO -0.03 0.46 0.41 0.82 -0.73 0.00 0.00 179.01 179.94 2c1d h ILE 194 N 0.72 1.20 -0.54 2.32 2.04 -1.20 -2.34 117.51 119.71 2c1d h ILE 194 Ca 0.25 -0.46 0.08 0.00 1.00 0.00 0.00 64.86 65.73 2c1d h ILE 194 Cb 0.04 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 36.34 2c1d h ILE 194 CO -0.11 0.21 0.36 0.22 0.00 0.00 0.00 178.15 178.84 2c1d h TYR 195 N 0.95 0.41 -0.38 1.37 3.20 -0.46 -2.24 116.97 119.82 2c1d h TYR 195 Ca 0.25 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.13 2c1d h TYR 195 Cb -0.02 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.12 2c1d h TYR 195 CO -0.01 0.20 0.00 0.66 -1.64 0.00 0.00 178.16 177.37 2c1d n TYR 196 N -4.47 0.49 -2.89 -3.82 4.02 -1.06 -2.37 117.16 107.07 2c1d n TYR 196 Ca 0.08 -0.31 -0.41 0.00 -0.01 0.00 0.00 57.90 57.25 2c1d n TYR 196 Cb 0.32 -0.01 -0.04 0.00 -0.02 0.00 0.00 39.34 39.60 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 -1.22 4.90 -0.67 -0.72 2.01 -0.84 -4.85 115.64 114.25 2c1d s THR 197 Ca 0.33 1.74 -0.18 0.00 0.31 0.00 0.00 61.69 63.90 2c1d s THR 197 Cb 0.19 -4.18 0.13 0.00 0.01 0.00 0.00 72.50 68.65 2c1d s THR 197 CO 0.26 0.24 0.74 -0.13 -0.69 0.00 0.00 174.62 175.03 2c1d s ARG 198 N 0.70 3.20 0.48 4.92 0.52 -1.26 -3.92 118.95 123.60 2c1d s ARG 198 Ca 0.44 -1.63 -0.08 0.00 -0.52 0.00 0.00 55.73 53.94 2c1d s ARG 198 Cb -0.20 -4.38 -0.04 0.00 0.52 0.00 0.00 34.95 30.85 2c1d s ARG 198 CO 0.23 -1.50 0.82 0.71 0.02 0.00 0.00 175.30 175.59 2c1d s TYR 199 N 2.09 3.55 0.05 -0.53 1.51 -0.76 -4.39 117.35 118.86 2c1d s TYR 199 Ca 0.14 0.95 0.00 0.00 -1.01 0.00 0.00 57.07 57.15 2c1d s TYR 199 Cb -0.20 -2.41 0.00 0.00 -0.11 0.00 0.00 41.96 39.24 2c1d s TYR 199 CO 0.01 -0.30 0.00 0.41 -1.11 0.00 0.00 175.55 174.57 2c1d n GLY 200 N -2.07 -1.40 0.23 0.71 0.00 -1.26 -1.71 105.19 99.69 2c1d n GLY 200 Ca 0.02 -1.49 0.09 0.00 0.00 0.00 0.00 46.02 44.64 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 -0.18 0.00 0.00 1.61 4.15 -0.61 -2.23 115.11 117.85 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 0.17 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.86 2c1d h GLN 201 CO 0.00 0.21 0.00 -0.07 -1.93 0.00 0.00 178.83 177.04 2c1d h LEU 202 N 0.00 0.00 -2.82 -2.39 3.38 -1.38 -3.48 115.31 108.61 2c1d h LEU 202 Ca -0.00 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.60 2c1d h LEU 202 Cb 0.49 0.00 0.13 0.00 0.09 0.00 0.00 40.66 41.36 2c1d h LEU 202 CO 0.03 0.00 -0.90 -0.62 0.09 0.00 0.00 178.44 177.04 2c1d n GLU 203 N -2.47 -1.90 -4.71 1.13 1.02 -0.69 -5.01 120.64 108.01 2c1d n GLU 203 Ca 0.04 0.62 -0.24 0.00 -0.02 0.00 0.00 57.16 57.56 2c1d n GLU 203 Cb 0.37 -4.84 -0.16 0.00 -0.02 0.00 0.00 31.44 26.79 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 -5.39 1.47 0.39 3.49 -1.94 -0.79 -4.73 119.30 111.80 2c1d s MET 204 Ca 0.43 -0.53 0.08 0.00 -1.71 0.00 0.00 55.69 53.96 2c1d s MET 204 Cb -0.12 -1.33 -0.01 0.00 2.01 0.00 0.00 34.83 35.38 2c1d s MET 204 CO 0.81 0.24 0.41 -1.54 -0.01 0.00 0.00 175.02 174.93 2c1d s SER 205 N -0.03 5.30 0.21 3.03 1.04 -1.25 -1.83 113.70 120.17 2c1d s SER 205 Ca -0.01 -0.58 -0.08 0.00 0.48 0.00 0.00 55.95 55.75 2c1d s SER 205 Cb -0.09 -0.72 0.27 0.00 0.10 0.00 0.00 66.02 65.57 2c1d s SER 205 CO 0.01 -0.59 1.80 0.00 0.98 0.00 0.00 173.24 175.44 2c1d h ALA 207 N 1.37 1.21 -0.93 0.00 0.00 -1.89 -0.27 119.26 118.75 2c1d h ALA 207 Ca 0.32 -0.15 0.18 0.00 0.00 0.00 0.00 54.91 55.26 2c1d h ALA 207 Cb 0.23 -0.30 -0.11 0.00 0.00 0.00 0.00 17.79 17.61 2c1d h ALA 207 CO -0.20 0.60 0.51 -0.91 0.00 0.00 0.00 179.25 179.24 2c1d h ASN 208 N 1.07 0.60 0.00 0.00 2.35 -1.75 0.40 115.58 118.26 2c1d h ASN 208 Ca 0.26 0.11 -0.24 0.00 -0.55 0.00 0.00 56.30 55.88 2c1d h ASN 208 Cb 0.11 0.01 -0.04 0.00 0.05 0.00 0.00 38.32 38.46 2c1d h ASN 208 CO -0.03 0.19 -1.31 0.00 -1.65 0.00 0.00 177.43 174.62 2c1d h HIS 210 N -1.00 0.00 0.00 0.00 3.86 -0.98 -2.86 115.15 114.17 2c1d h HIS 210 Ca -0.36 0.00 -0.34 0.00 -1.16 0.00 0.00 60.37 58.51 2c1d h HIS 210 Cb 1.30 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 29.72 2c1d h HIS 210 CO 0.08 0.00 -2.10 -1.91 0.86 0.00 0.00 177.93 174.86 2c1d n GLU 211 N -2.51 0.45 0.16 2.45 2.13 -0.06 -4.09 120.64 119.16 2c1d n GLU 211 Ca 0.01 0.20 0.04 0.00 0.66 0.00 0.00 57.16 58.07 2c1d n GLU 211 Cb 0.51 -1.26 0.10 0.00 0.27 0.00 0.00 31.44 31.06 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 -0.77 0.00 0.00 4.31 3.32 -1.13 -3.35 116.42 118.80 2c1d h ASP 212 Ca -0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.54 2c1d h ASP 212 Cb 1.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.98 2c1d h ASP 212 CO -0.31 0.44 -0.08 0.59 -1.72 0.00 0.00 179.24 178.16 2c1d n ASN 213 N -3.26 1.38 -4.64 6.45 3.02 -1.10 -5.03 115.26 112.09 2c1d n ASN 213 Ca 0.02 -2.10 -0.49 0.00 -0.03 0.00 0.00 54.58 51.98 2c1d n ASN 213 Cb 0.67 -0.15 -0.05 0.00 -0.61 0.00 0.00 39.78 39.64 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 -0.58 0.37 0.00 5.41 0.00 -1.12 -1.45 120.51 123.15 2c1d n ALA 214 Ca 0.04 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.95 2c1d n ALA 214 Cb 0.48 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.69 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 3.09 2.98 3.89 0.00 0.00 0.14 -4.78 105.19 110.51 2c1d n GLY 215 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.19 6.11 -0.14 1.61 0.01 -0.53 0.23 114.94 121.05 2c1d s ASN 216 Ca 0.00 1.13 -0.18 0.00 -0.71 0.00 0.00 52.86 53.10 2c1d s ASN 216 Cb 0.00 -2.25 -0.04 0.00 0.41 0.00 0.00 41.25 39.36 2c1d s ASN 216 CO 0.00 -0.82 0.47 -0.04 -1.51 0.00 0.00 177.10 175.20 2c1d s MET 217 N -5.01 4.31 -0.36 -0.60 -1.94 -1.26 -1.05 119.30 113.39 2c1d s MET 217 Ca 0.52 0.41 -0.05 0.00 -1.71 0.00 0.00 55.69 54.87 2c1d s MET 217 Cb -0.11 -3.46 0.07 0.00 2.01 0.00 0.00 34.83 33.34 2c1d s MET 217 CO 0.49 0.11 0.13 -1.50 -0.01 0.00 0.00 175.02 174.24 2c1d s ILE 218 N 0.79 3.51 0.00 2.53 2.07 0.06 -4.97 121.20 125.19 2c1d s ILE 218 Ca 0.25 -1.49 0.00 0.00 -1.41 0.00 0.00 60.65 58.00 2c1d s ILE 218 Cb -0.15 -3.13 0.00 0.00 0.13 0.00 0.00 42.46 39.31 2c1d s ILE 218 CO 0.10 -0.35 0.00 -1.14 -1.91 0.00 0.00 174.94 171.64 2c1d n ARG 219 N 4.72 0.00 0.00 3.50 3.00 -1.26 -1.38 