#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a2t s VAL 2 N 0.00 -0.01 0.17 1.69 1.01 -1.26 -2.69 120.40 119.31 3a2t s VAL 2 Ca 0.00 0.02 0.09 0.00 0.00 0.00 0.00 61.98 62.10 3a2t s VAL 2 Cb 0.00 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.63 3a2t s VAL 2 CO 0.00 0.01 -0.21 0.42 0.00 0.00 0.00 175.10 175.32 3a2t s THR 3 N 0.64 1.99 -0.14 3.92 -4.23 0.21 -4.97 115.64 113.06 3a2t s THR 3 Ca -0.03 -1.91 -0.04 0.00 -1.18 0.00 0.00 61.69 58.53 3a2t s THR 3 Cb -0.05 -1.91 -0.03 0.00 1.34 0.00 0.00 72.50 71.85 3a2t s THR 3 CO -0.04 -0.22 0.00 -0.22 -0.54 0.00 0.00 174.62 173.61 3a2t s LEU 4 N -2.58 3.52 0.00 4.79 2.96 -1.26 -1.52 118.68 124.60 3a2t s LEU 4 Ca 0.16 0.03 -0.02 0.00 -0.22 0.00 0.00 54.13 54.07 3a2t s LEU 4 Cb -0.07 -1.84 0.01 0.00 0.50 0.00 0.00 46.19 44.79 3a2t s LEU 4 CO 0.07 0.25 0.50 0.00 -1.32 0.00 0.00 176.35 175.85 3a2t n TYR 5 N 3.03 -1.49 -2.51 5.38 4.11 -0.08 -5.01 117.16 120.58 3a2t n TYR 5 Ca -0.18 -2.33 0.00 0.00 -0.00 0.00 0.00 57.90 55.39 3a2t n TYR 5 Cb 0.53 0.57 0.00 0.00 -0.00 0.00 0.00 39.34 40.44 3a2t n TYR 5 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 3a2t n GLY 6 N -0.58 -0.42 3.59 -7.48 0.00 -1.12 -0.38 105.19 98.81 3a2t n GLY 6 Ca 0.00 -1.47 -0.13 0.00 0.00 0.00 0.00 46.02 44.42 3a2t n GLY 6 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3a2t s THR 7 N -2.68 0.00 -0.19 2.61 -4.23 0.34 -1.55 115.64 109.95 3a2t s THR 7 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 3a2t s THR 7 Cb 0.00 -1.00 0.01 0.00 1.34 0.00 0.00 72.50 72.85 3a2t s THR 7 CO 0.00 0.00 -0.17 -0.63 -0.54 0.00 0.00 174.62 173.28 3a2t s ILE 8 N -0.34 2.35 -0.05 2.99 -1.09 0.04 -0.87 121.20 124.24 3a2t s ILE 8 Ca -0.03 -0.84 -0.01 0.00 -2.23 0.00 0.00 60.65 57.54 3a2t s ILE 8 Cb -0.03 -2.01 0.03 0.00 -1.58 0.00 0.00 42.46 38.87 3a2t s ILE 8 CO 0.02 0.52 0.03 -1.59 -1.23 0.00 0.00 174.94 172.68 3a2t s LYS 9 N 1.29 0.24 0.17 2.79 -2.85 -1.26 -1.13 119.74 118.98 3a2t s LYS 9 Ca 0.04 0.21 -0.07 0.00 -1.00 0.00 0.00 55.97 55.15 3a2t s LYS 9 Cb -0.13 -0.64 -0.02 0.00 -2.06 0.00 0.00 37.83 34.98 3a2t s LYS 9 CO -0.10 -0.27 0.24 0.00 0.10 0.00 0.00 175.35 175.32 3a2t s ALA 10 N 1.78 0.24 -0.02 0.59 0.00 -0.76 0.10 121.76 123.70 3a2t s ALA 10 Ca 0.01 -1.06 -0.29 0.00 0.00 0.00 0.00 51.96 50.62 3a2t s ALA 10 Cb -0.12 0.92 0.10 0.00 0.00 0.00 0.00 23.12 24.01 3a2t s ALA 10 CO -0.03 -0.63 1.29 0.20 0.00 0.00 0.00 175.76 176.59 3a2t s GLY 11 N -3.00 -0.15 -0.11 0.00 0.00 -0.81 -0.06 107.32 103.18 3a2t s GLY 11 Ca 0.21 0.08 -0.02 0.00 0.00 0.00 0.00 44.72 44.99 3a2t s GLY 11 CO 0.02 5.30 -0.03 -1.34 0.00 0.00 0.00 173.10 177.04 3a2t s VAL 12 N -2.05 3.97 -0.08 1.40 -7.23 0.04 -0.78 120.40 115.67 3a2t s VAL 12 Ca 0.28 -0.36 0.02 0.00 -1.81 0.00 0.00 61.98 60.12 3a2t s VAL 12 Cb -0.00 -2.69 0.01 0.00 0.56 0.00 0.00 36.38 34.26 3a2t s VAL 12 CO -0.01 0.55 -0.14 -1.83 -0.31 0.00 0.00 175.10 173.36 3a2t s GLU 13 N -0.27 1.97 -0.16 4.82 -1.05 0.10 -1.97 118.70 122.13 3a2t s GLU 13 Ca 0.05 -0.49 -0.09 0.00 -0.15 0.00 0.00 54.97 54.29 3a2t s GLU 13 Cb -0.13 -1.62 -0.05 0.00 -0.44 0.00 0.00 34.13 31.90 3a2t s GLU 13 CO 0.02 0.02 0.14 0.08 0.95 0.00 0.00 175.26 176.47 3a2t s VAL 14 N 0.72 5.45 0.06 1.83 1.01 0.55 -1.55 120.40 128.47 3a2t s VAL 14 Ca -0.13 0.21 -0.11 0.00 0.00 0.00 0.00 61.98 61.95 3a2t s VAL 14 Cb -0.16 -3.44 0.01 0.00 0.00 0.00 0.00 36.38 32.79 3a2t s VAL 14 CO 0.03 0.52 0.23 -0.94 0.00 0.00 0.00 175.10 174.94 3a2t s SER 15 N -0.28 0.01 -0.16 3.32 1.04 0.31 -1.09 113.70 116.85 3a2t s SER 15 Ca 0.11 -0.42 -0.16 0.00 0.48 0.00 0.00 55.95 55.97 3a2t s SER 15 Cb -0.12 0.33 0.04 0.00 0.10 0.00 0.00 66.02 66.38 3a2t s SER 15 CO 0.01 -0.65 0.45 -0.60 0.98 0.00 0.00 173.24 173.43 3a2t s ARG 16 N -3.07 0.53 -0.04 4.02 3.52 -0.93 0.10 118.95 123.09 3a2t s ARG 16 Ca -0.01 0.59 0.07 0.00 -0.13 0.00 0.00 55.73 56.25 3a2t s ARG 16 Cb 0.01 0.26 -0.02 0.00 -1.56 0.00 0.00 34.95 33.65 3a2t s ARG 16 CO -0.07 -0.07 -0.25 0.08 -0.81 0.00 0.00 175.30 174.19 3a2t s VAL 17 N 0.17 2.12 -0.35 7.11 1.01 -1.26 -2.67 120.40 126.52 3a2t s VAL 17 Ca -0.01 -1.06 -0.06 0.00 0.00 0.00 0.00 61.98 60.85 3a2t s VAL 17 Cb -0.03 -1.75 0.05 0.00 0.00 0.00 0.00 36.38 34.65 3a2t s VAL 17 CO 0.01 0.57 0.12 -0.75 0.00 0.00 0.00 175.10 175.06 3a2t s LYS 18 N -0.37 2.53 -0.04 2.72 2.20 0.15 -0.62 119.74 126.30 3a2t s LYS 18 Ca 0.03 -1.30 -0.01 0.00 -0.36 0.00 0.00 55.97 54.32 3a2t s LYS 18 Cb -0.12 -3.48 0.03 0.00 -1.51 0.00 0.00 37.83 32.75 3a2t s LYS 18 CO 0.02 -0.75 0.07 0.34 -0.36 0.00 0.00 175.35 174.67 3a2t s ASP 19 N 1.54 0.27 0.25 1.43 -1.08 0.03 -0.81 116.67 118.30 3a2t s ASP 19 Ca -0.00 0.12 0.16 0.00 -0.52 0.00 0.00 52.55 52.31 3a2t s ASP 19 Cb -0.20 -0.00 0.04 0.00 -1.46 0.00 0.00 42.92 41.30 3a2t s ASP 19 CO 0.01 -0.16 1.34 0.00 0.52 0.00 0.00 175.17 176.88 3a2t h ALA 20 N 7.57 0.68 0.03 3.66 0.00 -1.75 -3.13 119.26 126.32 3a2t h ALA 20 Ca -0.37 -0.48 -0.24 0.00 0.00 0.00 0.00 54.91 53.83 3a2t h ALA 20 Cb 1.12 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.92 3a2t h ALA 20 CO 0.38 0.62 -0.94 0.78 0.00 0.00 0.00 179.25 180.09 3a2t h GLY 21 N 3.58 0.65 0.59 0.00 0.00 -1.90 -3.38 103.07 102.61 3a2t h GLY 21 Ca -0.03 -1.20 -0.24 0.00 0.00 0.00 0.00 47.33 45.85 3a2t h GLY 21 CO 0.06 1.06 -1.84 -1.30 0.00 0.00 0.00 176.54 174.52 3a2t n THR 22 N -3.97 1.23 -4.53 4.70 -2.24 -1.26 -4.87 114.28 103.35 3a2t n THR 22 Ca -0.12 -0.75 -0.33 0.00 -2.27 0.00 0.00 64.05 60.58 3a2t n THR 22 Cb 0.84 -0.66 -0.15 0.00 -2.10 0.00 0.00 70.33 68.27 3a2t n THR 22 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3a2t s TYR 23 N -2.77 2.83 -0.15 4.78 2.02 -1.18 -5.01 117.35 117.87 3a2t s TYR 23 Ca -0.06 -0.83 0.22 0.00 -0.37 0.00 0.00 57.07 56.03 3a2t s TYR 23 Cb 0.08 -1.91 -0.28 0.00 -0.40 0.00 0.00 41.96 39.45 3a2t s TYR 23 CO 0.83 -0.36 0.59 0.36 -1.57 0.00 0.00 175.55 175.40 3a2t n LYS 24 N 3.93 0.59 -2.69 -0.62 0.00 -1.26 -4.14 118.16 113.97 3a2t n LYS 24 Ca -0.18 -0.14 -0.42 0.00 -0.00 0.00 0.00 58.31 57.56 3a2t n LYS 24 Cb 0.52 -1.55 -0.03 0.00 -0.00 0.00 0.00 35.03 33.97 3a2t n LYS 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3a2t s ALA 25 N -3.45 3.39 -0.75 0.58 0.00 -1.26 -4.40 121.76 115.86 3a2t s ALA 25 Ca -0.06 0.39 -0.02 0.00 0.00 0.00 0.00 51.96 52.27 3a2t s ALA 25 Cb 0.14 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.83 3a2t s ALA 25 CO 0.89 -0.58 0.64 0.94 0.00 0.00 0.00 175.76 177.65 3a2t n GLN 26 N 4.94 -4.28 -2.31 0.00 -0.06 -1.26 -2.97 117.38 111.44 3a2t n GLN 26 Ca 0.09 0.50 -0.05 0.00 -2.00 0.00 0.00 57.00 55.54 3a2t n GLN 26 Cb 0.49 -4.52 0.00 0.00 -4.06 0.00 0.00 30.24 22.15 3a2t n GLN 26 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3a2t n GLY 27 N -1.20 0.32 2.55 1.69 0.00 -1.26 -3.69 105.19 103.60 3a2t n GLY 27 Ca -0.10 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.30 3a2t n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a2t n GLY 28 N -0.95 0.72 3.72 -0.02 0.00 -1.25 -4.81 105.19 102.61 3a2t n GLY 28 Ca -0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 3a2t n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a2t s LYS 29 N -0.07 4.66 0.81 1.61 1.02 -1.16 -0.79 119.74 125.83 3a2t s LYS 29 Ca 0.00 1.43 -0.08 0.00 0.02 0.00 0.00 55.97 57.34 3a2t s LYS 29 Cb 0.00 -3.40 0.14 0.00 -0.52 0.00 0.00 37.83 34.05 3a2t s LYS 29 CO 0.00 0.15 1.13 -1.54 -0.92 0.00 0.00 175.35 174.17 3a2t s SER 30 N 0.24 3.99 0.72 2.83 1.04 0.20 -4.64 113.70 118.09 3a2t s SER 30 Ca 0.48 0.11 -0.10 0.00 0.48 0.00 0.00 55.95 56.92 3a2t s SER 30 Cb -0.23 -0.43 0.05 0.00 0.10 0.00 0.00 66.02 65.51 3a2t s SER 30 CO 0.29 -2.13 1.08 -0.54 0.98 0.00 0.00 173.24 172.92 3a2t s LYS 31 N -5.46 2.40 -0.27 4.02 1.02 -1.26 -4.67 119.74 115.52 3a2t s LYS 31 Ca 0.68 0.10 -0.18 0.00 0.02 0.00 0.00 55.97 56.59 3a2t s LYS 31 Cb -0.06 -2.07 -0.03 0.00 -0.52 0.00 0.00 37.83 35.15 3a2t s LYS 31 CO 0.48 -1.23 0.50 0.99 -0.92 0.00 0.00 175.35 175.18 3a2t s THR 32 N -3.35 5.07 -0.13 2.17 2.01 -1.26 -4.51 115.64 115.65 3a2t s THR 32 Ca 0.59 0.82 -0.14 0.00 0.31 0.00 0.00 61.69 63.27 3a2t s THR 32 Cb -0.11 -3.83 -0.05 0.00 0.01 0.00 0.00 72.50 68.53 3a2t s THR 32 CO 0.48 0.07 0.32 0.00 -0.69 0.00 0.00 174.62 174.80 3a2t s ALA 33 N 2.30 3.62 -0.20 7.40 0.00 0.12 -4.90 121.76 130.10 3a2t s ALA 33 Ca 0.20 -0.41 0.01 0.00 0.00 0.00 0.00 51.96 51.77 3a2t s ALA 33 Cb -0.16 -2.38 0.03 0.00 0.00 0.00 0.00 23.12 20.61 3a2t s ALA 33 CO 0.09 0.19 -0.17 0.99 0.00 0.00 0.00 175.76 176.86 3a2t s THR 34 N 0.10 2.17 0.12 0.00 2.01 -1.26 -0.53 115.64 118.25 3a2t s THR 34 Ca 0.18 -1.03 0.03 0.00 0.31 0.00 0.00 61.69 61.19 3a2t s THR 34 Cb -0.14 -1.98 -0.04 0.00 0.01 0.00 0.00 72.50 70.35 3a2t s THR 34 CO 0.06 0.43 -0.09 -1.10 -0.69 0.00 0.00 174.62 173.23 3a2t s GLN 35 N 1.27 0.94 -0.18 4.92 -0.21 -0.60 -4.96 119.66 120.84 3a2t s GLN 35 Ca 0.03 -1.35 -0.14 0.00 0.02 0.00 0.00 55.36 53.92 3a2t s GLN 35 Cb -0.14 -0.46 -0.05 0.00 1.00 0.00 0.00 33.01 33.36 3a2t s GLN 35 CO -0.11 0.04 0.29 0.42 -2.12 0.00 0.00 175.29 173.81 3a2t s ILE 36 N -3.24 5.30 0.00 1.08 1.01 -1.26 0.00 121.20 124.09 3a2t s ILE 36 Ca 0.13 0.51 -0.05 0.00 0.00 0.00 0.00 60.65 61.24 3a2t s ILE 36 Cb 0.02 -3.63 -0.00 0.00 0.01 0.00 0.00 42.46 38.86 3a2t s ILE 36 CO -0.01 0.36 0.10 0.00 0.00 0.00 0.00 174.94 175.38 3a2t s ALA 37 N 0.69 -0.22 -0.01 9.38 0.00 0.04 -4.97 121.76 126.66 3a2t s ALA 37 Ca 0.15 -0.21 -0.27 0.00 0.00 0.00 0.00 51.96 51.63 3a2t s ALA 37 Cb -0.13 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 3a2t s ALA 37 CO 0.04 -0.19 0.85 0.34 0.00 0.00 0.00 175.76 176.80 3a2t s ASP 38 N -1.32 7.22 -0.05 0.00 2.15 -1.26 -1.93 116.67 121.48 3a2t s ASP 38 Ca -0.14 1.47 0.05 0.00 0.43 0.00 0.00 52.55 54.35 3a2t s ASP 38 Cb -0.08 -2.50 0.22 0.00 -0.30 0.00 0.00 42.92 40.27 3a2t s ASP 38 CO 0.01 -0.16 0.94 0.49 -0.17 0.00 0.00 175.17 176.28 3a2t n PHE 39 N 3.64 0.52 -0.13 -5.34 3.72 0.28 -4.26 117.46 115.88 3a2t n PHE 39 Ca 0.02 -0.19 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 3a2t n PHE 39 Cb 0.51 -0.16 0.00 0.00 -0.94 0.00 0.00 39.48 38.89 3a2t n PHE 39 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3a2t n GLY 40 N 0.36 0.86 3.63 1.37 0.00 -1.25 -4.46 105.19 105.69 3a2t n GLY 40 Ca 0.08 -0.03 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 3a2t n GLY 40 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3a2t n SER 41 N 0.05 1.11 -3.78 1.61 7.64 -1.26 -4.86 113.62 114.12 3a2t n SER 41 Ca 0.00 0.88 -0.11 0.00 1.01 0.00 0.00 58.87 60.65 3a2t n SER 41 Cb 0.03 -1.40 -0.08 0.00 -1.01 0.00 0.00 64.21 61.75 3a2t n SER 41 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 3a2t s LYS 42 N -2.56 0.79 -0.06 1.43 -2.85 -0.05 -1.25 119.74 115.18 3a2t s LYS 42 Ca 0.72 -0.58 -0.03 0.00 -1.00 0.00 0.00 55.97 55.08 3a2t s LYS 42 Cb -0.45 0.33 0.03 0.00 -2.06 0.00 0.00 37.83 35.69 3a2t s LYS 42 CO 0.50 -0.25 0.14 -1.50 0.10 0.00 0.00 175.35 174.34 3a2t s ILE 43 N -2.69 -0.04 0.16 3.79 2.07 -0.87 -0.50 121.20 123.12 3a2t s ILE 43 Ca -0.04 0.16 -0.04 0.00 -1.41 0.00 0.00 60.65 59.32 3a2t s ILE 43 Cb -0.00 -0.23 -0.03 0.00 0.13 0.00 0.00 42.46 42.33 3a2t s ILE 43 CO -0.04 0.06 0.16 -0.83 -1.91 0.00 0.00 174.94 172.38 3a2t s GLY 44 N 1.01 0.93 -0.07 1.50 0.00 0.49 -1.33 107.32 109.84 3a2t s GLY 44 Ca -0.08 -1.34 0.02 0.00 0.00 0.00 0.00 44.72 43.33 3a2t s GLY 44 CO -0.05 -1.19 -0.12 -1.36 0.00 0.00 0.00 173.10 170.38 3a2t s PHE 45 N -4.05 1.50 0.06 1.90 0.08 -0.08 -0.91 117.98 116.48 3a2t s PHE 45 Ca 0.26 -0.58 0.00 0.00 0.12 0.00 0.00 56.93 56.73 3a2t s PHE 45 Cb 0.06 -1.11 -0.04 0.00 -0.57 0.00 0.00 43.02 41.36 3a2t s PHE 45 CO 0.04 -0.30 -0.05 -1.59 -0.10 0.00 0.00 175.22 173.22 3a2t s LYS 46 N 0.75 0.63 0.20 0.44 -2.85 -0.57 -0.38 119.74 117.95 3a2t s LYS 46 Ca -0.13 -1.12 -0.19 0.00 -1.00 0.00 0.00 55.97 53.54 3a2t s LYS 46 Cb -0.16 -0.00 0.03 0.00 -2.06 0.00 0.00 37.83 35.64 3a2t s LYS 46 CO 0.03 -0.05 0.55 0.20 0.10 0.00 0.00 175.35 176.18 3a2t s GLY 47 N -2.60 -0.16 0.00 0.59 0.00 -0.68 0.66 107.32 105.13 3a2t s GLY 47 Ca 0.03 -0.14 -0.12 0.00 0.00 0.00 0.00 44.72 44.50 3a2t s GLY 47 CO -0.06 -0.19 0.24 -0.86 0.00 0.00 0.00 173.10 172.23 3a2t s GLN 48 N -3.86 0.62 -0.07 2.90 -2.07 -1.10 -2.37 119.66 113.72 3a2t s GLN 48 Ca 0.08 -0.34 -0.03 0.00 -1.82 0.00 0.00 55.36 53.26 3a2t s GLN 48 Cb -0.01 0.27 0.04 0.00 -1.09 0.00 0.00 33.01 32.21 3a2t s GLN 48 CO -0.03 -0.17 0.13 -2.00 -1.32 0.00 0.00 175.29 171.90 3a2t s GLU 49 N -1.58 0.03 0.19 9.60 2.12 -0.84 -4.37 118.70 123.85 3a2t s GLU 49 Ca -0.12 0.44 -0.31 0.00 0.36 0.00 0.00 54.97 55.34 3a2t s GLU 49 Cb -0.05 -0.26 -0.09 0.00 0.26 0.00 0.00 34.13 33.98 3a2t s GLU 49 CO 0.02 -0.24 1.46 0.34 -0.54 0.00 0.00 175.26 176.29 3a2t s ASP 50 N 1.75 6.69 0.00 -1.70 2.15 -1.26 -0.37 116.67 123.93 3a2t s ASP 50 Ca -0.02 2.56 0.20 0.00 0.43 0.00 0.00 52.55 55.72 3a2t s ASP 50 Cb -0.12 -2.60 -0.05 0.00 -0.30 0.00 0.00 42.92 39.85 3a2t s ASP 50 CO -0.05 -0.72 0.98 0.18 -0.17 0.00 0.00 175.17 175.39 3a2t n LEU 51 N 3.21 1.72 0.00 -1.34 4.77 0.51 -4.90 117.00 120.98 3a2t n LEU 51 Ca 0.10 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.37 3a2t n LEU 51 Cb 0.40 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 3a2t n LEU 51 CO 0.60 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.61 3a2t n GLY 52 N 1.37 0.73 3.55 -0.72 0.00 -1.25 -4.95 105.19 103.92 3a2t n GLY 52 Ca 0.08 -0.78 -0.38 0.00 0.00 0.00 0.00 46.02 44.93 3a2t n GLY 52 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a2t s ASN 53 N -4.00 5.63 0.00 1.61 0.01 -1.26 -4.25 114.94 112.67 3a2t s ASN 53 Ca 0.00 -0.16 0.00 0.00 -0.71 0.00 0.00 52.86 51.99 3a2t s ASN 53 Cb 0.00 -2.55 0.00 0.00 0.41 0.00 0.00 41.25 39.11 3a2t s ASN 53 CO 0.00 -2.19 0.00 0.61 -1.51 0.00 0.00 177.10 174.01 3a2t n GLY 54 N 5.82 0.00 3.43 0.66 0.00 -1.26 -4.96 105.19 108.88 3a2t n GLY 54 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 3a2t n GLY 54 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3a2t s MET 55 N -1.54 2.28 0.01 1.61 -1.94 -1.26 -3.56 119.30 114.89 3a2t s MET 55 Ca 0.00 -0.84 0.04 0.00 -1.71 0.00 0.00 55.69 53.18 3a2t s MET 55 Cb 0.00 -2.23 -0.01 0.00 2.01 0.00 0.00 34.83 34.59 3a2t s MET 55 CO 0.00 0.58 -0.12 0.15 -0.01 0.00 0.00 175.02 175.63 3a2t s LYS 56 N -0.90 0.89 0.06 2.03 1.02 -0.24 -0.36 119.74 122.25 3a2t s LYS 56 Ca 0.12 -0.52 -0.14 0.00 0.02 0.00 0.00 55.97 55.45 3a2t s LYS 56 Cb -0.10 -0.87 -0.06 0.00 -0.52 0.00 0.00 37.83 36.28 3a2t s LYS 56 CO 0.01 0.23 0.46 0.00 -0.92 0.00 0.00 175.35 175.14 3a2t s ALA 57 N -0.49 3.66 -0.02 5.17 0.00 0.50 -1.31 121.76 129.28 3a2t s ALA 57 Ca 0.03 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 51.79 3a2t s ALA 57 Cb -0.06 -2.43 0.02 0.00 0.00 0.00 0.00 23.12 20.66 3a2t s ALA 57 CO 0.00 0.48 0.00 0.96 0.00 0.00 0.00 175.76 177.21 3a2t s ILE 58 N -1.26 0.12 0.05 0.00 -4.36 -0.10 -1.98 121.20 113.68 3a2t s ILE 58 Ca 0.30 0.07 -0.00 0.00 -0.26 0.00 0.00 60.65 60.76 3a2t s ILE 58 Cb -0.16 -0.20 -0.04 0.00 1.25 0.00 0.00 42.46 43.32 3a2t s ILE 58 CO 0.17 0.11 -0.04 -1.66 0.24 0.00 0.00 174.94 173.75 3a2t s TRP 59 N 0.75 0.56 -0.26 1.37 1.48 -1.00 0.36 118.94 122.20 3a2t s TRP 59 Ca -0.07 -0.94 -0.18 0.00 -1.06 0.00 0.00 56.10 53.85 3a2t s TRP 59 Cb -0.10 -0.39 0.07 0.00 -1.16 0.00 0.00 33.47 31.90 3a2t s TRP 59 CO -0.02 -0.30 0.66 -1.14 -4.06 0.00 0.00 176.95 172.10 3a2t s GLN 60 N -3.44 0.71 -0.26 3.25 0.74 0.10 -1.69 119.66 119.07 3a2t s GLN 60 Ca 0.04 1.10 0.02 0.00 0.05 0.00 0.00 55.36 56.57 3a2t s GLN 60 Cb 0.04 0.20 0.07 0.00 1.10 0.00 0.00 33.01 34.42 3a2t s GLN 60 CO -0.07 -0.13 -0.04 -0.51 -0.55 0.00 0.00 175.29 173.98 3a2t s LEU 61 N 1.23 3.00 -0.06 3.68 1.43 0.49 0.59 118.68 129.02 3a2t s LEU 61 Ca -0.07 -1.37 0.06 0.00 -1.03 0.00 0.00 54.13 51.72 3a2t s LEU 61 Cb -0.05 -1.29 -0.01 0.00 0.03 0.00 0.00 46.19 44.86 3a2t s LEU 61 CO -0.13 -0.25 -0.24 -0.70 0.23 0.00 0.00 176.35 175.26 3a2t s GLU 62 N 1.29 2.62 0.19 1.70 2.12 -1.18 -0.90 118.70 124.54 3a2t s GLU 62 Ca -0.04 -0.88 0.10 0.00 0.36 0.00 0.00 54.97 54.51 3a2t s GLU 62 Cb -0.19 -2.21 -0.04 0.00 0.26 0.00 0.00 34.13 31.95 3a2t s GLU 62 CO -0.07 0.37 -0.20 -0.65 -0.54 0.00 0.00 175.26 174.17 3a2t s GLN 63 N -0.14 1.41 -0.00 4.30 1.11 -0.45 -1.70 119.66 124.19 3a2t s GLN 63 Ca -0.04 -1.50 -0.30 0.00 0.01 0.00 0.00 55.36 53.53 3a2t s GLN 63 Cb -0.14 -1.53 -0.04 0.00 -1.01 0.00 0.00 33.01 30.29 3a2t s GLN 63 CO 0.04 0.31 1.07 0.15 0.01 0.00 0.00 175.29 176.87 3a2t s LYS 64 N -2.91 4.49 -0.44 2.91 1.02 -1.26 -2.04 119.74 121.51 3a2t s LYS 64 Ca 0.20 1.54 0.02 0.00 0.02 0.00 0.00 55.97 57.75 3a2t s LYS 64 Cb -0.06 -3.45 0.14 0.00 -0.52 0.00 0.00 37.83 33.94 3a2t s LYS 64 CO 0.09 -0.18 0.26 0.00 -0.92 0.00 0.00 175.35 174.59 3a2t s ALA 65 N 1.27 2.02 0.19 5.17 0.00 -0.38 -4.46 121.76 125.57 3a2t s ALA 65 Ca 0.54 -2.56 -0.30 0.00 0.00 0.00 0.00 51.96 49.64 3a2t s ALA 65 Cb -0.23 -1.84 -0.08 0.00 0.00 0.00 0.00 23.12 20.97 3a2t s ALA 65 CO 0.27 -2.06 0.96 0.45 0.00 0.00 0.00 175.76 175.37 3a2t s SER 66 N 0.32 7.56 0.00 0.00 0.15 -1.26 -3.86 113.70 116.62 3a2t s SER 66 Ca 0.19 1.91 0.10 0.00 0.70 0.00 0.00 55.95 58.85 3a2t s SER 66 Cb -0.21 -2.60 0.57 0.00 -1.71 0.00 0.00 66.02 62.07 3a2t s SER 66 CO -0.02 0.05 1.33 2.30 1.20 0.00 0.00 173.24 178.09 3a2t n ILE 67 N 2.01 0.00 1.00 6.45 -5.35 -1.26 -2.03 119.36 120.17 3a2t n ILE 67 Ca -0.00 0.00 0.10 0.00 -0.27 0.00 0.00 62.75 62.58 3a2t n ILE 67 Cb 0.48 -0.18 -0.07 0.00 -1.74 0.00 0.00 39.64 38.13 3a2t n ILE 67 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3a2t n ALA 68 N -0.66 4.59 -2.60 -1.28 0.00 -1.26 -4.99 120.51 114.31 3a2t n ALA 68 Ca 0.07 -0.57 -0.03 0.00 0.00 0.00 0.00 53.44 52.92 3a2t n ALA 68 Cb 0.03 -0.81 0.01 0.00 0.00 0.00 0.00 19.45 18.68 3a2t n ALA 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2t n GLY 69 N 1.50 0.79 0.12 0.00 0.00 -0.86 -4.98 105.19 101.75 3a2t n GLY 69 Ca 0.04 -0.59 0.05 0.00 0.00 0.00 0.00 46.02 45.53 3a2t n GLY 69 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3a2t n THR 70 N -2.80 0.00 -3.42 2.61 -2.24 -1.26 -5.02 114.28 102.15 3a2t n THR 70 Ca 0.00 -0.34 -0.20 0.00 -2.27 0.00 0.00 64.05 61.24 3a2t n THR 70 Cb 0.51 1.06 -0.00 0.00 -2.10 0.00 0.00 70.33 69.80 3a2t n THR 70 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3a2t s ASN 71 N -1.62 6.00 -0.27 3.42 0.02 -1.26 -5.01 114.94 116.21 3a2t s ASN 71 Ca 0.06 -0.01 -0.25 0.00 -1.02 0.00 0.00 52.86 51.64 3a2t s ASN 71 Cb 0.08 -1.43 0.13 0.00 0.02 0.00 0.00 41.25 40.05 3a2t s ASN 71 CO 0.32 -0.44 1.07 -0.94 0.02 0.00 0.00 177.10 177.13 3a2t s SER 72 N -4.15 -0.40 0.00 -1.22 1.04 -1.26 -4.88 113.70 102.82 3a2t s SER 72 Ca 0.44 0.75 0.00 0.00 0.48 0.00 0.00 55.95 57.62 3a2t s SER 72 Cb -0.10 0.75 0.00 0.00 0.10 0.00 0.00 66.02 66.78 3a2t s SER 72 CO 0.33 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 175.00 3a2t n GLY 73 N 2.01 2.91 3.78 7.32 0.00 -1.26 -4.99 105.19 114.96 3a2t n GLY 73 Ca -0.12 -1.99 -0.25 0.00 0.00 0.00 0.00 46.02 43.66 3a2t n GLY 73 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3a2t s TRP 74 N -2.81 3.07 -1.51 1.61 0.52 -1.26 -4.66 118.94 113.89 3a2t s TRP 74 Ca 0.00 -0.07 -0.16 0.00 0.02 0.00 0.00 56.10 55.88 3a2t s TRP 74 Cb 0.00 -1.44 0.15 0.00 -1.15 0.00 0.00 33.47 31.03 3a2t s TRP 74 CO 0.00 0.53 0.61 0.41 0.02 0.00 0.00 176.95 178.52 3a2t n GLY 75 N -0.59 -0.45 0.02 0.98 0.00 -1.22 -4.83 105.19 99.11 3a2t n GLY 75 Ca -0.08 0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.16 3a2t n GLY 75 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3a2t n ASN 76 N -2.42 0.53 -4.93 1.61 0.23 -1.11 -4.65 115.26 104.51 3a2t n ASN 76 Ca 0.06 -0.06 -0.23 0.00 -0.53 0.00 0.00 54.58 53.82 3a2t n ASN 76 Cb 0.49 0.17 0.01 0.00 -2.08 0.00 0.00 39.78 38.36 3a2t n ASN 76 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 3a2t s ARG 77 N -3.06 2.36 -0.32 -3.83 0.52 -0.69 -4.93 118.95 109.00 3a2t s ARG 77 Ca 0.10 -1.77 -0.42 0.00 -0.52 0.00 0.00 55.73 53.12 3a2t s ARG 77 Cb 0.16 -2.34 -0.17 0.00 0.52 0.00 0.00 34.95 33.12 3a2t s ARG 77 CO 0.69 -0.56 1.67 0.94 0.02 0.00 0.00 175.30 178.06 3a2t n GLN 78 N -1.84 0.79 -3.77 3.54 7.27 -1.26 -4.40 117.38 117.71 3a2t n GLN 78 Ca 0.05 0.29 -0.13 0.00 0.07 0.00 0.00 57.00 57.27 3a2t n GLN 78 Cb 0.63 -1.91 -0.14 0.00 2.41 0.00 0.00 30.24 31.22 3a2t n GLN 78 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 3a2t s SER 79 N 3.17 -0.10 0.21 1.69 0.01 -0.59 -3.08 113.70 115.02 3a2t s SER 79 Ca 1.00 0.27 -0.18 0.00 1.31 0.00 0.00 55.95 58.35 3a2t s SER 79 Cb -1.20 