116.66 125.24 2c1d n ARG 219 Ca -0.10 0.00 0.15 0.00 -0.00 0.00 0.00 57.85 57.90 2c1d n ARG 219 Cb 0.43 0.00 0.72 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 9.69 2.68 -2.73 5.13 0.00 -1.26 -4.83 120.51 129.19 2c1d n ALA 220 Ca 0.00 -0.26 -0.35 0.00 0.00 0.00 0.00 53.44 52.82 2c1d n ALA 220 Cb 0.00 -1.38 -0.08 0.00 0.00 0.00 0.00 19.45 17.99 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 -2.25 6.28 -0.37 0.00 1.01 -0.48 -5.06 116.67 115.81 2c1d s ASP 221 Ca 0.37 0.32 -0.27 0.00 0.71 0.00 0.00 52.55 53.68 2c1d s ASP 221 Cb 0.21 -2.12 0.02 0.00 1.01 0.00 0.00 42.92 42.04 2c1d s ASP 221 CO 0.42 0.16 0.97 -2.28 0.21 0.00 0.00 175.17 174.65 2c1d s HIS 222 N 0.36 3.07 -0.06 4.23 5.65 -1.26 -0.76 115.29 126.52 2c1d s HIS 222 Ca 0.11 0.84 -0.30 0.00 0.25 0.00 0.00 55.06 55.96 2c1d s HIS 222 Cb -0.12 -3.72 -0.03 0.00 -1.18 0.00 0.00 32.58 27.53 2c1d s HIS 222 CO -0.00 -0.85 1.18 -0.51 -0.65 0.00 0.00 174.74 173.90 2c1d s LEU 223 N 3.59 4.28 0.00 8.88 1.43 -0.22 -4.93 118.68 131.71 2c1d s LEU 223 Ca 0.40 1.78 -0.00 0.00 -1.03 0.00 0.00 54.13 55.28 2c1d s LEU 223 Cb -0.12 -3.56 0.09 0.00 0.03 0.00 0.00 46.19 42.64 2c1d s LEU 223 CO 0.19 -0.56 0.63 -1.54 0.23 0.00 0.00 176.35 175.30 2c1d n SER 224 N 5.14 0.84 0.00 2.29 3.41 -1.26 0.24 113.62 124.27 2c1d n SER 224 Ca 0.11 -1.71 0.10 0.00 -0.26 0.00 0.00 58.87 57.10 2c1d n SER 224 Cb 0.47 -0.41 0.57 0.00 -0.26 0.00 0.00 64.21 64.58 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 -2.17 0.84 -3.36 4.33 6.02 -1.26 -4.43 117.38 117.35 2c1d n GLN 225 Ca 0.10 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.91 2c1d n GLN 225 Cb 0.37 -1.36 0.07 0.00 1.02 0.00 0.00 30.24 30.35 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 0.58 -0.31 3.86 1.08 0.00 -1.26 -4.81 105.19 104.33 2c1d n GLY 226 Ca 0.14 0.09 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 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 -5.67 3.85 -0.10 1.61 -1.52 -1.26 -5.01 119.66 111.56 2c1d s GLN 227 Ca 0.26 0.66 0.14 0.00 -1.95 0.00 0.00 55.36 54.46 2c1d s GLN 227 Cb -0.11 -2.30 0.29 0.00 -0.22 0.00 0.00 33.01 30.67 2c1d s GLN 227 CO 0.64 -0.11 1.19 0.44 -0.25 0.00 0.00 175.29 177.20 2c1d n ILE 228 N -1.35 1.71 0.29 1.08 -5.35 -1.26 -4.68 119.36 109.79 2c1d n ILE 228 Ca 0.04 -1.79 0.12 0.00 -0.27 0.00 0.00 62.75 60.86 2c1d n ILE 228 Cb 0.54 -0.02 0.58 0.00 -1.74 0.00 0.00 39.64 39.00 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 0.62 0.00 0.10 7.28 7.08 -1.90 -2.57 115.58 126.19 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 0.97 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.21 2c1d h ASN 229 CO 0.05 0.00 -0.35 0.61 -2.08 0.00 0.00 177.43 175.66 2c1d n GLY 230 N -0.61 -0.25 3.84 9.14 0.00 -1.26 -2.05 105.19 114.01 2c1d n GLY 230 Ca 0.00 -0.52 -0.32 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.46 3.39 0.59 1.61 0.40 -0.97 -2.05 117.98 118.48 2c1d s PHE 231 Ca 0.22 1.36 -0.19 0.00 -0.60 0.00 0.00 56.93 57.73 2c1d s PHE 231 Cb 0.19 -2.68 -0.04 0.00 0.51 0.00 0.00 43.02 41.00 2c1d s PHE 231 CO 0.53 -0.12 