0.19 0.07 0.00 0.21 0.00 0.00 66.02 65.29 3a2t s SER 79 CO 0.69 -0.12 0.89 2.22 0.41 0.00 0.00 173.24 177.33 3a2t n PHE 80 N 3.91 -1.53 -3.84 2.43 1.16 0.20 -1.55 117.46 118.25 3a2t n PHE 80 Ca -0.23 -1.29 -0.12 0.00 -1.87 0.00 0.00 57.45 53.94 3a2t n PHE 80 Cb 0.53 0.63 -0.11 0.00 -1.61 0.00 0.00 39.48 38.93 3a2t n PHE 80 CO 0.00 0.00 0.00 -1.50 -1.87 0.00 0.00 176.76 173.39 3a2t s ILE 81 N -2.12 0.04 0.00 1.97 2.07 -1.00 0.02 121.20 122.17 3a2t s ILE 81 Ca 0.19 -0.31 -0.01 0.00 -1.41 0.00 0.00 60.65 59.11 3a2t s ILE 81 Cb -0.03 -0.33 0.00 0.00 0.13 0.00 0.00 42.46 42.23 3a2t s ILE 81 CO 0.06 -0.17 0.07 0.61 -1.91 0.00 0.00 174.94 173.60 3a2t n GLY 82 N 2.30 0.79 3.07 1.50 0.00 0.16 -1.51 105.19 111.50 3a2t n GLY 82 Ca -0.17 -0.87 -0.18 0.00 0.00 0.00 0.00 46.02 44.80 3a2t n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3a2t s LEU 83 N 0.00 2.11 0.14 0.99 1.43 -0.23 -0.92 118.68 122.19 3a2t s LEU 83 Ca 0.02 -0.33 0.07 0.00 -1.03 0.00 0.00 54.13 52.86 3a2t s LEU 83 Cb -0.00 -0.47 -0.04 0.00 0.03 0.00 0.00 46.19 45.71 3a2t s LEU 83 CO 0.00 0.04 -0.16 -0.75 0.23 0.00 0.00 176.35 175.71 3a2t s LYS 84 N -0.75 1.13 0.00 1.70 2.20 -0.42 -0.95 119.74 122.64 3a2t s LYS 84 Ca 0.01 -1.31 0.00 0.00 -0.36 0.00 0.00 55.97 54.31 3a2t s LYS 84 Cb -0.06 -1.09 0.00 0.00 -1.51 0.00 0.00 37.83 35.17 3a2t s LYS 84 CO 0.00 0.21 0.00 0.41 -0.36 0.00 0.00 175.35 175.62 3a2t n GLY 85 N 0.43 -0.58 0.26 5.54 0.00 -0.34 -1.08 105.19 109.41 3a2t n GLY 85 Ca -0.14 -0.63 -0.04 0.00 0.00 0.00 0.00 46.02 45.20 3a2t n GLY 85 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3a2t h GLY 86 N 0.00 0.93 1.82 -0.02 0.00 -1.95 -1.98 103.07 101.86 3a2t h GLY 86 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.02 3a2t h GLY 86 CO 0.00 0.26 0.00 1.97 0.00 0.00 0.00 176.54 178.77 3a2t n PHE 87 N -4.70 0.00 0.00 5.60 -1.74 -1.26 -4.80 117.46 110.56 3a2t n PHE 87 Ca 0.06 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.95 3a2t n PHE 87 Cb 0.08 -0.41 0.00 0.00 1.52 0.00 0.00 39.48 40.67 3a2t n PHE 87 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 3a2t n GLY 88 N -1.16 0.40 2.95 4.97 0.00 -0.75 -4.60 105.19 107.02 3a2t n GLY 88 Ca 0.01 -1.72 -0.13 0.00 0.00 0.00 0.00 46.02 44.17 3a2t n GLY 88 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a2t s THR 89 N 0.00 0.28 -0.11 2.61 2.01 0.27 -1.20 115.64 119.51 3a2t s THR 89 Ca 0.00 -0.37 -0.01 0.00 0.31 0.00 0.00 61.69 61.62 3a2t s THR 89 Cb 0.00 -0.28 0.03 0.00 0.01 0.00 0.00 72.50 72.26 3a2t s THR 89 CO 0.00 -0.07 -0.03 0.54 -0.69 0.00 0.00 174.62 174.37 3a2t s VAL 90 N -0.44 0.72 0.10 3.82 0.11 -0.13 -1.40 120.40 123.18 3a2t s VAL 90 Ca -0.03 -0.16 0.06 0.00 -2.93 0.00 0.00 61.98 58.92 3a2t s VAL 90 Cb -0.04 -0.85 -0.03 0.00 -1.53 0.00 0.00 36.38 33.93 3a2t s VAL 90 CO -0.00 0.26 -0.16 -0.13 -3.33 0.00 0.00 175.10 171.74 3a2t s ARG 91 N 1.82 0.97 -0.00 1.54 0.52 -0.49 -1.07 118.95 122.24 3a2t s ARG 91 Ca 0.04 -1.11 0.01 0.00 -0.52 0.00 0.00 55.73 54.16 3a2t s ARG 91 Cb -0.13 -1.01 -0.00 0.00 0.52 0.00 0.00 34.95 34.33 3a2t s ARG 91 CO -0.07 0.22 -0.03 0.00 0.02 0.00 0.00 175.30 175.44 3a2t s ALA 92 N -1.52 0.27 0.00 2.13 0.00 -0.57 -0.17 121.76 121.91 3a2t s ALA 92 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 51.87 3a2t s ALA 92 Cb -0.08 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 22.96 3a2t s ALA 92 CO 0.03 0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.26 3a2t n GLY 93 N 3.04 0.97 3.61 0.00 0.00 -0.58 -2.37 105.19 109.86 3a2t n GLY 93 Ca -0.13 -1.90 -0.43 0.00 0.00 0.00 0.00 46.02 43.56 3a2t n GLY 93 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3a2t s ASN 94 N -4.00 5.96 0.13 1.61 3.04 -0.59 -2.03 114.94 119.06 3a2t s ASN 94 Ca 0.00 1.50 0.10 0.00 0.04 0.00 0.00 52.86 54.50 3a2t s ASN 94 Cb 0.00 -2.53 -0.04 0.00 -1.54 0.00 0.00 41.25 37.15 3a2t s ASN 94 CO 0.00 -1.62 -0.24 -0.76 -3.04 0.00 0.00 177.10 171.44 3a2t s LEU 95 N 6.61 2.33 0.51 3.21 1.43 -1.01 -1.54 118.68 130.22 3a2t s LEU 95 Ca 0.81 -0.75 -0.20 0.00 -1.03 0.00 0.00 54.13 52.96 3a2t s LEU 95 Cb -0.25 -1.07 -0.07 0.00 0.03 0.00 0.00 46.19 44.83 3a2t s LEU 95 CO 0.33 0.12 1.10 0.20 0.23 0.00 0.00 176.35 178.33 3a2t s ASN 96 N -2.10 5.98 0.27 2.29 0.01 -1.26 -1.56 114.94 118.56 3a2t s ASN 96 Ca 0.12 2.11 -0.28 0.00 -0.71 0.00 0.00 52.86 54.10 3a2t s ASN 96 Cb -0.10 -2.58 -0.09 0.00 0.41 0.00 0.00 41.25 38.90 3a2t s ASN 96 CO 0.06 -1.04 0.92 0.28 -1.51 0.00 0.00 177.10 175.81 3a2t s THR 97 N -1.81 4.17 0.38 1.60 -1.32 -0.53 -4.84 115.64 113.29 3a2t s THR 97 Ca 0.70 1.93 0.17 0.00 -1.21 0.00 0.00 61.69 63.28 3a2t s THR 97 Cb -0.22 -4.17 0.38 0.00 -1.51 0.00 0.00 72.50 66.98 3a2t s THR 97 CO 0.25 0.35 1.75 0.58 -2.21 0.00 0.00 174.62 175.34 3a2t h VAL 98 N 2.93 0.50 0.00 5.08 2.07 -1.91 1.64 116.25 126.56 3a2t h VAL 98 Ca -0.46 -0.14 -0.05 0.00 0.82 0.00 0.00 66.70 66.87 3a2t h VAL 98 Cb 1.20 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 3a2t h VAL 98 CO 0.67 0.08 -0.22 -0.07 0.02 0.00 0.00 177.57 178.04 3a2t h LEU 99 N 0.42 0.00 -0.27 2.57 3.38 -1.89 -1.97 115.31 117.55 3a2t h LEU 99 Ca 0.62 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.40 3a2t h LEU 99 Cb 1.50 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.23 3a2t h LEU 99 CO -0.35 0.22 -0.88 0.50 0.09 0.00 0.00 178.44 178.02 3a2t h LYS 100 N 0.00 0.07 -0.03 1.13 3.64 0.21 -3.10 116.57 118.49 3a2t h LYS 100 Ca -0.00 -0.08 -0.11 0.00 -1.27 0.00 0.00 60.65 59.19 3a2t h LYS 100 Cb 0.71 0.03 0.01 0.00 -0.41 0.00 0.00 32.23 32.56 3a2t h LYS 100 CO 0.03 0.90 -0.41 -0.44 -2.27 0.00 0.00 179.45 177.26 3a2t h ASP 101 N 0.04 0.41 0.00 4.20 3.32 -1.02 -2.73 116.42 120.64 3a2t h ASP 101 Ca -0.02 -0.72 0.00 0.00 0.02 0.00 0.00 57.03 56.30 3a2t h ASP 101 Cb 1.53 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.96 3a2t h ASP 101 CO 0.12 1.07 0.13 -1.54 -1.72 0.00 0.00 179.24 177.30 3a2t n SER 102 N -4.37 0.18 0.25 6.45 3.41 -0.76 -0.91 113.62 117.88 3a2t n SER 102 Ca -0.09 0.50 0.17 0.00 -0.26 0.00 0.00 58.87 59.19 3a2t n SER 102 Cb 0.57 -0.51 0.73 0.00 -0.26 0.00 0.00 64.21 64.74 3a2t n SER 102 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3a2t h GLY 103 N 0.00 0.00 1.70 5.00 0.00 -1.40 -3.10 103.07 105.27 3a2t h GLY 103 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3a2t h GLY 103 CO 0.00 0.00 0.08 -0.55 0.00 0.00 0.00 176.54 176.07 3a2t h ASP 104 N 0.00 0.35 0.05 0.19 3.32 -1.21 0.41 116.42 119.52 3a2t h ASP 104 Ca 0.00 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.02 3a2t h ASP 104 Cb 0.37 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.84 3a2t h ASP 104 CO 0.00 0.34 -0.15 0.59 -1.72 0.00 0.00 179.24 178.31 3a2t n ASN 105 N -4.40 1.77 -0.11 6.45 4.13 -1.17 -4.38 115.26 117.55 3a2t n ASN 105 Ca 0.01 -1.44 -0.19 0.00 1.68 0.00 0.00 54.58 54.64 3a2t n ASN 105 Cb 0.15 0.11 -0.09 0.00 -1.54 0.00 0.00 39.78 38.41 3a2t n ASN 105 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 3a2t n VAL 106 N 0.16 1.27 -4.00 2.41 0.31 -0.55 -4.86 118.33 113.08 3a2t n VAL 106 Ca 0.15 -0.42 -0.31 0.00 -0.01 0.00 0.00 64.34 63.74 3a2t n VAL 106 Cb 0.42 -1.49 -0.15 0.00 -0.91 0.00 0.00 33.84 31.71 3a2t n VAL 106 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 3a2t s ASN 107 N -6.52 4.17 -0.05 4.52 3.04 0.02 -4.90 114.94 115.22 3a2t s ASN 107 Ca -0.31 -1.33 0.14 0.00 0.04 0.00 0.00 52.86 51.40 3a2t s ASN 107 Cb 0.10 -1.37 0.45 0.00 -1.54 0.00 0.00 41.25 38.89 3a2t s ASN 107 CO 0.47 -0.22 1.37 0.00 -3.04 0.00 0.00 177.10 175.68 3a2t n ALA 108 N 4.54 2.48 -2.70 1.71 0.00 -1.26 -4.68 120.51 120.60 3a2t n ALA 108 Ca -0.12 -1.45 -0.27 0.00 0.00 0.00 0.00 53.44 51.61 3a2t n ALA 108 Cb 0.43 -0.62 -0.03 0.00 0.00 0.00 0.00 19.45 19.23 3a2t n ALA 108 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3a2t s TRP 109 N -1.46 3.48 0.01 0.00 0.52 -1.26 -5.10 118.94 115.12 3a2t s TRP 109 Ca 0.34 0.39 0.06 0.00 0.02 0.00 0.00 56.10 56.91 3a2t s TRP 109 Cb 0.21 -1.90 -0.03 0.00 -1.15 0.00 0.00 33.47 30.60 3a2t s TRP 109 CO 0.18 0.30 -0.19 -1.21 0.02 0.00 0.00 176.95 176.04 3a2t s GLU 110 N -3.56 2.18 0.04 4.98 8.01 -1.26 -4.96 118.70 124.13 3a2t s GLU 110 Ca 0.40 -0.90 -0.28 0.00 0.01 0.00 0.00 54.97 54.19 3a2t s GLU 110 Cb -0.11 -2.20 0.10 0.00 -4.31 0.00 0.00 34.13 27.61 3a2t s GLU 110 CO 0.30 0.57 1.20 -1.54 0.01 0.00 0.00 175.26 175.80 3a2t s SER 111 N -1.09 -0.07 0.77 -0.19 1.04 -1.26 -4.89 113.70 108.00 3a2t s SER 111 Ca 0.13 -0.25 -0.09 0.00 0.48 0.00 0.00 55.95 56.22 3a2t s SER 111 Cb -0.10 0.26 0.09 0.00 0.10 0.00 0.00 66.02 66.36 3a2t s SER 111 CO 0.03 -0.48 1.10 -0.83 0.98 0.00 0.00 173.24 174.04 3a2t s GLY 112 N -3.11 1.68 0.10 7.32 0.00 -1.26 -4.35 107.32 107.70 3a2t s GLY 112 Ca 0.16 -0.94 -0.21 0.00 0.00 0.00 0.00 44.72 43.72 3a2t s GLY 112 CO -0.01 -0.45 1.75 1.48 0.00 0.00 0.00 173.10 175.86 3a2t h SER 113 N -0.86 0.12 0.00 1.64 4.64 -1.95 -2.91 113.55 114.23 3a2t h SER 113 Ca -0.44 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3a2t h SER 113 Cb 1.31 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3a2t h SER 113 CO 0.57 0.10 0.22 -1.13 -0.87 0.00 0.00 176.83 175.72 3a2t h ASN 114 N 0.13 0.00 -0.01 4.97 -1.24 -1.96 -2.06 115.58 115.41 3a2t h ASN 114 Ca 0.04 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.05 3a2t h ASN 114 Cb -0.01 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.04 3a2t h ASN 114 CO -0.01 0.00 -0.11 0.35 -1.29 0.00 0.00 177.43 176.37 3a2t n THR 115 N -2.88 1.98 0.36 -3.57 -2.24 -1.11 -4.76 114.28 102.06 3a2t n THR 115 Ca -0.02 -2.47 0.07 0.00 -2.27 0.00 0.00 64.05 59.36 3a2t n THR 115 Cb 0.27 -0.24 0.32 0.00 -2.10 0.00 0.00 70.33 68.58 3a2t n THR 115 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3a2t n GLU 116 N -1.34 0.06 -0.00 -0.78 1.02 -0.78 -0.80 120.64 118.02 3a2t n GLU 116 Ca 0.17 0.36 0.07 0.00 -0.02 0.00 0.00 57.16 57.75 3a2t n GLU 116 Cb 0.66 -1.62 -0.09 0.00 -0.02 0.00 0.00 31.44 30.37 3a2t n GLU 116 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3a2t n ASP 117 N -1.73 0.97 -0.01 1.62 8.00 -1.26 -2.23 116.55 121.91 3a2t n ASP 117 Ca 0.02 -0.57 0.00 0.00 0.71 0.00 0.00 54.79 54.95 3a2t n ASP 117 Cb 0.14 1.22 -0.04 0.00 -0.02 0.00 0.00 41.12 42.42 3a2t n ASP 117 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 3a2t n VAL 118 N -1.56 0.17 -0.32 2.53 3.14 -1.13 -4.44 118.33 116.71 3a2t n VAL 118 Ca 0.01 -0.16 0.07 0.00 -2.96 0.00 0.00 64.34 61.30 3a2t n VAL 118 Cb 0.28 -0.24 0.20 0.00 -1.06 0.00 0.00 33.84 33.02 3a2t n VAL 118 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 3a2t n LEU 119 N -1.93 3.31 -3.49 6.55 4.77 0.02 -3.93 117.00 122.29 3a2t n LEU 119 Ca -0.04 -2.13 -0.11 0.00 -0.03 0.00 0.00 56.01 53.69 3a2t n LEU 119 Cb 0.40 -0.33 -0.03 0.00 -2.33 0.00 0.00 43.42 41.13 3a2t n LEU 119 CO 0.11 0.77 0.59 -0.83 -1.33 0.00 0.00 177.39 176.69 3a2t s GLY 120 N -1.09 -0.50 -1.05 -0.72 0.00 -1.25 -4.48 107.32 98.23 3a2t s GLY 120 Ca 0.31 1.04 -0.22 0.00 0.00 0.00 0.00 44.72 45.85 3a2t s GLY 120 CO 0.18 0.46 1.57 1.08 0.00 0.00 0.00 173.10 176.39 3a2t s LEU 121 N -2.20 3.50 -0.15 0.66 1.43 -1.26 -4.13 118.68 116.53 3a2t s LEU 121 Ca 0.01 -1.52 0.09 0.00 -1.03 0.00 0.00 54.13 51.68 3a2t s LEU 121 Cb -0.01 -2.57 -0.23 0.00 0.03 0.00 0.00 46.19 43.41 3a2t s LEU 121 CO -0.06 -1.65 0.26 0.61 0.23 0.00 0.00 176.35 175.74 3a2t n GLY 122 N 6.62 -0.80 0.21 -3.19 0.00 -0.95 -4.05 105.19 103.04 3a2t n GLY 122 Ca 0.37 -0.20 -0.09 0.00 0.00 0.00 0.00 46.02 46.09 3a2t n GLY 122 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3a2t h THR 123 N 0.01 1.22 0.00 2.61 2.02 -1.82 -1.92 112.91 115.03 3a2t h THR 123 Ca -0.45 -0.74 0.00 0.00 0.77 0.00 0.00 66.41 65.99 3a2t h THR 123 Cb 2.07 0.91 0.00 0.00 -1.74 0.00 0.00 68.15 69.39 3a2t h THR 123 CO 0.04 0.26 0.00 0.00 0.37 0.00 0.00 175.52 176.19 3a2t n ILE 124 N -4.57 0.84 -0.97 3.11 3.06 -1.26 -2.21 119.36 117.36 3a2t n ILE 124 Ca 0.00 0.21 0.03 0.00 -2.50 0.00 0.00 62.75 60.49 3a2t n ILE 124 Cb 0.19 -1.11 0.36 0.00 0.54 0.00 0.00 39.64 39.62 3a2t n ILE 124 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3a2t n GLY 125 N 0.06 3.33 0.00 4.50 0.00 -0.74 -4.36 105.19 107.98 3a2t n GLY 125 Ca 0.03 -0.97 0.14 0.00 0.00 0.00 0.00 46.02 45.22 3a2t n GLY 125 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3a2t n ARG 126 N 0.25 0.11 0.02 1.61 1.85 -0.94 -3.16 116.66 116.41 3a2t n ARG 126 Ca 0.31 0.01 0.11 0.00 -1.00 0.00 0.00 57.85 57.29 3a2t n ARG 126 Cb 1.22 -1.50 0.03 0.00 -1.05 0.00 0.00 32.46 31.17 3a2t n ARG 126 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 3a2t n VAL 127 N -1.44 0.10 -2.88 8.89 0.24 -1.26 -4.43 118.33 117.56 3a2t n VAL 127 Ca 0.09 -0.16 -0.35 0.00 -2.04 0.00 0.00 64.34 61.88 3a2t n VAL 127 Cb 0.30 0.35 -0.07 0.00 -1.47 0.00 0.00 33.84 32.96 3a2t n VAL 127 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 3a2t s GLU 128 N -3.13 4.36 0.03 7.34 2.02 -1.19 -4.88 118.70 123.25 3a2t s GLU 128 Ca 0.06 1.13 -0.14 0.00 0.02 0.00 0.00 54.97 56.03 3a2t s GLU 128 Cb 0.15 -2.58 0.05 0.00 0.10 0.00 0.00 34.13 31.85 3a2t s GLU 128 CO 0.80 0.19 0.65 -1.13 0.02 0.00 0.00 175.26 175.78 3a2t n SER 129 N 0.12 -0.75 -4.21 -0.19 3.41 -1.26 -4.99 113.62 105.76 3a2t n SER 129 Ca 0.03 -1.25 -0.28 0.00 -0.26 0.00 0.00 58.87 57.10 3a2t n SER 129 Cb 0.52 1.18 -0.16 0.00 -0.26 0.00 0.00 64.21 65.49 3a2t n SER 129 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3a2t s ARG 130 N -2.01 1.98 0.01 4.33 0.52 -1.26 -1.45 118.95 121.07 3a2t s ARG 130 Ca 0.15 -0.75 0.03 0.00 -0.52 0.00 0.00 55.73 54.64 3a2t s ARG 130 Cb -0.01 -1.77 -0.01 0.00 0.52 0.00 0.00 34.95 33.68 3a2t s ARG 130 CO 0.01 0.36 -0.09 -1.21 0.02 0.00 0.00 175.30 174.39 3a2t s GLU 131 N -0.21 0.63 -0.09 3.54 0.41 -0.60 -4.90 118.70 117.48 3a2t s GLU 131 Ca 0.00 -0.46 -0.29 0.00 -0.41 0.00 0.00 54.97 53.81 3a2t s GLU 131 Cb -0.11 -0.57 -0.05 0.00 -1.78 0.00 0.00 34.13 31.62 3a2t s GLU 131 CO 0.02 0.14 1.67 0.42 -0.49 0.00 0.00 175.26 177.02 3a2t s ILE 132 N -0.57 3.58 0.18 -1.63 -1.09 -1.26 -2.42 121.20 118.00 3a2t s ILE 132 Ca -0.00 0.69 -0.21 0.00 -2.23 0.00 0.00 60.65 58.90 3a2t s ILE 132 Cb -0.05 -3.48 0.07 0.00 -1.58 0.00 0.00 42.46 37.42 3a2t s ILE 132 CO 0.00 -0.10 1.02 -1.54 -1.23 0.00 0.00 174.94 173.08 3a2t n SER 133 N 7.53 -1.71 -4.69 3.58 3.41 -0.86 -4.57 113.62 116.31 3a2t n SER 133 Ca 0.18 -1.89 -0.28 0.00 -0.26 0.00 0.00 58.87 56.62 3a2t n SER 133 Cb 0.43 2.77 -0.08 0.00 -0.26 0.00 0.00 64.21 67.08 3a2t n SER 133 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3a2t s VAL 134 N -2.07 3.93 -0.22 -3.33 -7.23 -0.82 -1.52 120.40 109.14 3a2t s VAL 134 Ca 0.23 -1.20 -0.15 0.00 -1.81 0.00 0.00 61.98 59.04 3a2t s VAL 134 Cb -0.03 -2.94 0.06 0.00 0.56 0.00 0.00 36.38 34.04 3a2t s VAL 134 CO 0.05 -0.01 0.55 -0.60 -0.31 0.00 0.00 175.10 174.78 3a2t s ARG 135 N -2.70 0.59 -0.05 4.82 3.52 0.77 -1.76 118.95 124.13 3a2t s ARG 135 Ca 0.27 0.90 0.01 0.00 -0.13 0.00 0.00 55.73 56.78 3a2t s ARG 135 Cb -0.10 0.16 -0.03 0.00 -1.56 0.00 0.00 34.95 33.42 3a2t s ARG 135 CO 0.19 -0.12 -0.07 -0.47 -0.81 0.00 0.00 175.30 174.02 3a2t s TYR 136 N 1.00 2.92 -0.15 5.12 5.04 0.18 -1.40 117.35 130.06 3a2t s TYR 136 Ca -0.06 0.01 -0.02 0.00 -2.44 0.00 0.00 57.07 54.56 3a2t s TYR 136 Cb -0.06 -1.69 0.05 0.00 0.35 0.00 0.00 41.96 40.61 3a2t s TYR 136 CO -0.09 0.34 0.01 -0.51 -1.34 0.00 0.00 175.55 173.96 3a2t s ASP 137 N -0.94 2.41 0.31 4.32 1.11 -0.50 -0.53 116.67 122.86 3a2t s ASP 137 Ca 0.13 -0.53 -0.17 0.00 0.18 0.00 0.00 52.55 52.16 3a2t s ASP 137 Cb -0.11 -0.58 -0.09 0.00 1.07 0.00 0.00 42.92 43.21 3a2t s ASP 137 CO 0.03 -0.25 0.75 -0.94 1.18 0.00 0.00 175.17 175.94 3a2t s SER 138 N 1.87 6.86 1.13 0.27 1.04 0.43 -0.56 113.70 124.75 3a2t s SER 138 Ca 0.01 1.35 -0.17 0.00 0.48 0.00 0.00 55.95 57.63 3a2t s SER 138 Cb -0.15 -2.40 0.21 0.00 0.10 0.00 0.00 66.02 63.78 3a2t s SER 138 CO -0.07 -0.16 0.39 -2.65 0.98 0.00 0.00 173.24 171.74 3a2t n PRO 139 N -0.11 -2.68 -3.21 4.02 -0.02 -1.26 -3.54 135.00 128.20 3a2t n PRO 139 Ca 0.02 -0.79 -0.45 0.00 -2.02 0.00 0.00 63.50 60.27 3a2t n PRO 139 Cb 0.53 -1.62 -0.06 0.00 -0.02 0.00 0.00 33.50 32.33 3a2t n PRO 139 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3a2t s VAL 140 N -2.12 4.98 -0.37 -1.45 1.01 -1.26 -4.25 120.40 116.93 3a2t s VAL 140 Ca 0.47 -0.97 -0.09 0.00 0.00 0.00 0.00 61.98 61.39 3a2t s VAL 140 Cb -0.09 -4.35 0.04 0.00 0.00 0.00 0.00 36.38 31.98 3a2t s VAL 140 CO 0.45 -0.90 0.19 0.12 0.00 0.00 0.00 175.10 174.96 3a2t s PHE 141 N 2.30 3.27 -1.30 5.22 5.36 0.55 -4.57 117.98 128.80 3a2t s PHE 141 Ca 0.10 -1.25 -0.02 0.00 -0.96 0.00 0.00 56.93 54.79 3a2t s PHE 141 Cb -0.24 -2.52 0.00 0.00 -0.34 0.00 0.00 43.02 39.93 3a2t s PHE 141 CO 0.07 -0.72 0.32 0.00 -1.46 0.00 0.00 175.22 173.43 3a2t n ALA 142 N 4.92 -0.67 0.00 11.12 0.00 -1.26 -1.67 120.51 132.94 3a2t n ALA 142 Ca -0.11 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.52 3a2t n ALA 142 Cb 0.45 -2.75 0.00 0.00 0.00 0.00 0.00 19.45 17.15 3a2t n ALA 142 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2t n GLY 143 N -1.25 2.52 3.83 0.00 0.00 -1.26 -4.89 105.19 104.14 3a2t n GLY 143 Ca -0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.51 3a2t n GLY 143 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3a2t s PHE 144 N -2.45 3.75 -0.14 1.61 0.08 -0.67 -0.72 117.98 119.45 3a2t s PHE 144 Ca 0.00 1.08 -0.15 0.00 0.12 0.00 0.00 56.93 57.98 3a2t s PHE 144 Cb 0.00 -2.35 0.04 0.00 -0.57 0.00 0.00 43.02 40.14 3a2t s PHE 144 CO 0.00 0.63 0.41 -1.54 -0.10 0.00 0.00 175.22 174.62 3a2t s SER 145 N -1.09 -0.41 0.16 1.36 1.04 0.10 0.21 113.70 115.07 3a2t s SER 145 Ca 0.25 0.75 0.02 0.00 0.48 0.00 0.00 55.95 57.45 3a2t s SER 145 Cb -0.18 0.78 -0.05 0.00 0.10 0.00 0.00 66.02 66.68 3a2t s SER 145 CO 0.15 -0.19 -0.02 -0.83 0.98 0.00 0.00 173.24 173.34 3a2t s GLY 146 N 0.02 1.17 -0.07 7.32 0.00 -1.23 -0.13 107.32 114.39 3a2t s GLY 146 Ca -0.02 -1.56 -0.03 0.00 0.00 0.00 0.00 44.72 43.11 3a2t s GLY 146 CO 0.01 -1.53 0.17 -0.56 0.00 0.00 0.00 173.10 171.19 3a2t s SER 147 N -3.16 -0.14 -0.08 1.64 0.01 0.08 -0.42 113.70 111.62 3a2t s SER 147 Ca 0.22 0.34 0.03 0.00 1.31 0.00 0.00 55.95 57.85 3a2t s SER 147 Cb 0.06 0.23 0.01 0.00 0.21 0.00 0.00 66.02 66.53 3a2t s SER 147 CO 0.03 -0.15 -0.16 0.54 0.41 0.00 0.00 173.24 173.90 3a2t s VAL 148 N 1.20 1.46 -0.00 3.43 0.11 0.31 -0.66 120.40 126.25 3a2t s VAL 148 Ca -0.09 -0.66 -0.00 0.00 -2.93 0.00 0.00 61.98 58.29 3a2t s VAL 148 Cb -0.11 -1.31 -0.00 0.00 -1.53 0.00 0.00 36.38 33.43 3a2t s VAL 148 CO -0.06 0.43 0.00 -1.58 -3.33 0.00 0.00 175.10 170.56 3a2t s GLN 149 N 0.62 0.02 -0.01 1.54 0.74 0.49 0.49 119.66 123.55 3a2t s GLN 149 Ca -0.15 -0.02 0.02 0.00 0.05 0.00 0.00 55.36 55.27 3a2t s GLN 149 Cb -0.16 0.01 -0.00 0.00 1.10 0.00 0.00 33.01 33.95 3a2t s GLN 149 CO 0.04 -0.00 -0.08 -0.47 -0.55 0.00 0.00 175.29 174.23 3a2t s TYR 150 N -0.05 0.74 -0.34 1.67 6.14 -0.72 0.12 117.35 124.91 3a2t s TYR 150 Ca -0.01 -0.15 -0.03 0.00 0.64 0.00 0.00 57.07 57.53 3a2t s TYR 150 Cb -0.00 -0.49 0.07 0.00 0.42 0.00 0.00 41.96 41.95 3a2t s TYR 150 CO -0.00 -0.02 0.07 0.08 0.64 0.00 0.00 175.55 176.32 3a2t s VAL 151 N -0.12 3.17 0.84 3.14 1.01 -0.59 -1.95 120.40 125.90 3a2t s VAL 151 Ca 0.02 -1.56 -0.16 0.00 0.00 0.00 0.00 61.98 60.28 3a2t s VAL 151 Cb -0.04 -2.93 -0.08 0.00 0.00 0.00 0.00 36.38 33.33 3a2t s VAL 151 CO -0.00 -0.30 -0.09 -2.65 0.00 0.00 0.00 175.10 172.06 3a2t n PRO 152 N 4.63 0.01 0.13 2.72 -0.02 -1.26 -2.49 135.00 138.71 3a2t n PRO 152 Ca -0.10 0.02 -0.02 0.00 -2.02 0.00 0.00 63.50 61.39 3a2t n PRO 152 Cb 0.43 -1.40 0.21 0.00 -0.02 0.00 0.00 33.50 32.72 3a2t n PRO 152 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3a2t h ARG 153 N -0.82 0.10 -0.05 -0.52 2.43 -1.93 -2.04 114.38 111.55 3a2t h ARG 153 Ca -0.44 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 3a2t h ARG 153 Cb 1.33 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.89 3a2t h ARG 153 CO 0.33 0.60 0.00 -0.25 -1.51 0.00 0.00 179.97 179.15 3a2t n ASP 154 N -3.93 1.69 -0.06 -3.80 8.00 -1.26 -2.94 116.55 114.26 3a2t n ASP 154 Ca -0.02 -1.59 -0.04 0.00 0.71 0.00 0.00 54.79 53.85 3a2t n ASP 154 Cb 0.54 -0.02 -0.13 0.00 -0.02 0.00 0.00 41.12 41.49 3a2t n ASP 154 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3a2t n ASN 155 N 0.32 0.96 0.04 -2.24 3.02 -1.05 -3.87 115.26 112.46 3a2t n ASN 155 Ca 0.18 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.86 3a2t n ASN 155 Cb 0.38 1.10 0.33 0.00 -0.61 0.00 0.00 39.78 40.98 3a2t n ASN 155 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3a2t