1.18 -2.14 0.70 0.00 0.00 175.22 175.37 2c1d s PRO 232 N -3.49 3.05 -0.05 0.24 0.02 -1.26 -4.76 135.00 128.75 2c1d s PRO 232 Ca 0.57 1.74 0.05 0.00 0.02 0.00 0.00 61.00 63.38 2c1d s PRO 232 Cb -0.10 -1.95 -0.01 0.00 0.02 0.00 0.00 34.50 32.47 2c1d s PRO 232 CO 0.22 -1.12 -0.21 0.99 -0.33 0.00 0.00 177.00 176.55 2c1d s THR 233 N -1.70 1.72 -0.26 0.99 2.01 -0.79 -2.66 115.64 114.95 2c1d s THR 233 Ca 0.75 -0.88 -0.24 0.00 0.31 0.00 0.00 61.69 61.63 2c1d s THR 233 Cb -0.28 -1.47 -0.00 0.00 0.01 0.00 0.00 72.50 70.76 2c1d s THR 233 CO 0.32 0.49 0.83 -0.47 -0.69 0.00 0.00 174.62 175.10 2c1d s TYR 234 N -0.03 3.28 -0.27 4.92 6.14 0.11 -0.37 117.35 131.13 2c1d s TYR 234 Ca -0.05 1.06 -0.13 0.00 0.64 0.00 0.00 57.07 58.59 2c1d s TYR 234 Cb -0.13 -3.12 -0.04 0.00 0.42 0.00 0.00 41.96 39.09 2c1d s TYR 234 CO 0.03 -0.46 0.30 1.03 0.64 0.00 0.00 175.55 177.09 2c1d s ARG 235 N 2.91 4.01 0.36 4.97 0.52 -0.49 -1.77 118.95 129.47 2c1d s ARG 235 Ca 0.35 -0.09 0.05 0.00 -0.52 0.00 0.00 55.73 55.52 2c1d s ARG 235 Cb -0.15 -3.64 0.71 0.00 0.52 0.00 0.00 34.95 32.39 2c1d s ARG 235 CO 0.09 -0.21 1.98 -0.07 0.02 0.00 0.00 175.30 177.11 2c1d h LEU 236 N 8.41 0.68 -1.38 2.53 3.38 -1.39 -0.33 115.31 127.20 2c1d h LEU 236 Ca -0.33 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.57 2c1d h LEU 236 Cb 1.17 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 2c1d h LEU 236 CO 0.62 0.46 -0.31 0.07 0.09 0.00 0.00 178.44 179.36 2c1d h LYS 237 N 0.78 0.00 0.00 1.13 2.10 -1.84 -3.08 116.57 115.66 2c1d h LYS 237 Ca 0.28 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.93 2c1d h LYS 237 Cb 0.13 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.46 2c1d h LYS 237 CO -0.08 0.31 -1.50 -0.25 -2.00 0.00 0.00 179.45 175.93 2c1d n ASP 238 N -4.10 0.40 -3.77 7.07 8.00 -0.78 -4.98 116.55 118.39 2c1d n ASP 238 Ca -0.02 -0.13 -0.28 0.00 0.71 0.00 0.00 54.79 55.07 2c1d n ASP 238 Cb 0.36 1.36 0.04 0.00 -0.02 0.00 0.00 41.12 42.86 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 -2.15 -5.31 -3.77 -2.24 7.64 -0.20 -4.95 113.62 102.63 2c1d n SER 239 Ca -0.01 -0.67 -0.06 0.00 1.01 0.00 0.00 58.87 59.14 2c1d n SER 239 Cb 0.50 -4.22 -0.02 0.00 -1.01 0.00 0.00 64.21 59.47 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 -3.25 -0.12 0.35 0.23 0.00 -1.22 -5.01 107.32 98.30 2c1d s GLY 240 Ca 0.62 -0.18 -0.19 0.00 0.00 0.00 0.00 44.72 44.98 2c1d s GLY 240 CO 0.77 -0.02 0.83 1.06 0.00 0.00 0.00 173.10 175.74 2c1d s MET 241 N -3.59 4.17 0.02 2.90 -1.94 -1.26 -1.39 119.30 118.22 2c1d s MET 241 Ca 0.12 0.92 0.01 0.00 -1.71 0.00 0.00 55.69 55.03 2c1d s MET 241 Cb -0.04 -2.43 -0.02 0.00 2.01 0.00 0.00 34.83 34.35 2c1d s MET 241 CO 0.05 0.13 -0.05 0.14 -0.01 0.00 0.00 175.02 175.29 2c1d s VAL 242 N -1.96 0.30 0.26 -6.03 -7.23 0.50 -4.92 120.40 101.31 2c1d s VAL 242 Ca 0.55 -0.84 0.05 0.00 -1.81 0.00 0.00 61.98 59.94 2c1d s VAL 242 Cb -0.11 -0.38 -0.03 0.00 0.56 0.00 0.00 36.38 36.41 2c1d s VAL 242 CO 0.17 -0.36 0.36 0.42 -0.31 0.00 0.00 175.10 175.38 2c1d s THR 243 N -1.18 4.97 0.27 5.32 -4.23 -1.26 -1.89 115.64 117.64 