n ALA 156 N -2.50 2.83 -3.16 5.41 0.00 -0.79 -4.63 120.51 117.68 3a2t n ALA 156 Ca -0.21 -0.20 0.04 0.00 0.00 0.00 0.00 53.44 53.06 3a2t n ALA 156 Cb 0.91 -1.28 -0.01 0.00 0.00 0.00 0.00 19.45 19.07 3a2t n ALA 156 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3a2t s ASN 157 N -3.72 -1.38 -0.11 0.00 3.84 -1.15 -4.61 114.94 107.82 3a2t s ASN 157 Ca 0.10 0.74 -0.10 0.00 0.21 0.00 0.00 52.86 53.81 3a2t s ASN 157 Cb 0.15 2.11 -0.27 0.00 -0.55 0.00 0.00 41.25 42.70 3a2t s ASN 157 CO 0.65 -0.27 0.45 -0.78 -2.79 0.00 0.00 177.10 174.37 3a2t h ASP 158 N 8.01 0.44 -1.01 -4.21 1.82 -1.82 -3.36 116.42 116.28 3a2t h ASP 158 Ca -0.19 -0.91 0.24 0.00 -0.39 0.00 0.00 57.03 55.77 3a2t h ASP 158 Cb 1.16 -0.14 -0.11 0.00 0.68 0.00 0.00 39.33 40.92 3a2t h ASP 158 CO 0.24 1.80 0.62 0.58 -1.61 0.00 0.00 179.24 180.87 3a2t h VAL 159 N -0.03 0.58 -0.24 2.25 2.07 -1.97 -0.66 116.25 118.25 3a2t h VAL 159 Ca -0.39 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 66.94 3a2t h VAL 159 Cb 1.98 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 3a2t h VAL 159 CO 0.09 0.10 0.00 -0.67 0.02 0.00 0.00 177.57 177.11 3a2t n ASP 160 N -4.77 1.64 -0.23 0.57 2.03 -1.26 -4.61 116.55 109.91 3a2t n ASP 160 Ca 0.25 -2.07 -0.02 0.00 0.52 0.00 0.00 54.79 53.47 3a2t n ASP 160 Cb 0.74 -0.26 0.04 0.00 -0.72 0.00 0.00 41.12 40.92 3a2t n ASP 160 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 3a2t h LYS 161 N 1.44 -0.09 0.00 -0.67 1.57 -1.29 -3.21 116.57 114.32 3a2t h LYS 161 Ca 0.00 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3a2t h LYS 161 Cb 0.49 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.82 3a2t h LYS 161 CO 0.04 -0.06 -1.75 0.66 -0.57 0.00 0.00 179.45 177.77 3a2t n TYR 162 N -5.46 0.00 -3.93 -1.35 4.01 -1.26 -4.71 117.16 104.46 3a2t n TYR 162 Ca 0.07 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.51 3a2t n TYR 162 Cb 0.36 -0.38 -0.14 0.00 -0.31 0.00 0.00 39.34 38.87 3a2t n TYR 162 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 3a2t s LYS 163 N -3.35 1.89 -0.88 -0.72 1.02 -1.21 -5.03 119.74 111.45 3a2t s LYS 163 Ca -0.04 -2.53 -0.25 0.00 0.02 0.00 0.00 55.97 53.17 3a2t s LYS 163 Cb 0.14 -3.23 0.00 0.00 -0.52 0.00 0.00 37.83 34.22 3a2t s LYS 163 CO 0.87 -1.10 1.65 -1.01 -0.92 0.00 0.00 175.35 174.84 3a2t s HIS 164 N -0.17 2.12 -0.03 3.18 3.76 -1.24 -4.52 115.29 118.39 3a2t s HIS 164 Ca 0.17 0.03 0.01 0.00 -0.15 0.00 0.00 55.06 55.11 3a2t s HIS 164 Cb -0.25 -4.37 -0.01 0.00 1.11 0.00 0.00 32.58 29.05 3a2t s HIS 164 CO -0.01 -1.95 0.03 0.25 -0.85 0.00 0.00 174.74 172.22 3a2t n THR 165 N 7.20 0.00 -4.33 1.30 -2.24 -1.26 -4.98 114.28 109.96 3a2t n THR 165 Ca 0.29 -0.27 -0.35 0.00 -2.27 0.00 0.00 64.05 61.45 3a2t n THR 165 Cb 0.49 0.76 -0.09 0.00 -2.10 0.00 0.00 70.33 69.39 3a2t n THR 165 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3a2t s LYS 166 N -1.54 3.03 0.34 -0.78 -0.14 -1.26 -5.07 119.74 114.31 3a2t s LYS 166 Ca 0.00 -0.39 -0.29 0.00 -1.36 0.00 0.00 55.97 53.94 3a2t s LYS 166 Cb 0.01 -2.83 -0.12 0.00 -1.68 0.00 0.00 37.83 33.22 3a2t s LYS 166 CO 0.04 0.70 1.50 0.43 -0.76 0.00 0.00 175.35 177.26 3a2t n SER 167 N 2.14 3.65 -4.65 2.83 7.64 -1.26 -4.87 113.62 119.10 3a2t n SER 167 Ca -0.19 1.19 -0.46 0.00 1.01 0.00 0.00 58.87 60.43 3a2t n SER 167 Cb 0.54 -1.59 -0.03 0.00 -1.01 0.00 0.00 64.21 62.12 3a2t n SER 167 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3a2t n SER 168 N 1.14 2.41 -1.39 6.43 2.88 -1.26 -4.88 113.62 118.95 3a2t n SER 168 Ca 0.05 1.14 0.08 0.00 -1.33 0.00 0.00 58.87 58.80 3a2t n SER 168 Cb 0.37 -1.37 0.33 0.00 -0.75 0.00 0.00 64.21 62.80 3a2t n SER 168 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3a2t n ARG 169 N 2.09 3.91 -2.06 -1.46 3.00 -1.26 -3.69 116.66 117.20 3a2t n ARG 169 Ca 0.13 -3.00 -0.38 0.00 -0.01 0.00 0.00 57.85 54.59 3a2t n ARG 169 Cb 0.29 -2.05 0.01 0.00 0.00 0.00 0.00 32.46 30.71 3a2t n ARG 169 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.63 175.80 3a2t s GLU 170 N -2.77 3.52 0.03 5.56 -1.05 -1.26 -4.85 118.70 117.89 3a2t s GLU 170 Ca 0.48 1.98 -0.04 0.00 -0.15 0.00 0.00 54.97 57.25 3a2t s GLU 170 Cb 0.38 -2.37 -0.02 0.00 -0.44 0.00 0.00 34.13 31.69 3a2t s GLU 170 CO 0.13 -0.80 0.05 -1.54 0.95 0.00 0.00 175.26 174.04 3a2t s SER 171 N -1.16 0.21 -0.00 0.83 1.04 -1.04 -4.22 113.70 109.36 3a2t s SER 171 Ca 0.66 -0.53 0.05 0.00 0.48 0.00 0.00 55.95 56.62 3a2t s SER 171 Cb -0.34 0.18 -0.03 0.00 0.10 0.00 0.00 66.02 65.93 3a2t s SER 171 CO 0.41 -0.43 -0.15 -0.31 0.98 0.00 0.00 173.24 173.73 3a2t s TYR 172 N -2.23 2.66 -0.03 5.02 1.51 -0.37 -1.54 117.35 122.38 3a2t s TYR 172 Ca -0.08 -0.19 0.02 0.00 -1.01 0.00 0.00 57.07 55.81 3a2t s TYR 172 Cb -0.04 -1.56 0.00 0.00 -0.11 0.00 0.00 41.96 40.26 3a2t s TYR 172 CO -0.03 0.23 -0.09 -1.01 -1.11 0.00 0.00 175.55 173.54 3a2t s HIS 173 N -0.85 0.96 0.05 2.71 3.76 0.33 -0.96 115.29 121.29 3a2t s HIS 173 Ca 0.14 -0.24 -0.12 0.00 -0.15 0.00 0.00 55.06 54.69 3a2t s HIS 173 Cb -0.11 -0.68 0.01 0.00 1.11 0.00 0.00 32.58 32.91 3a2t s HIS 173 CO 0.03 -0.10 0.26 0.00 -0.85 0.00 0.00 174.74 174.08 3a2t s ALA 174 N 0.21 -0.54 -0.03 -1.40 0.00 -0.64 0.19 121.76 119.54 3a2t s ALA 174 Ca -0.03 -0.15 -0.27 0.00 0.00 0.00 0.00 51.96 51.51 3a2t s ALA 174 Cb -0.09 0.33 0.06 0.00 0.00 0.00 0.00 23.12 23.42 3a2t s ALA 174 CO 0.01 -0.41 0.59 0.20 0.00 0.00 0.00 175.76 176.15 3a2t s GLY 175 N -2.15 -0.48 0.02 0.00 0.00 0.16 -0.92 107.32 103.94 3a2t s GLY 175 Ca -0.04 1.05 0.05 0.00 0.00 0.00 0.00 44.72 45.78 3a2t s GLY 175 CO -0.04 0.73 -0.16 -2.27 0.00 0.00 0.00 173.10 171.35 3a2t s LEU 176 N -1.31 2.12 -0.02 0.66 2.96 0.87 -0.74 118.68 123.22 3a2t s LEU 176 Ca -0.11 -0.40 0.00 0.00 -0.22 0.00 0.00 54.13 53.40 3a2t s LEU 176 Cb -0.01 -0.75 0.03 0.00 0.50 0.00 0.00 46.19 45.96 3a2t s LEU 176 CO 0.08 0.12 0.02 -0.75 -1.32 0.00 0.00 176.35 174.49 3a2t s LYS 177 N -0.84 0.10 -0.08 1.98 2.20 0.82 -1.22 119.74 122.70 3a2t s LYS 177 Ca 0.04 0.13 0.04 0.00 -0.36 0.00 0.00 55.97 55.82 3a2t s LYS 177 Cb -0.07 -0.32 0.00 0.00 -1.51 0.00 0.00 37.83 35.93 3a2t s LYS 177 CO 0.01 -0.14 -0.20 -0.47 -0.36 0.00 0.00 175.35 174.19 3a2t s TYR 178 N 0.97 2.13 -0.02 4.03 5.04 -0.41 -0.72 117.35 128.36 3a2t s TYR 178 Ca -0.09 -0.79 0.02 0.00 -2.44 0.00 0.00 57.07 53.77 3a2t s TYR 178 Cb -0.12 -1.45 0.00 0.00 0.35 0.00 0.00 41.96 40.75 3a2t s TYR 178 CO -0.02 -0.32 -0.08 -2.00 -1.34 0.00 0.00 175.55 171.79 3a2t s GLU 179 N 0.32 0.85 -0.27 4.97 2.12 0.11 -1.83 118.70 124.97 3a2t s GLU 179 Ca -0.14 -0.26 -0.09 0.00 0.36 0.00 0.00 54.97 54.85 3a2t s GLU 179 Cb -0.16 -0.81 0.12 0.00 0.26 0.00 0.00 34.13 33.54 3a2t s GLU 179 CO 0.06 0.09 0.57 1.21 -0.54 0.00 0.00 175.26 176.65 3a2t s ASN 180 N 0.24 -0.86 -1.71 -1.70 3.84 0.12 -4.43 114.94 110.45 3a2t s ASN 180 Ca -0.03 1.38 -0.14 0.00 0.21 0.00 0.00 52.86 54.28 3a2t s ASN 180 Cb -0.08 1.99 0.13 0.00 -0.55 0.00 0.00 41.25 42.74 3a2t s ASN 180 CO 0.00 -0.22 0.45 0.00 -2.79 0.00 0.00 177.10 174.54 3a2t n ALA 181 N 5.43 -1.53 -0.34 1.71 0.00 -1.26 0.12 120.51 124.63 3a2t n ALA 181 Ca -0.11 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.10 3a2t n ALA 181 Cb 0.49 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.81 3a2t n ALA 181 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2t n GLY 182 N -1.66 1.00 3.65 0.00 0.00 -1.26 -4.99 105.19 101.93 3a2t n GLY 182 Ca -0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 3a2t n GLY 182 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3a2t s PHE 183 N -2.85 3.23 -0.15 1.61 0.40 0.12 -0.44 117.98 119.89 3a2t s PHE 183 Ca 0.00 0.09 -0.12 0.00 -0.60 0.00 0.00 56.93 56.30 3a2t s PHE 183 Cb 0.00 -1.98 0.05 0.00 0.51 0.00 0.00 43.02 41.60 3a2t s PHE 183 CO 0.00 0.25 0.39 0.12 0.70 0.00 0.00 175.22 176.69 3a2t s PHE 184 N -0.06 -0.49 0.00 0.36 5.36 0.29 0.13 117.98 123.58 3a2t s PHE 184 Ca 0.05 1.12 0.02 0.00 -0.96 0.00 0.00 56.93 57.17 3a2t s PHE 184 Cb -0.12 0.19 -0.01 0.00 -0.34 0.00 0.00 43.02 42.74 3a2t s PHE 184 CO 0.01 -0.26 -0.06 0.20 -1.46 0.00 0.00 175.22 173.66 3a2t s GLY 185 N 0.69 0.29 -0.03 13.12 0.00 -0.76 0.38 107.32 121.01 3a2t s GLY 185 Ca -0.04 -0.29 -0.15 0.00 0.00 0.00 0.00 44.72 44.24 3a2t s GLY 185 CO -0.05 -0.26 0.33 -0.86 0.00 0.00 0.00 173.10 172.27 3a2t s GLN 186 N -0.27 0.65 -0.05 2.90 -2.07 0.22 -1.29 119.66 119.75 3a2t s GLN 186 Ca 0.01 -0.07 0.03 0.00 -1.82 0.00 0.00 55.36 53.51 3a2t s GLN 186 Cb -0.03 0.29 -0.03 0.00 -1.09 0.00 0.00 33.01 32.16 3a2t s GLN 186 CO -0.00 -0.17 -0.13 -0.47 -1.32 0.00 0.00 175.29 173.20 3a2t s TYR 187 N -1.10 2.75 -0.10 9.60 5.04 -0.36 0.17 117.35 133.35 3a2t s TYR 187 Ca -0.11 -0.13 -0.11 0.00 -2.44 0.00 0.00 57.07 54.27 3a2t s TYR 187 Cb -0.05 -1.65 0.03 0.00 0.35 0.00 0.00 41.96 40.65 3a2t s TYR 187 CO 0.04 0.21 0.31 0.00 -1.34 0.00 0.00 175.55 174.77 3a2t s ALA 188 N -0.73 -0.76 0.17 3.97 0.00 0.75 -0.09 121.76 125.06 3a2t s ALA 188 Ca 0.11 0.80 -0.23 0.00 0.00 0.00 0.00 51.96 52.65 3a2t s ALA 188 Cb -0.11 -0.44 0.08 0.00 0.00 0.00 0.00 23.12 22.65 3a2t s ALA 188 CO 0.01 -0.16 1.05 0.20 0.00 0.00 0.00 175.76 176.86 3a2t s GLY 189 N -0.02 0.05 -0.01 0.00 0.00 -0.10 -0.24 107.32 107.01 3a2t s GLY 189 Ca -0.02 -0.24 -0.20 0.00 0.00 0.00 0.00 44.72 44.26 3a2t s GLY 189 CO 0.01 2.29 0.43 -1.35 0.00 0.00 0.00 173.10 174.47 3a2t s SER 190 N -3.37 -0.33 0.00 1.64 1.04 -0.40 -1.62 113.70 110.66 3a2t s SER 190 Ca 0.21 0.24 0.02 0.00 0.48 0.00 0.00 55.95 56.90 3a2t s SER 190 Cb -0.02 0.39 -0.01 0.00 0.10 0.00 0.00 66.02 66.48 3a2t s SER 190 CO 0.04 -0.53 -0.07 0.12 0.98 0.00 0.00 173.24 173.79 3a2t s PHE 191 N -1.48 0.60 -0.08 5.02 5.36 -0.13 -0.42 117.98 126.84 3a2t s PHE 191 Ca -0.12 -0.18 -0.03 0.00 -0.96 0.00 0.00 56.93 55.64 3a2t s PHE 191 Cb -0.03 -0.38 0.04 0.00 -0.34 0.00 0.00 43.02 42.32 3a2t s PHE 191 CO 0.05 -0.02 0.12 0.00 -1.46 0.00 0.00 175.22 173.91 3a2t s ALA 192 N -0.38 0.03 0.31 11.12 0.00 0.35 -1.23 121.76 131.96 3a2t s ALA 192 Ca 0.00 0.33 0.02 0.00 0.00 0.00 0.00 51.96 52.32 3a2t s ALA 192 Cb -0.04 -0.79 0.59 0.00 0.00 0.00 0.00 23.12 22.88 3a2t s ALA 192 CO -0.00 -0.63 1.89 -0.22 0.00 0.00 0.00 175.76 176.81 3a2t h LYS 193 N 8.39 0.93 -3.65 0.00 1.63 -1.85 0.07 116.57 122.09 3a2t h LYS 193 Ca -0.13 -0.06 -0.26 0.00 -0.85 0.00 0.00 60.65 