2c1d s THR 243 Ca -0.11 -1.04 -0.01 0.00 -1.18 0.00 0.00 61.69 59.35 2c1d s THR 243 Cb -0.08 -3.73 0.28 0.00 1.34 0.00 0.00 72.50 70.30 2c1d s THR 243 CO -0.00 -0.30 1.86 0.00 -0.54 0.00 0.00 174.62 175.63 2c1d h ALA 244 N 1.17 1.45 -0.07 3.99 0.00 -1.96 -1.51 119.26 122.33 2c1d h ALA 244 Ca -0.51 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.42 2c1d h ALA 244 Cb 1.24 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 2c1d h ALA 244 CO 0.60 0.35 -0.08 1.96 0.00 0.00 0.00 179.25 182.08 2c1d h GLN 245 N 1.10 -0.11 -0.75 0.00 1.08 -1.94 -1.36 115.11 113.13 2c1d h GLN 245 Ca 0.46 0.01 -0.06 0.00 -1.45 0.00 0.00 58.65 57.61 2c1d h GLN 245 Cb 0.31 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.73 2c1d h GLN 245 CO -0.21 -0.07 0.23 1.25 -0.95 0.00 0.00 178.83 179.08 2c1d h HIS 246 N -0.11 1.20 -0.45 2.96 2.76 -1.80 -2.20 115.15 117.51 2c1d h HIS 246 Ca 0.06 -0.12 0.07 0.00 -2.20 0.00 0.00 60.37 58.18 2c1d h HIS 246 Cb 0.19 -0.35 -0.06 0.00 1.55 0.00 0.00 27.41 28.74 2c1d h HIS 246 CO -0.18 0.94 0.08 -0.09 -1.30 0.00 0.00 177.93 177.38 2c1d h ARG 247 N 1.11 0.20 -0.94 5.26 9.65 -0.99 -2.54 114.38 126.12 2c1d h ARG 247 Ca 0.24 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 59.11 2c1d h ARG 247 Cb 0.31 -0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 28.80 2c1d h ARG 247 CO -0.01 0.13 0.58 0.74 2.80 0.00 0.00 179.97 184.21 2c1d h PHE 248 N 0.20 1.23 -0.48 2.20 0.05 -0.84 -2.19 116.94 117.11 2c1d h PHE 248 Ca 0.22 0.00 0.07 0.00 3.82 0.00 0.00 57.97 62.09 2c1d h PHE 248 Cb 0.29 -0.41 -0.06 0.00 2.00 0.00 0.00 35.95 37.77 2c1d h PHE 248 CO -0.22 0.81 0.13 0.28 -0.18 0.00 0.00 178.31 179.13 2c1d h VAL 249 N 1.30 0.77 0.00 -0.55 2.07 -0.99 -2.00 116.25 116.85 2c1d h VAL 249 Ca 0.34 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.76 2c1d h VAL 249 Cb -0.07 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.17 2c1d h VAL 249 CO -0.06 0.05 0.00 0.61 0.02 0.00 0.00 177.57 178.19 2c1d n GLY 250 N -1.27 0.94 0.00 2.17 0.00 -0.83 -1.98 105.19 104.22 2c1d n GLY 250 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2c1d n GLY 250 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2c1d n VAL 252 N 0.76 0.00 -0.34 1.61 0.31 -0.75 -1.82 118.33 118.10 2c1d n VAL 252 Ca 0.00 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.40 2c1d n VAL 252 Cb 0.24 0.00 0.25 0.00 -0.91 0.00 0.00 33.84 33.42 2c1d n VAL 252 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 2c1d h ARG 253 N 0.00 0.95 -0.02 5.55 2.43 -1.63 -2.42 114.38 119.25 2c1d h ARG 253 Ca 0.00 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2c1d h ARG 253 Cb 0.00 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.33 2c1d h ARG 253 CO 0.00 0.63 0.00 -0.25 -1.51 0.00 0.00 179.97 178.84 2c1d n ASP 254 N -4.57 0.21 -0.53 -3.80 8.00 -0.76 -1.21 116.55 113.89 2c1d n ASP 254 Ca 0.17 -1.55 0.05 0.00 0.71 0.00 0.00 54.79 54.17 2c1d n ASP 254 Cb 0.32 -0.02 0.14 0.00 -0.02 0.00 0.00 41.12 41.55 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 -0.61 0.38 -3.24 -3.53 -2.24 -0.91 -4.93 114.28 