59.36 3a2t h LYS 193 Cb 1.12 -0.21 -0.30 0.00 -0.60 0.00 0.00 32.23 32.24 3a2t h LYS 193 CO 0.17 0.61 -0.72 0.71 -3.45 0.00 0.00 179.45 176.77 3a2t s TYR 194 N -5.87 0.01 0.32 1.91 1.51 -1.24 -0.04 117.35 113.95 3a2t s TYR 194 Ca -0.11 0.05 -0.18 0.00 -1.01 0.00 0.00 57.07 55.82 3a2t s TYR 194 Cb 0.21 -0.09 0.03 0.00 -0.11 0.00 0.00 41.96 42.00 3a2t s TYR 194 CO 0.80 -0.03 0.73 0.00 -1.11 0.00 0.00 175.55 175.93 3a2t s ALA 195 N 0.41 -0.95 -0.02 3.71 0.00 -0.45 -4.20 121.76 120.27 3a2t s ALA 195 Ca -0.03 -0.53 0.05 0.00 0.00 0.00 0.00 51.96 51.44 3a2t s ALA 195 Cb -0.05 0.80 -0.01 0.00 0.00 0.00 0.00 23.12 23.86 3a2t s ALA 195 CO -0.01 -1.01 -0.17 -0.51 0.00 0.00 0.00 175.76 174.07 3a2t s ASP 196 N -2.99 2.02 0.10 0.00 1.11 -1.26 0.19 116.67 115.84 3a2t s ASP 196 Ca 0.14 -0.32 0.08 0.00 0.18 0.00 0.00 52.55 52.63 3a2t s ASP 196 Cb -0.05 -0.35 -0.03 0.00 1.07 0.00 0.00 42.92 43.55 3a2t s ASP 196 CO 0.09 0.19 -0.20 -0.76 1.18 0.00 0.00 175.17 175.66 3a2t s LEU 197 N -0.23 2.29 0.66 1.23 1.02 -0.68 -1.57 118.68 121.40 3a2t s LEU 197 Ca 0.03 -0.68 0.03 0.00 0.02 0.00 0.00 54.13 53.53 3a2t s LEU 197 Cb -0.08 -0.86 0.11 0.00 0.02 0.00 0.00 46.19 45.37 3a2t s LEU 197 CO 0.00 0.05 0.91 0.54 0.02 0.00 0.00 176.35 177.88 3a2t s ASN 198 N -1.88 4.65 0.00 2.29 2.20 -0.22 -0.33 114.94 121.65 3a2t s ASN 198 Ca 0.06 -0.54 0.05 0.00 -0.94 0.00 0.00 52.86 51.49 3a2t s ASN 198 Cb -0.10 0.08 0.24 0.00 -2.00 0.00 0.00 41.25 39.47 3a2t s ASN 198 CO 0.04 -1.65 1.05 0.35 -2.94 0.00 0.00 177.10 173.95 3a2t n THR 199 N -2.60 1.21 -0.69 0.54 -2.24 -1.26 -1.55 114.28 107.69 3a2t n THR 199 Ca 0.15 0.30 0.08 0.00 -2.27 0.00 0.00 64.05 62.32 3a2t n THR 199 Cb 0.61 -1.22 0.38 0.00 -2.10 0.00 0.00 70.33 67.99 3a2t n THR 199 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3a2t n ASP 200 N -1.36 5.12 -1.12 3.42 8.00 -1.26 -4.91 116.55 124.44 3a2t n ASP 200 Ca 0.02 -2.64 -0.15 0.00 0.71 0.00 0.00 54.79 52.73 3a2t n ASP 200 Cb 0.05 -0.62 -0.06 0.00 -0.02 0.00 0.00 41.12 40.46 3a2t n ASP 200 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3a2t n ALA 201 N 0.92 -0.22 -2.56 2.24 0.00 -0.60 -4.98 120.51 115.31 3a2t n ALA 201 Ca 0.26 0.24 -0.33 0.00 0.00 0.00 0.00 53.44 53.61 3a2t n ALA 201 Cb 1.01 -1.75 -0.05 0.00 0.00 0.00 0.00 19.45 18.66 3a2t n ALA 201 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3a2t s GLU 202 N -3.18 3.73 -0.05 0.00 2.02 -1.26 -4.81 118.70 115.16 3a2t s GLU 202 Ca 0.00 0.12 -0.26 0.00 0.02 0.00 0.00 54.97 54.85 3a2t s GLU 202 Cb 0.00 -2.85 -0.03 0.00 0.10 0.00 0.00 34.13 31.35 3a2t s GLU 202 CO 0.00 0.46 0.81 0.50 0.02 0.00 0.00 175.26 177.05 3a2t s ARG 203 N -2.42 4.48 0.27 1.61 3.52 -1.26 -1.05 118.95 124.09 3a2t s ARG 203 Ca 0.40 1.09 0.10 0.00 -0.13 0.00 0.00 55.73 57.18 3a2t s ARG 203 Cb -0.13 -3.46 -0.05 0.00 -1.56 0.00 0.00 34.95 29.75 3a2t s ARG 203 CO 0.21 0.00 -0.15 0.14 -0.81 0.00 0.00 175.30 174.70 3a2t s VAL 204 N 0.94 2.11 0.42 7.11 -7.23 -0.61 -4.94 120.40 118.20 3a2t s VAL 204 Ca 0.43 -2.28 -0.26 0.00 -1.81 0.00 0.00 61.98 58.06 3a2t s VAL 204 Cb -0.19 -2.29 -0.08 0.00 0.56 0.00 0.00 36.38 34.38 3a2t s VAL 204 CO 0.22 -0.42 1.34 0.00 -0.31 0.00 0.00 175.10 175.93 3a2t s ALA 205 N -2.73 3.24 0.44 1.32 0.00 -1.26 -4.39 121.76 118.38 3a2t s ALA 205 Ca 0.28 1.30 -0.23 0.00 0.00 0.00 0.00 51.96 53.31 3a2t s ALA 205 Cb -0.01 -3.52 -0.11 0.00 0.00 0.00 0.00 23.12 19.48 3a2t s ALA 205 CO 0.12 -0.94 0.81 0.28 0.00 0.00 0.00 175.76 176.03 3a2t n VAL 206 N -0.01 2.30 -2.49 0.00 0.31 -1.26 -2.27 118.33 114.91 3a2t n VAL 206 Ca 0.04 -0.50 -0.15 0.00 -0.01 0.00 0.00 64.34 63.72 3a2t n VAL 206 Cb 0.43 -0.90 0.01 0.00 -0.91 0.00 0.00 33.84 32.47 3a2t n VAL 206 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3a2t n ASN 207 N 0.68 -4.62 -4.85 4.52 3.02 -1.26 -5.01 115.26 107.74 3a2t n ASN 207 Ca 0.11 -0.09 -0.32 0.00 -0.03 0.00 0.00 54.58 54.25 3a2t n ASN 207 Cb 0.40 -3.65 -0.04 0.00 -0.61 0.00 0.00 39.78 35.88 3a2t n ASN 207 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3a2t s THR 208 N -2.84 4.66 0.10 3.41 2.01 -0.96 -5.00 115.64 117.02 3a2t s THR 208 Ca 0.09 0.93 -0.34 0.00 0.31 0.00 0.00 61.69 62.67 3a2t s THR 208 Cb -0.04 -3.68 -0.14 0.00 0.01 0.00 0.00 72.50 68.64 3a2t s THR 208 CO 0.11 -0.45 1.56 0.00 -0.69 0.00 0.00 174.62 175.15 3a2t h ALA 209 N 1.51 -0.99 -3.09 7.40 0.00 -1.95 -3.28 119.26 118.86 3a2t h ALA 209 Ca -0.47 -0.12 -0.70 0.00 0.00 0.00 0.00 54.91 53.61 3a2t h ALA 209 Cb 1.18 0.85 -0.34 0.00 0.00 0.00 0.00 17.79 19.48 3a2t h ALA 209 CO 0.63 -1.12 -0.39 -0.80 0.00 0.00 0.00 179.25 177.57 3a2t s ASN 210 N -4.62 5.37 -0.07 0.00 -0.87 -1.26 -5.00 114.94 108.49 3a2t s ASN 210 Ca -0.17 -2.52 -0.05 0.00 -1.57 0.00 0.00 52.86 48.55 3a2t s ASN 210 Cb 0.06 -1.88 0.02 0.00 -0.02 0.00 0.00 41.25 39.43 3a2t s ASN 210 CO 0.61 -0.46 0.17 0.00 -2.57 0.00 0.00 177.10 174.85 3a2t s ALA 211 N 0.42 -0.40 -0.26 0.60 0.00 -1.24 -4.70 121.76 116.20 3a2t s ALA 211 Ca 0.13 0.55 -0.04 0.00 0.00 0.00 0.00 51.96 52.61 3a2t s ALA 211 Cb -0.21 -0.34 0.01 0.00 0.00 0.00 0.00 23.12 22.58 3a2t s ALA 211 CO -0.04 -0.10 -0.01 -1.01 0.00 0.00 0.00 175.76 174.60 3a2t s HIS 212 N 0.38 3.06 0.42 0.00 3.76 0.55 -4.91 115.29 118.55 3a2t s HIS 212 Ca -0.02 -1.17 -0.25 0.00 -0.15 0.00 0.00 55.06 53.46 3a2t s HIS 212 Cb -0.04 -2.14 -0.08 0.00 1.11 0.00 0.00 32.58 31.43 3a2t s HIS 212 CO -0.02 -0.62 1.29 -2.14 -0.85 0.00 0.00 174.74 172.41 3a2t s PRO 213 N 1.43 3.86 0.16 8.40 0.02 -1.26 -1.68 135.00 145.93 3a2t s PRO 213 Ca 0.03 2.13 0.02 0.00 0.02 0.00 0.00 61.00 63.19 3a2t s PRO 213 Cb -0.16 -2.67 -0.05 0.00 0.02 0.00 0.00 34.50 31.64 3a2t s PRO 213 CO -0.02 -0.57 -0.02 0.14 -0.33 0.00 0.00 177.00 176.21 3a2t s VAL 214 N -1.30 0.75 0.18 3.83 -7.23 0.49 -1.20 120.40 115.92 3a2t s VAL 214 Ca 0.59 -1.98 0.10 0.00 -1.81 0.00 0.00 61.98 58.88 3a2t s VAL 214 Cb -0.37 -2.05 -0.04 0.00 0.56 0.00 0.00 36.38 34.48 3a2t s VAL 214 CO 0.47 -0.55 -0.21 -0.75 -0.31 0.00 0.00 175.10 173.75 3a2t s LYS 215 N -3.89 1.40 -1.49 4.82 2.20 0.13 -1.34 119.74 121.59 3a2t s LYS 215 Ca 0.22 -1.47 -0.01 0.00 -0.36 0.00 0.00 55.97 54.35 3a2t s LYS 215 Cb 0.06 -1.61 0.01 0.00 -1.51 0.00 0.00 37.83 34.78 3a2t s LYS 215 CO 0.03 0.34 0.25 -0.25 -0.36 0.00 0.00 175.35 175.36 3a2t n ASP 216 N 0.29 0.11 -4.61 1.43 8.00 0.94 -0.73 116.55 121.98 3a2t n ASP 216 Ca -0.13 -1.13 -0.43 0.00 0.71 0.00 0.00 54.79 53.81 3a2t n ASP 216 Cb 0.56 -2.39 -0.02 0.00 -0.02 0.00 0.00 41.12 39.25 3a2t n ASP 216 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3a2t s TYR 217 N -4.11 2.56 -0.00 1.24 5.04 0.01 -4.34 117.35 117.74 3a2t s TYR 217 Ca 0.04 0.74 0.06 0.00 -2.44 0.00 0.00 57.07 55.47 3a2t s TYR 217 Cb -0.02 -4.21 -0.02 0.00 0.35 0.00 0.00 41.96 38.06 3a2t s TYR 217 CO 0.94 -1.78 -0.18 1.14 -1.34 0.00 0.00 175.55 174.33 3a2t s GLN 218 N 4.62 1.43 -0.08 4.97 -2.07 -0.72 -0.50 119.66 127.32 3a2t s GLN 218 Ca 0.57 -0.70 0.01 0.00 -1.82 0.00 0.00 55.36 53.43 3a2t s GLN 218 Cb -0.13 -1.41 0.02 0.00 -1.09 0.00 0.00 33.01 30.40 3a2t s GLN 218 CO 0.29 0.38 -0.10 0.08 -1.32 0.00 0.00 175.29 174.62 3a2t s VAL 219 N -0.50 1.07 -0.02 3.63 1.01 0.44 -2.52 120.40 123.51 3a2t s VAL 219 Ca 0.07 -0.40 0.07 0.00 0.00 0.00 0.00 61.98 61.72 3a2t s VAL 219 Cb -0.07 -1.02 -0.02 0.00 0.00 0.00 0.00 36.38 35.27 3a2t s VAL 219 CO -0.00 0.35 -0.23 -1.00 0.00 0.00 0.00 175.10 174.22 3a2t s HIS 220 N 0.99 2.11 -0.10 5.22 3.76 0.13 -1.28 115.29 126.14 3a2t s HIS 220 Ca -0.08 -0.41 -0.05 0.00 -0.15 0.00 0.00 55.06 54.37 3a2t s HIS 220 Cb -0.15 -1.36 0.05 0.00 1.11 0.00 0.00 32.58 32.23 3a2t s HIS 220 CO -0.00 -0.04 0.22 0.50 -0.85 0.00 0.00 174.74 174.57 3a2t s ARG 221 N -0.54 0.17 -0.11 1.40 3.52 0.67 -1.06 118.95 123.01 3a2t s ARG 221 Ca 0.09 0.50 0.03 0.00 -0.13 0.00 0.00 55.73 56.22 3a2t s ARG 221 Cb -0.09 -0.14 0.01 0.00 -1.56 0.00 0.00 34.95 33.17 3a2t s ARG 221 CO -0.01 -0.17 -0.19 0.08 -0.81 0.00 0.00 175.30 174.20 3a2t s VAL 222 N 1.30 1.73 -0.06 7.11 1.01 -0.50 -0.18 120.40 130.81 3a2t s VAL 222 Ca -0.09 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.10 3a2t s VAL 222 Cb -0.11 -1.54 0.02 0.00 0.00 0.00 0.00 36.38 34.76 3a2t s VAL 222 CO -0.08 0.49 -0.06 -0.69 0.00 0.00 0.00 175.10 174.76 3a2t s VAL 223 N 0.71 0.71 0.11 2.92 1.01 0.13 -0.68 120.40 125.31 3a2t s VAL 223 Ca -0.12 -0.18 0.04 0.00 0.00 0.00 0.00 61.98 61.72 3a2t s VAL 223 Cb -0.16 -0.73 -0.04 0.00 0.00 0.00 0.00 36.38 35.45 3a2t s VAL 223 CO 0.02 0.28 -0.10 0.00 0.00 0.00 0.00 175.10 175.30 3a2t s ALA 224 N 1.16 1.22 0.00 5.51 0.00 -0.69 0.69 121.76 129.64 3a2t s ALA 224 Ca -0.07 -1.28 0.00 0.00 0.00 0.00 0.00 51.96 50.61 3a2t s ALA 224 Cb -0.14 0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.02 3a2t s ALA 224 CO -0.01 -0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.10 3a2t n GLY 225 N 0.33 -1.84 3.14 0.00 0.00 0.16 -1.37 105.19 105.60 3a2t n GLY 225 Ca -0.14 -1.13 -0.30 0.00 0.00 0.00 0.00 46.02 44.45 3a2t n GLY 225 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3a2t s TYR 226 N -2.14 2.19 -0.34 1.61 5.04 -0.26 -0.55 117.35 122.90 3a2t s TYR 226 Ca 0.00 -0.92 -0.01 0.00 -2.44 0.00 0.00 57.07 53.70 3a2t s TYR 226 Cb 0.00 -1.50 0.12 0.00 0.35 0.00 0.00 41.96 40.92 3a2t s TYR 226 CO 0.00 -0.41 0.16 0.34 -1.34 0.00 0.00 175.55 174.30 3a2t s ASP 227 N 0.56 3.56 -0.05 4.32 2.15 0.42 -1.08 116.67 126.55 3a2t s ASP 227 Ca -0.15 -1.85 -0.18 0.00 0.43 0.00 0.00 52.55 50.81 3a2t s ASP 227 Cb -0.17 -0.63 0.06 0.00 -0.30 0.00 0.00 42.92 41.88 3a2t s ASP 227 CO 0.05 -0.37 0.79 0.00 -0.17 0.00 0.00 175.17 175.47 3a2t n ALA 228 N 4.53 -2.26 -3.77 3.66 0.00 -0.27 -4.67 120.51 117.73 3a2t n ALA 228 Ca 0.02 -0.43 -0.27 0.00 0.00 0.00 0.00 53.44 52.76 3a2t n ALA 228 Cb 0.39 0.02 -0.07 0.00 0.00 0.00 0.00 19.45 19.79 3a2t n ALA 228 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3a2t n ASN 229 N -0.61 -0.36 -0.00 0.00 3.02 -1.26 0.16 115.26 116.22 3a2t n ASN 229 Ca 0.04 -0.92 -0.00 0.00 -0.03 0.00 0.00 54.58 53.67 3a2t n ASN 229 Cb 0.34 -1.16 -0.00 0.00 -0.61 0.00 0.00 39.78 38.35 3a2t n ASN 229 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3a2t n ASP 230 N -1.79 -4.81 -4.25 6.41 8.00 -1.26 -4.94 116.55 113.91 3a2t n ASP 230 Ca -0.07 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.14 