99.20 2c1d n THR 255 Ca 0.12 -0.38 -0.15 0.00 -2.27 0.00 0.00 64.05 61.37 2c1d n THR 255 Cb 0.09 0.20 0.07 0.00 -2.10 0.00 0.00 70.33 68.59 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 0.34 -3.59 -4.36 -0.78 1.74 -0.35 -1.32 116.66 108.34 2c1d n ARG 256 Ca 0.10 0.83 -0.19 0.00 -0.77 0.00 0.00 57.85 57.82 2c1d n ARG 256 Cb 0.25 -5.69 -0.10 0.00 -1.02 0.00 0.00 32.46 25.90 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 2.05 -0.08 7.54 0.00 -1.15 -1.08 121.76 125.67 2c1d s ALA 257 Ca 0.29 -1.72 -0.30 0.00 0.00 0.00 0.00 51.96 50.23 2c1d s ALA 257 Cb -0.04 0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 2c1d s ALA 257 CO 0.71 -0.00 1.43 -2.00 0.00 0.00 0.00 175.76 175.89 2c1d s GLU 258 N -3.69 4.23 0.74 0.00 2.12 -1.26 -4.50 118.70 116.34 2c1d s GLU 258 Ca 0.24 1.92 -0.10 0.00 0.36 0.00 0.00 54.97 57.39 2c1d s GLU 258 Cb 0.01 -3.79 0.17 0.00 0.26 0.00 0.00 34.13 30.78 2c1d s GLU 258 CO 0.08 -0.71 1.01 0.25 -0.54 0.00 0.00 175.26 175.35 2c1d n THR 259 N 5.21 0.00 -3.99 -1.70 -2.24 -1.26 -4.87 114.28 105.42 2c1d n THR 259 Ca 0.15 -0.92 -0.22 0.00 -2.27 0.00 0.00 64.05 60.79 2c1d n THR 259 Cb 0.44 -1.44 -0.04 0.00 -2.10 0.00 0.00 70.33 67.18 2c1d n THR 259 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2c1d s PHE 260 N -3.14 2.98 0.20 4.78 0.40 -1.26 -5.06 117.98 116.87 2c1d s PHE 260 Ca 0.59 -0.21 -0.30 0.00 -0.60 0.00 0.00 56.93 56.41 2c1d s PHE 260 Cb -0.02 -1.57 -0.08 0.00 0.51 0.00 0.00 43.02 41.86 2c1d s PHE 260 CO 0.41 0.37 1.01 0.21 0.70 0.00 0.00 175.22 177.93 2c1d s LYS 261 N -3.90 4.72 0.13 0.44 2.20 -1.26 -4.77 119.74 117.30 2c1d s LYS 261 Ca 0.36 1.59 -0.33 0.00 -0.36 0.00 0.00 55.97 57.23 2c1d s LYS 261 Cb -0.07 -3.29 -0.13 0.00 -1.51 0.00 0.00 37.83 32.83 2c1d s LYS 261 CO 0.25 0.28 1.67 0.00 -0.36 0.00 0.00 175.35 177.19 2c1d n ALA 262 N 2.02 1.63 -0.69 3.13 0.00 -1.26 -1.66 120.51 123.67 2c1d n ALA 262 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.85 2c1d n ALA 262 Cb 0.47 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.50 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 3.71 0.90 3.73 0.00 0.00 -1.26 -4.95 105.19 107.32 2c1d n GLY 263 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.01 4.27 0.28 1.61 1.04 -0.67 -4.73 113.70 112.49 2c1d s SER 264 Ca 0.00 2.20 0.01 0.00 0.48 0.00 0.00 55.95 58.63 2c1d s SER 264 Cb 0.00 -2.57 0.55 0.00 0.10 0.00 0.00 66.02 64.10 2c1d s SER 264 CO 0.00 -2.21 1.82 0.44 0.98 0.00 0.00 173.24 174.27 2c1d h ASP 265 N -0.52 0.84 -0.41 7.02 3.32 -1.97 0.17 116.42 124.87 2c1d h ASP 265 Ca -0.46 0.06 -0.07 0.00 0.02 0.00 0.00 57.03 56.58 2c1d h ASP 265 Cb 1.27 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 2c1d h ASP 265 CO 0.50 0.43 0.00 0.44 -1.72 0.00 0.00 179.24 178.89 2c1d h ASP 266 N 0.90 0.71 1.06 6.45 3.32 -1.94 -1.53 116.42 125.40 2c1d h ASP 266 Ca 0.49 -0.30 -0.07 0.00 0.02 0.00 0.00 57.03 57.17 2c1d h ASP 266 Cb 0.53 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 2c1d h ASP 266 CO -0.29 0.85 -0.32 -0.26 -1.72 0.00 0.00 179.24 177.50 2c1d h PHE 267 N 0.56 0.00 -0.39 