3a2t n ASP 230 Cb 0.41 -2.31 -0.16 0.00 -0.02 0.00 0.00 41.12 39.04 3a2t n ASP 230 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3a2t s LEU 231 N -0.01 2.04 -0.03 0.64 2.96 0.43 0.40 118.68 125.11 3a2t s LEU 231 Ca 0.00 -0.42 -0.01 0.00 -0.22 0.00 0.00 54.13 53.48 3a2t s LEU 231 Cb 0.00 -1.19 0.03 0.00 0.50 0.00 0.00 46.19 45.53 3a2t s LEU 231 CO 0.00 0.28 0.04 -0.47 -1.32 0.00 0.00 176.35 174.88 3a2t s TYR 232 N -0.49 0.05 -0.01 5.38 5.04 0.38 -1.11 117.35 126.58 3a2t s TYR 232 Ca 0.08 0.17 0.00 0.00 -2.44 0.00 0.00 57.07 54.88 3a2t s TYR 232 Cb -0.09 -0.33 0.01 0.00 0.35 0.00 0.00 41.96 41.90 3a2t s TYR 232 CO -0.00 -0.13 0.01 0.54 -1.34 0.00 0.00 175.55 174.62 3a2t s VAL 233 N 1.46 0.05 -0.13 3.14 0.11 -0.24 0.47 120.40 125.25 3a2t s VAL 233 Ca -0.04 0.07 -0.05 0.00 -2.93 0.00 0.00 61.98 59.02 3a2t s VAL 233 Cb -0.13 -0.11 0.06 0.00 -1.53 0.00 0.00 36.38 34.68 3a2t s VAL 233 CO -0.03 0.06 0.28 -0.55 -3.33 0.00 0.00 175.10 171.53 3a2t s SER 234 N 0.52 0.16 -0.06 3.54 0.15 0.28 -1.10 113.70 117.18 3a2t s SER 234 Ca -0.05 0.63 0.03 0.00 0.70 0.00 0.00 55.95 57.26 3a2t s SER 234 Cb -0.07 0.70 -0.02 0.00 -1.71 0.00 0.00 66.02 64.92 3a2t s SER 234 CO -0.01 -0.22 -0.16 0.68 1.20 0.00 0.00 173.24 174.73 3a2t s VAL 235 N 2.18 2.91 -0.00 4.45 -7.23 -0.47 -0.95 120.40 121.29 3a2t s VAL 235 Ca -0.01 -0.77 0.02 0.00 -1.81 0.00 0.00 61.98 59.41 3a2t s VAL 235 Cb -0.12 -2.14 -0.01 0.00 0.56 0.00 0.00 36.38 34.68 3a2t s VAL 235 CO -0.09 0.58 -0.06 0.00 -0.31 0.00 0.00 175.10 175.22 3a2t s ALA 236 N -0.49 0.49 0.02 1.32 0.00 0.82 -1.70 121.76 122.22 3a2t s ALA 236 Ca 0.06 -0.27 0.07 0.00 0.00 0.00 0.00 51.96 51.82 3a2t s ALA 236 Cb -0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 3a2t s ALA 236 CO 0.02 0.11 -0.22 0.20 0.00 0.00 0.00 175.76 175.87 3a2t s GLY 237 N -0.20 1.16 -0.09 0.00 0.00 0.14 -0.95 107.32 107.39 3a2t s GLY 237 Ca 0.02 -1.05 -0.05 0.00 0.00 0.00 0.00 44.72 43.64 3a2t s GLY 237 CO -0.00 -0.93 0.21 1.62 0.00 0.00 0.00 173.10 174.00 3a2t s GLN 238 N -0.89 0.17 -0.03 2.90 0.74 0.18 -1.40 119.66 121.33 3a2t s GLN 238 Ca 0.09 0.47 0.07 0.00 0.05 0.00 0.00 55.36 56.04 3a2t s GLN 238 Cb -0.09 -0.13 -0.02 0.00 1.10 0.00 0.00 33.01 33.87 3a2t s GLN 238 CO 0.01 -0.16 -0.24 -0.47 -0.55 0.00 0.00 175.29 173.87 3a2t s TYR 239 N 1.20 2.40 -0.01 1.67 5.04 -0.22 0.60 117.35 128.02 3a2t s TYR 239 Ca -0.09 -0.48 0.00 0.00 -2.44 0.00 0.00 57.07 54.06 3a2t s TYR 239 Cb -0.11 -1.54 0.01 0.00 0.35 0.00 0.00 41.96 40.68 3a2t s TYR 239 CO -0.07 -0.06 -0.00 -1.21 -1.34 0.00 0.00 175.55 172.86 3a2t s GLU 240 N -0.50 0.15 -0.09 4.97 2.02 -0.29 -0.69 118.70 124.26 3a2t s GLU 240 Ca 0.07 0.01 -0.30 0.00 0.02 0.00 0.00 54.97 54.77 3a2t s GLU 240 Cb -0.11 -0.23 0.07 0.00 0.10 0.00 0.00 34.13 33.96 3a2t s GLU 240 CO 0.00 -0.04 0.70 0.00 0.02 0.00 0.00 175.26 175.94 3a2t s ALA 241 N 0.40 -1.78 0.14 5.21 0.00 -1.05 -0.33 121.76 124.35 3a2t s ALA 241 Ca -0.04 1.44 -0.24 0.00 0.00 0.00 0.00 51.96 53.12 3a2t s ALA 241 Cb -0.06 -0.20 0.07 0.00 0.00 0.00 0.00 23.12 22.93 3a2t s ALA 241 CO -0.01 -0.36 0.70 0.00 0.00 0.00 0.00 175.76 176.08 3a2t s ALA 242 N -0.95 -1.61 -0.14 0.00 0.00 -0.09 -1.75 121.76 117.22 3a2t s ALA 242 Ca -0.09 0.49 -0.06 0.00 0.00 0.00 0.00 51.96 52.30 3a2t s ALA 242 Cb -0.01 0.77 -0.04 0.00 0.00 0.00 0.00 23.12 23.84 3a2t s ALA 242 CO 0.08 -0.80 0.05 0.15 0.00 0.00 0.00 175.76 175.25 3a2t s LYS 243 N -3.61 3.61 0.03 0.00 1.02 0.09 0.23 119.74 121.11 3a2t s LYS 243 Ca 0.04 -0.33 -0.34 0.00 0.02 0.00 0.00 55.97 55.36 3a2t s LYS 243 Cb -0.02 -3.08 -0.12 0.00 -0.52 0.00 0.00 37.83 34.09 3a2t s LYS 243 CO -0.09 0.47 1.77 -1.71 -0.92 0.00 0.00 175.35 174.87 3a2t n ASN 244 N 2.90 3.41 -0.11 2.83 2.85 0.11 0.23 115.26 127.47 3a2t n ASN 244 Ca -0.18 1.01 0.09 0.00 -0.11 0.00 0.00 54.58 55.39 3a2t n ASN 244 Cb 0.53 -1.41 0.12 0.00 1.24 0.00 0.00 39.78 40.26 3a2t n ASN 244 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 3a2t n ASN 245 N 5.39 2.13 -4.57 1.20 5.15 -0.34 0.19 115.26 124.41 3a2t n ASN 245 Ca 0.20 -2.96 -0.42 0.00 -0.60 0.00 0.00 54.58 50.80 3a2t n ASN 245 Cb 0.30 -0.40 -0.06 0.00 -0.53 0.00 0.00 39.78 39.09 3a2t n ASN 245 CO 0.00 0.00 0.00 -1.83 1.40 0.00 0.00 177.26 176.83 3a2t s GLU 246 N -2.58 3.68 -0.16 1.20 -1.05 -1.21 -4.77 118.70 113.82 3a2t s GLU 246 Ca 0.28 0.10 -0.39 0.00 -0.15 0.00 0.00 54.97 54.82 3a2t s GLU 246 Cb 0.25 -3.81 -0.16 0.00 -0.44 0.00 0.00 34.13 29.97 3a2t s GLU 246 CO 0.03 -0.77 1.65 0.28 0.95 0.00 0.00 175.26 177.39 3a2t n VAL 247 N 5.64 0.24 -3.60 1.83 0.31 -1.26 -3.98 118.33 117.51 3a2t n VAL 247 Ca -0.00 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 3a2t n VAL 247 Cb 0.48 -1.17 0.00 0.00 -0.91 0.00 0.00 33.84 32.25 3a2t n VAL 247 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3a2t n GLY 248 N 3.77 -0.67 0.21 2.92 0.00 -1.26 -4.97 105.19 105.19 3a2t n GLY 248 Ca 0.24 -1.24 0.02 0.00 0.00 0.00 0.00 46.02 45.05 3a2t n GLY 248 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3a2t h SER 249 N 0.00 0.09 -0.38 1.61 0.87 -2.05 -3.21 113.55 110.47 3a2t h SER 249 Ca 0.00 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 3a2t h SER 249 Cb 0.00 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 3a2t h SER 249 CO 0.00 0.37 0.00 2.30 -0.53 0.00 0.00 176.83 178.97 3a2t n ILE 250 N -4.18 0.49 -1.67 2.23 -6.64 -1.26 -4.99 119.36 103.35 3a2t n ILE 250 Ca -0.02 -0.68 -0.42 0.00 -1.77 0.00 0.00 62.75 59.87 3a2t n ILE 250 Cb 0.35 0.77 0.00 0.00 -1.44 0.00 0.00 39.64 39.31 3a2t n ILE 250 CO 0.00 0.00 0.00 1.17 -1.77 0.00 0.00 176.55 175.95 3a2t n LYS 251 N 1.23 1.81 0.00 6.28 4.81 -1.22 -2.38 118.16 128.70 3a2t n LYS 251 Ca 0.19 0.64 0.00 0.00 -0.87 0.00 0.00 58.31 58.27 3a2t n LYS 251 Cb 0.54 -2.22 0.00 0.00 0.02 0.00 0.00 35.03 33.37 3a2t n LYS 251 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3a2t n GLY 252 N 0.92 2.81 3.68 3.14 0.00 0.51 -4.94 105.19 111.31 3a2t n GLY 252 Ca 0.07 -0.08 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 3a2t n GLY 252 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3a2t n LYS 253 N 0.00 0.78 -3.24 1.61 5.02 -1.00 -4.29 118.16 117.03 3a2t n LYS 253 Ca 0.00 0.32 -0.39 0.00 -2.02 0.00 0.00 58.31 56.23 3a2t n LYS 253 Cb 0.00 -2.38 -0.06 0.00 -0.02 0.00 0.00 35.03 32.57 3a2t n LYS 253 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3a2t s LYS 254 N -3.38 4.28 -0.04 1.97 -0.14 -1.26 0.05 119.74 121.21 3a2t s LYS 254 Ca 0.78 0.69 0.03 0.00 -1.36 0.00 0.00 55.97 56.11 3a2t s LYS 254 Cb -0.36 -3.33 -0.03 0.00 -1.68 0.00 0.00 37.83 32.43 3a2t s LYS 254 CO 0.45 0.41 -0.12 -1.01 -0.76 0.00 0.00 175.35 174.32 3a2t s HIS 255 N -0.30 2.77 -0.19 3.18 3.76 0.13 -0.76 115.29 123.88 3a2t s HIS 255 Ca 0.30 -0.11 -0.30 0.00 -0.15 0.00 0.00 55.06 54.80 3a2t s HIS 255 Cb -0.18 -1.64 0.14 0.00 1.11 0.00 0.00 32.58 32.02 3a2t s HIS 255 CO 0.17 0.24 1.08 -1.83 -0.85 0.00 0.00 174.74 173.55 3a2t s GLU 256 N -0.86 0.47 -0.20 1.40 -1.05 -0.06 -0.91 118.70 117.49 3a2t s GLU 256 Ca 0.12 0.13 -0.24 0.00 -0.15 0.00 0.00 54.97 54.83 3a2t s GLU 256 Cb -0.11 0.22 0.06 0.00 -0.44 0.00 0.00 34.13 33.87 3a2t s GLU 256 CO 0.02 -0.14 0.65 -1.14 0.95 0.00 0.00 175.26 175.59 3a2t s GLN 257 N -1.03 0.82 -0.13 -4.83 0.74 0.55 -0.76 119.66 115.02 3a2t s GLN 257 Ca 0.01 0.74 -0.01 0.00 0.05 0.00 0.00 55.36 56.15 3a2t s GLN 257 Cb -0.01 0.40 -0.02 0.00 1.10 0.00 0.00 33.01 34.48 3a2t s GLN 257 CO -0.01 -0.14 -0.09 0.99 -0.55 0.00 0.00 175.29 175.48 3a2t s THR 258 N -0.03 3.39 0.01 -0.34 2.01 -1.26 -1.14 115.64 118.28 3a2t s THR 258 Ca -0.03 -0.55 0.05 0.00 0.31 0.00 0.00 61.69 61.47 3a2t s THR 258 Cb -0.04 -2.44 -0.02 0.00 0.01 0.00 0.00 72.50 70.02 3a2t s THR 258 CO 0.03 0.52 -0.14 -1.10 -0.69 0.00 0.00 174.62 173.24 3a2t s GLN 259 N 0.21 1.05 0.07 4.92 -0.21 0.20 -1.32 119.66 124.58 3a2t s GLN 259 Ca -0.06 -0.60 0.06 0.00 0.02 0.00 0.00 55.36 54.78 3a2t s GLN 259 Cb -0.15 -1.03 -0.03 0.00 1.00 0.00 0.00 33.01 32.80 3a2t s GLN 259 CO 0.04 0.27 -0.17 0.14 -2.12 0.00 0.00 175.29 173.46 3a2t s VAL 260 N -0.54 1.33 -0.07 1.09 -7.23 -0.42 0.52 120.40 115.09 3a2t s VAL 260 Ca 0.04 -1.33 -0.06 0.00 -1.81 0.00 0.00 61.98 58.82 3a2t s VAL 260 Cb -0.06 -1.23 0.02 0.00 0.56 0.00 0.00 36.38 35.66 3a2t s VAL 260 CO 0.00 -0.11 0.18 0.00 -0.31 0.00 0.00 175.10 174.86 3a2t s ALA 261 N -1.15 -0.43 -0.01 1.32 0.00 -0.12 -1.08 121.76 120.29 3a2t s ALA 261 Ca 0.02 0.57 0.03 0.00 0.00 0.00 0.00 51.96 52.58 3a2t s ALA 261 Cb -0.10 -0.35 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 3a2t s ALA 261 CO 0.03 -0.11 -0.10 0.00 0.00 0.00 0.00 175.76 175.59 3a2t s ALA 262 N 0.36 0.80 -0.13 0.00 0.00 0.10 -0.13 121.76 122.76 3a2t s ALA 262 Ca -0.02 -0.42 -0.12 0.00 0.00 0.00 0.00 51.96 51.40 3a2t s ALA 262 Cb -0.04 -0.20 0.03 0.00 0.00 0.00 0.00 23.12 22.92 3a2t s ALA 262 CO -0.02 0.20 0.35 0.99 0.00 0.00 0.00 175.76 177.28 3a2t s THR 263 N -0.23 0.00 0.03 0.00 2.01 -0.12 0.36 115.64 117.69 3a2t s THR 263 Ca 0.04 -0.00 -0.03 0.00 0.31 0.00 0.00 61.69 62.00 3a2t s THR 263 Cb -0.04 -0.50 -0.02 0.00 0.01 0.00 0.00 72.50 71.96 3a2t s THR 263 CO -0.00 -0.00 0.04 0.00 -0.69 0.00 0.00 174.62 173.97 3a2t s ALA 264 N 0.18 0.04 -0.25 7.40 0.00 -0.41 0.98 121.76 129.69 3a2t s ALA 264 Ca -0.00 -0.59 -0.25 0.00 0.00 0.00 0.00 51.96 51.12 3a2t s ALA 264 Cb -0.02 0.19 0.07 0.00 0.00 0.00 0.00 23.12 23.36 3a2t s ALA 264 CO 0.01 -0.25 0.74 0.00 0.00 0.00 0.00 175.76 176.25 3a2t s ALA 265 N -2.17 -1.79 -0.02 0.00 0.00 0.18 -1.59 121.76 116.36 3a2t s ALA 265 Ca -0.09 1.97 0.08 0.00 0.00 0.00 0.00 51.96 53.92 3a2t s ALA 265 Cb -0.04 -1.11 -0.02 0.00 0.00 0.00 0.00 23.12 21.95 3a2t s ALA 265 CO -0.03 -0.34 -0.25 -0.47 0.00 0.00 0.00 175.76 174.67 3a2t s TYR 266 N 0.25 2.29 -0.51 0.00 5.04 -1.15 -0.47 117.35 122.80 3a2t s TYR 266 Ca -0.01 -0.47 -0.17 0.00 -2.44 0.00 0.00 57.07 53.99 3a2t s TYR 266 Cb -0.05 -1.48 0.09 0.00 0.35 0.00 0.00 41.96 40.87 3a2t s TYR 266 CO 0.01 -0.06 0.50 0.50 -1.34 0.00 0.00 175.55 175.16 3a2t s ARG 267 N -0.54 3.01 0.53 4.97 3.52 0.16 -2.98 118.95 127.62 3a2t s ARG 267 Ca 0.08 -1.36 -0.09 0.00 -0.13 0.00 0.00 55.73 54.23 3a2t s ARG 267 Cb -0.10 -4.19 0.12 0.00 -1.56 0.00 0.00 34.95 29.22 3a2t s ARG 267 CO -0.00 -1.20 0.71 1.19 -0.81 