4.55 0.05 -1.63 -0.24 116.94 119.85 2c1d h PHE 267 Ca 0.12 0.00 -0.05 0.00 3.82 0.00 0.00 57.97 61.86 2c1d h PHE 267 Cb 0.48 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.41 2c1d h PHE 267 CO 0.04 0.32 0.04 0.87 -0.18 0.00 0.00 178.31 179.40 2c1d h LYS 268 N 0.00 0.66 -0.59 1.51 1.57 -0.44 0.27 116.57 119.55 2c1d h LYS 268 Ca -0.00 -0.19 -0.07 0.00 -1.87 0.00 0.00 60.65 58.51 2c1d h LYS 268 Cb 0.94 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.15 2c1d h LYS 268 CO 0.04 0.73 0.09 0.00 -0.57 0.00 0.00 179.45 179.74 2c1d h ALA 269 N 0.90 0.78 -0.60 3.86 0.00 -1.07 -1.87 119.26 121.27 2c1d h ALA 269 Ca 0.12 -0.26 0.06 0.00 0.00 0.00 0.00 54.91 54.82 2c1d h ALA 269 Cb 0.41 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 2c1d h ALA 269 CO 0.01 0.54 0.31 1.25 0.00 0.00 0.00 179.25 181.37 2c1d h LEU 270 N 0.88 0.44 -0.90 0.00 5.85 -0.99 -1.11 115.31 119.48 2c1d h LEU 270 Ca 0.18 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 2c1d h LEU 270 Cb 0.44 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 2c1d h LEU 270 CO 0.01 0.29 0.40 -0.08 -0.34 0.00 0.00 178.44 178.72 2c1d h GLU 271 N 0.58 1.19 -0.06 1.25 4.81 -0.50 0.52 114.58 122.38 2c1d h GLU 271 Ca 0.27 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 2c1d h GLU 271 Cb 0.20 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.36 2c1d h GLU 271 CO -0.19 0.91 0.04 1.25 -0.73 0.00 0.00 179.01 180.29 2c1d h LEU 272 N 1.18 0.07 -0.01 1.64 5.85 -1.08 -0.08 115.31 122.88 2c1d h LEU 272 Ca 0.29 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 59.00 2c1d h LEU 272 Cb 0.12 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 2c1d h LEU 272 CO -0.04 0.05 0.00 0.22 -0.34 0.00 0.00 178.44 178.34 2c1d h TYR 273 N 0.08 0.02 -0.43 1.25 3.20 -0.75 -2.67 116.97 117.66 2c1d h TYR 273 Ca 0.02 -0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.75 2c1d h TYR 273 Cb -0.01 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 2c1d h TYR 273 CO -0.07 0.18 -0.30 0.28 -1.64 0.00 0.00 178.16 176.61 2c1d h VAL 274 N -0.16 1.27 -0.80 1.81 2.07 -0.87 -1.88 116.25 117.69 2c1d h VAL 274 Ca 0.00 -1.47 0.14 0.00 0.82 0.00 0.00 66.70 66.20 2c1d h VAL 274 Cb 0.18 1.25 -0.09 0.00 -1.52 0.00 0.00 31.29 31.11 2c1d h VAL 274 CO -0.00 0.50 0.37 0.00 0.02 0.00 0.00 177.57 178.46 2c1d h ALA 275 N 0.85 1.17 0.00 1.67 0.00 -0.98 -2.07 119.26 119.89 2c1d h ALA 275 Ca 0.09 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 2c1d h ALA 275 Cb 0.88 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2c1d h ALA 275 CO 0.08 -0.14 -0.23 0.66 0.00 0.00 0.00 179.25 179.62 2c1d h SER 276 N 0.54 0.00 0.50 0.00 4.64 -0.99 -1.75 113.55 116.48 2c1d h SER 276 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 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 -0.37 0.23 0.00 0.54 -0.87 0.00 0.00 176.83 176.36 2c1d n ARG 277 N -3.44 0.15 -0.25 4.77 1.74 -0.78 -1.77 116.66 117.08 2c1d n ARG 277 Ca -0.00 0.46 0.08 0.00 -0.77 0.00 0.00 57.85 57.62 2c1d n ARG 277 Cb 0.42 -1.83 0.22 0.00 -1.02 0.00 0.00 32.46 30.24 2c1d n ARG 277 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2c1d n GLY 278 N -0.38 2.68 3.67 -0.13 0.00 -0.66 -4.79 105.19 105.57 2c1d n GLY 278 Ca 0.01 -0.53 -0.49 0.00 0.00 0.00 0.00 46.02 45.01 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 0.92 2.92 0.00 1.61 3.02 -0.73 -1.36 115.26 121.64 2c1d n ASN 279 Ca 0.16 1.05 0.00 0.00 -0.03 0.00 0.00 54.58 55.76 2c1d n ASN 279 Cb 0.50 -1.34 0.00 0.00 -0.61 0.00 0.00 39.78 38.33 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 3.72 2.11 3.74 7.41 0.00 -0.66 -4.26 105.19 117.25 2c1d n GLY 280 Ca 0.20 -0.22 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 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 3.45 0.34 0.99 1.43 -0.46 -4.66 118.68 119.76 2c1d s LEU 281 Ca 0.00 2.28 -0.26 0.00 -1.03 0.00 0.00 54.13 55.11 2c1d s LEU 281 Cb 0.00 -4.58 -0.09 0.00 0.03 0.00 0.00 46.19 41.54 2c1d s LEU 281 CO 0.00 -1.88 1.04 -0.44 0.23 0.00 0.00 176.35 175.30 2c1d s SER 282 N -2.02 7.06 -0.07 2.29 0.01 -0.67 -0.50 113.70 119.79 2c1d s SER 282 Ca 0.73 2.07 -0.33 0.00 1.31 0.00 0.00 55.95 59.73 2c1d s SER 282 Cb -0.27 -2.60 -0.11 0.00 0.21 0.00 0.00 66.02 63.25 2c1d s SER 282 CO 0.40 -0.28 1.91 0.52 0.41 0.00 0.00 173.24 176.20 2c1d n VAL 283 N 0.50 0.63 0.30 3.43 0.31 -0.28 -4.75 118.33 118.48 2c1d n VAL 283 Ca 0.02 -0.11 0.12 0.00 -0.01 0.00 0.00 64.34 64.36 2c1d n VAL 283 Cb 0.48 -1.97 0.23 0.00 -0.91 0.00 0.00 33.84 31.67 2c1d n VAL 283 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2c1d h GLU 284 N 9.55 0.00 0.00 5.55 5.08 -1.73 -1.05 114.58 131.98 2c1d h GLU 284 Ca -0.49 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 2c1d h GLU 284 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2c1d h GLU 284 CO 0.95 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 179.37 2c1d n GLY 285 N 1.10 1.13 2.81 -3.84 0.00 -1.26 -4.70 105.19 100.43 2c1d n GLY 285 Ca 0.04 -0.55 -0.22 0.00 0.00 0.00 0.00 46.02 45.29 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 0.47 0.41 1.61 -7.23 -1.26 -3.98 120.40 110.41 2c1d s VAL 286 Ca 0.00 0.03 0.08 0.00 -1.81 0.00 0.00 61.98 60.28 2c1d s VAL 286 Cb 0.00 -0.58 0.00 0.00 0.56 0.00 0.00 36.38 36.36 2c1d s VAL 286 CO 0.00 0.26 0.54 -0.94 -0.31 0.00 0.00 175.10 174.65 2c1d s SER 287 N 1.69 5.66 -0.09 4.85 1.04 -0.87 -4.93 113.70 121.05 2c1d s SER 287 Ca 0.01 -0.41 0.03 0.00 0.48 0.00 0.00 55.95 56.06 2c1d s SER 287 Cb -0.13 -0.74 0.00 0.00 0.10 0.00 0.00 66.02 65.26 2c1d s SER 287 CO -0.04 -0.70 -0.20 -0.69 0.98 0.00 0.00 173.24 172.59 2c1d s VAL 288 N -2.33 1.73 0.22 5.02 1.01 -1.26 -0.72 120.40 124.07 2c1d s VAL 288 Ca 0.53 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.66 2c1d s VAL 288 Cb -0.09 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.74 2c1d s VAL 288 CO 0.32 0.49 0.22 -0.13 0.00 0.00 0.00 175.10 176.00 2c1d s ARG 289 N 0.47 1.32 0.00 2.72 3.00 -0.73 -4.88 118.95 120.86 2c1d s ARG 289 Ca -0.17 -1.58 0.11 0.00 0.00 0.00 0.00 55.73 54.09 2c1d s ARG 289 Cb -0.17 0.32 0.69 0.00 0.00 0.00 0.00 34.95 35.78 2c1d s ARG 289 CO 0.07 -0.47 1.12 1.58 0.00 0.00 0.00 175.30 177.60