0.00 0.00 175.30 175.19 3a2t n PHE 268 N 5.52 -3.97 -0.16 5.12 3.72 -0.31 -4.85 117.46 122.52 3a2t n PHE 268 Ca -0.11 -0.65 -0.06 0.00 -0.05 0.00 0.00 57.45 56.58 3a2t n PHE 268 Cb 0.43 -0.55 -0.05 0.00 -0.94 0.00 0.00 39.48 38.37 3a2t n PHE 268 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3a2t h GLY 269 N -0.93 -1.70 0.00 1.37 0.00 -2.02 -3.34 103.07 96.45 3a2t h GLY 269 Ca -0.23 0.92 0.00 0.00 0.00 0.00 0.00 47.33 48.02 3a2t h GLY 269 CO 0.17 -0.48 0.00 0.70 0.00 0.00 0.00 176.54 176.92 3a2t n ASN 270 N -4.09 0.52 -4.67 0.19 3.02 -1.26 -5.01 115.26 103.96 3a2t n ASN 270 Ca 0.00 -0.78 -0.35 0.00 -0.03 0.00 0.00 54.58 53.42 3a2t n ASN 270 Cb 0.14 0.30 -0.10 0.00 -0.61 0.00 0.00 39.78 39.52 3a2t n ASN 270 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3a2t s VAL 271 N -0.30 4.22 -0.44 2.41 1.01 -1.25 -0.58 120.40 125.46 3a2t s VAL 271 Ca 0.00 -0.28 0.02 0.00 0.00 0.00 0.00 61.98 61.72 3a2t s VAL 271 Cb 0.00 -2.77 0.14 0.00 0.00 0.00 0.00 36.38 33.76 3a2t s VAL 271 CO 0.00 0.60 0.26 -0.89 0.00 0.00 0.00 175.10 175.08 3a2t s THR 272 N -0.86 1.21 0.95 3.92 2.01 -0.86 -1.17 115.64 120.84 3a2t s THR 272 Ca 0.13 -2.56 -0.12 0.00 0.31 0.00 0.00 61.69 59.45 3a2t s THR 272 Cb -0.11 -1.85 0.16 0.00 0.01 0.00 0.00 72.50 70.71 3a2t s THR 272 CO 0.02 -0.95 1.09 -2.16 -0.69 0.00 0.00 174.62 171.93 3a2t s PRO 273 N 0.30 0.85 -0.09 4.92 0.04 -1.16 -2.79 135.00 137.08 3a2t s PRO 273 Ca 0.20 0.86 -0.31 0.00 0.04 0.00 0.00 61.00 61.79 3a2t s PRO 273 Cb -0.20 -1.76 0.09 0.00 0.04 0.00 0.00 34.50 32.67 3a2t s PRO 273 CO -0.03 -2.54 0.78 0.50 0.04 0.00 0.00 177.00 175.75 3a2t s ARG 274 N -4.84 0.92 -0.02 4.56 3.52 0.21 -2.95 118.95 120.35 3a2t s ARG 274 Ca 0.65 0.23 -0.06 0.00 -0.13 0.00 0.00 55.73 56.42 3a2t s ARG 274 Cb -0.19 0.43 0.01 0.00 -1.56 0.00 0.00 34.95 33.63 3a2t s ARG 274 CO 0.58 -0.28 0.13 0.54 -0.81 0.00 0.00 175.30 175.45 3a2t s VAL 275 N -1.15 0.05 -0.02 7.11 0.11 -0.62 -0.70 120.40 125.17 3a2t s VAL 275 Ca -0.08 -0.38 -0.05 0.00 -2.93 0.00 0.00 61.98 58.54 3a2t s VAL 275 Cb -0.00 -0.31 0.00 0.00 -1.53 0.00 0.00 36.38 34.54 3a2t s VAL 275 CO 0.07 -0.21 0.11 -0.44 -3.33 0.00 0.00 175.10 171.30 3a2t s SER 276 N -0.70 -0.04 0.14 3.54 0.01 0.11 -1.29 113.70 115.48 3a2t s SER 276 Ca -0.08 0.02 0.08 0.00 1.31 0.00 0.00 55.95 57.28 3a2t s SER 276 Cb -0.05 0.22 -0.04 0.00 0.21 0.00 0.00 66.02 66.36 3a2t s SER 276 CO 0.01 -0.17 -0.18 -0.47 0.41 0.00 0.00 173.24 172.84 3a2t s TYR 277 N -0.54 1.73 -0.15 2.43 6.14 0.16 0.08 117.35 127.19 3a2t s TYR 277 Ca -0.06 -0.47 -0.19 0.00 0.64 0.00 0.00 57.07 56.98 3a2t s TYR 277 Cb -0.04 -0.89 0.05 0.00 0.42 0.00 0.00 41.96 41.50 3a2t s TYR 277 CO 0.00 0.26 0.51 0.00 0.64 0.00 0.00 175.55 176.97 3a2t s ALA 278 N -1.84 -1.27 0.01 3.97 0.00 0.83 0.02 121.76 123.48 3a2t s ALA 278 Ca 0.12 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.35 3a2t s ALA 278 Cb -0.07 -0.60 -0.01 0.00 0.00 0.00 0.00 23.12 22.44 3a2t s ALA 278 CO 0.05 -0.26 -0.02 -1.58 0.00 0.00 0.00 175.76 173.95 3a2t s HIS 279 N -0.15 0.19 -0.25 0.00 5.04 -0.24 -0.46 115.29 119.42 3a2t s HIS 279 Ca -0.03 -0.33 0.01 0.00 -1.54 0.00 0.00 55.06 53.16 3a2t s HIS 279 Cb -0.03 -0.14 0.07 0.00 0.04 0.00 0.00 32.58 32.52 3a2t s HIS 279 CO 0.02 -0.11 -0.03 0.20 -2.34 0.00 0.00 174.74 172.49 3a2t s GLY 280 N -0.91 1.29 0.95 1.59 0.00 -0.23 -1.30 107.32 108.71 3a2t s GLY 280 Ca -0.09 -1.43 -0.11 0.00 0.00 0.00 0.00 44.72 43.08 3a2t s GLY 280 CO -0.01 1.02 1.12 -1.36 0.00 0.00 0.00 173.10 173.87 3a2t s PHE 281 N 1.40 1.71 0.23 1.90 0.08 -0.44 -1.10 117.98 121.76 3a2t s PHE 281 Ca -0.03 1.63 -0.31 0.00 0.12 0.00 0.00 56.93 58.34 3a2t s PHE 281 Cb -0.19 -3.26 -0.14 0.00 -0.57 0.00 0.00 43.02 38.86 3a2t s PHE 281 CO -0.08 -2.88 1.18 1.63 -0.10 0.00 0.00 175.22 174.97 3a2t n LYS 282 N -4.27 1.49 -3.98 0.44 5.02 -1.26 -4.25 118.16 111.34 3a2t n LYS 282 Ca 0.10 0.53 -0.37 0.00 -2.02 0.00 0.00 58.31 56.55 3a2t n LYS 282 Cb 0.53 -2.03 -0.07 0.00 -0.02 0.00 0.00 35.03 33.44 3a2t n LYS 282 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3a2t s ALA 283 N -0.47 3.76 -0.41 7.82 0.00 -0.43 -4.74 121.76 127.29 3a2t s ALA 283 Ca 0.67 -0.67 -0.21 0.00 0.00 0.00 0.00 51.96 51.74 3a2t s ALA 283 Cb -0.74 -1.87 0.02 0.00 0.00 0.00 0.00 23.12 20.53 3a2t s ALA 283 CO 0.54 0.61 0.66 0.21 0.00 0.00 0.00 175.76 177.79 3a2t s LYS 284 N -1.00 3.44 -0.26 0.00 2.20 0.06 0.17 119.74 124.35 3a2t s LYS 284 Ca 0.15 -0.18 -0.01 0.00 -0.36 0.00 0.00 55.97 55.57 3a2t s LYS 284 Cb -0.12 -3.90 0.03 0.00 -1.51 0.00 0.00 37.83 32.34 3a2t s LYS 284 CO 0.04 -0.93 -0.06 0.08 -0.36 0.00 0.00 175.35 174.13 3a2t s VAL 285 N 2.85 2.82 -1.16 4.02 1.01 0.95 -0.88 120.40 130.00 3a2t s VAL 285 Ca 0.24 -1.16 -0.07 0.00 0.00 0.00 0.00 61.98 61.00 3a2t s VAL 285 Cb -0.14 -2.49 0.01 0.00 0.00 0.00 0.00 36.38 33.76 3a2t s VAL 285 CO 0.18 0.12 0.90 0.59 0.00 0.00 0.00 175.10 176.89 3a2t n ASN 286 N 4.64 -5.62 0.00 3.32 3.02 -1.01 -2.33 115.26 117.28 3a2t n ASN 286 Ca -0.16 -0.41 0.00 0.00 -0.03 0.00 0.00 54.58 53.98 3a2t n ASN 286 Cb 0.46 -4.27 0.00 0.00 -0.61 0.00 0.00 39.78 35.36 3a2t n ASN 286 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3a2t n GLY 287 N -1.70 3.02 3.88 7.41 0.00 0.06 -4.69 105.19 113.18 3a2t n GLY 287 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 3a2t n GLY 287 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a2t s VAL 288 N -1.41 5.26 0.02 1.61 1.01 -0.98 -4.99 120.40 120.93 3a2t s VAL 288 Ca 0.00 0.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.86 3a2t s VAL 288 Cb 0.00 -3.59 -0.07 0.00 0.00 0.00 0.00 36.38 32.73 3a2t s VAL 288 CO 0.00 0.33 1.53 -0.54 0.00 0.00 0.00 175.10 176.41 3a2t s LYS 289 N -1.86 4.24 -0.21 2.72 1.02 -1.26 -0.03 119.74 124.35 3a2t s LYS 289 Ca 0.29 2.14 0.01 0.00 0.02 0.00 0.00 55.97 58.43 3a2t s LYS 289 Cb -0.13 -3.62 0.03 0.00 -0.52 0.00 0.00 37.83 33.59 3a2t s LYS 289 CO 0.17 -0.67 -0.16 0.34 -0.92 0.00 0.00 175.35 174.12 3a2t s ASP 290 N 2.21 3.67 0.00 2.83 -1.08 0.45 -4.90 116.67 119.86 3a2t s ASP 290 Ca 0.69 -0.88 0.26 0.00 -0.52 0.00 0.00 52.55 52.10 3a2t s ASP 290 Cb -0.35 -1.53 1.03 0.00 -1.46 0.00 0.00 42.92 40.61 3a2t s ASP 290 CO 0.29 -0.07 1.73 0.00 0.52 0.00 0.00 175.17 177.64 3a2t n ALA 291 N 4.58 2.57 0.09 3.66 0.00 -1.26 -1.31 120.51 128.82 3a2t n ALA 291 Ca -0.18 -0.44 -0.04 0.00 0.00 0.00 0.00 53.44 52.77 3a2t n ALA 291 Cb 0.47 -1.17 0.14 0.00 0.00 0.00 0.00 19.45 18.89 3a2t n ALA 291 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3a2t h ASN 292 N 2.10 0.27 1.04 0.00 2.35 -1.93 -3.06 115.58 116.35 3a2t h ASN 292 Ca 0.00 -0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.60 3a2t h ASN 292 Cb 0.45 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.74 3a2t h ASN 292 CO 0.00 0.78 -0.07 -1.22 -1.65 0.00 0.00 177.43 175.26 3a2t n TYR 293 N -3.90 0.20 -2.39 1.19 4.02 -1.25 -2.84 117.16 112.19 3a2t n TYR 293 Ca -0.02 0.06 -0.39 0.00 -0.01 0.00 0.00 57.90 57.53 3a2t n TYR 293 Cb 0.59 -0.57 -0.03 0.00 -0.02 0.00 0.00 39.34 39.31 3a2t n TYR 293 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 176.86 174.71 3a2t s GLN 294 N -3.03 4.39 0.17 -0.72 0.74 -1.16 -4.78 119.66 115.28 3a2t s GLN 294 Ca 0.13 1.83 -0.18 0.00 0.05 0.00 0.00 55.36 57.18 3a2t s GLN 294 Cb 0.17 -2.96 0.04 0.00 1.10 0.00 0.00 33.01 31.37 3a2t s GLN 294 CO 0.57 -0.02 0.51 1.52 -0.55 0.00 0.00 175.29 177.31 3a2t s TYR 295 N -1.29 -0.24 -0.02 1.67 1.13 -0.26 -0.51 117.35 117.83 3a2t s TYR 295 Ca 0.50 -0.07 0.00 0.00 -1.41 0.00 0.00 57.07 56.09 3a2t s TYR 295 Cb -0.31 0.40 0.03 0.00 -1.10 0.00 0.00 41.96 40.97 3a2t s TYR 295 CO 0.40 -0.84 0.02 -0.51 -2.51 0.00 0.00 175.55 172.11 3a2t s ASP 296 N -2.83 0.13 -0.10 -0.18 1.01 -0.43 -1.07 116.67 113.21 3a2t s ASP 296 Ca 0.05 0.03 -0.12 0.00 0.71 0.00 0.00 52.55 53.22 3a2t s ASP 296 Cb -0.00 -0.09 0.03 0.00 1.01 0.00 0.00 42.92 43.86 3a2t s ASP 296 CO -0.08 -0.12 0.31 0.00 0.21 0.00 0.00 175.17 175.50 3a2t s GLN 297 N 1.01 0.43 -0.05 8.23 -2.07 0.39 -1.09 119.66 126.52 3a2t s GLN 297 Ca -0.09 0.29 0.00 0.00 -1.82 0.00 0.00 55.36 53.75 3a2t s GLN 297 Cb -0.12 0.20 0.02 0.00 -1.09 0.00 0.00 33.01 32.02 3a2t s GLN 297 CO -0.03 -0.07 -0.02 0.54 -1.32 0.00 0.00 175.29 174.39 3a2t s VAL 298 N -0.17 0.41 -0.11 3.63 0.11 -0.73 -0.12 120.40 123.42 3a2t s VAL 298 Ca -0.03 0.01 0.03 0.00 -2.93 0.00 0.00 61.98 59.05 3a2t s VAL 298 Cb -0.03 -0.49 0.01 0.00 -1.53 0.00 0.00 36.38 34.33 3a2t s VAL 298 CO 0.01 0.22 -0.20 -0.63 -3.33 0.00 0.00 175.10 171.17 3a2t s ILE 299 N 1.31 1.86 0.02 7.04 1.01 0.11 -1.86 121.20 130.69 3a2t s ILE 299 Ca -0.05 -0.88 0.07 0.00 0.00 0.00 0.00 60.65 59.78 3a2t s ILE 299 Cb -0.13 -1.64 -0.03 0.00 0.01 0.00 0.00 42.46 40.66 3a2t s ILE 299 CO -0.02 0.51 -0.19 0.68 0.00 0.00 0.00 174.94 175.92 3a2t s VAL 300 N 0.67 2.68 -0.04 2.92 -7.23 -0.82 0.09 120.40 118.67 3a2t s VAL 300 Ca -0.12 -1.11 -0.30 0.00 -1.81 0.00 0.00 61.98 58.65 3a2t s VAL 300 Cb -0.16 -2.08 0.11 0.00 0.56 0.00 0.00 36.38 34.81 3a2t s VAL 300 CO 0.03 0.42 1.33 -0.83 -0.31 0.00 0.00 175.10 175.73 3a2t s GLY 301 N -1.17 -0.29 0.03 2.32 0.00 0.12 -0.97 107.32 107.37 3a2t s GLY 301 Ca 0.13 0.41 -0.12 0.00 0.00 0.00 0.00 44.72 45.14 3a2t s GLY 301 CO 0.03 3.20 0.26 0.00 0.00 0.00 0.00 173.10 176.59 3a2t s ALA 302 N -2.13 -0.56 -0.11 3.20 0.00 -0.54 0.68 121.76 122.30 3a2t s ALA 302 Ca 0.23 -0.06 0.03 0.00 0.00 0.00 0.00 51.96 52.16 3a2t s ALA 302 Cb 0.03 0.26 0.01 0.00 0.00 0.00 0.00 23.12 23.41 3a2t s ALA 302 CO -0.03 -0.36 -0.21 -0.51 0.00 0.00 0.00 175.76 174.65 3a2t s ASP 303 N -1.92 2.86 -0.32 0.00 1.01 -1.12 -2.04 116.67 115.14 3a2t s ASP 303 Ca -0.07 -0.53 -0.11 0.00 0.71 0.00 0.00 52.55 52.56 3a2t s ASP 303 Cb -0.02 -1.31 -0.01 0.00 1.01 0.00 0.00 42.92 42.58 3a2t s ASP 303 CO -0.02 0.10 0.19 -0.47 0.21 0.00 0.00 175.17 175.17 3a2t s TYR 304 N 0.65 3.20 -0.52 4.23 5.04 0.64 -2.02 117.35 128.56 3a2t s TYR 304 Ca -0.12 -0.38 -0.24 0.00 -2.44 0.00 0.00 57.07 53.89 3a2t s TYR 304 Cb -0.16 -2.40 0.04 0.00 0.35 0.00 0.00 41.96 39.78 3a2t s TYR 304 CO 0.03 -0.39 0.91 -0.51 -1.34 0.00 0.00 175.55 174.25 3a2t s ASP 305 N 1.67 6.38 0.10 4.32 1.01 0.26 0.47 116.67 130.87 3a2t s ASP 305 Ca 0.05 -0.23 -0.13 0.00 0.71 0.00 0.00 52.55 52.95 3a2t s ASP 305 Cb -0.17 -2.43 -0.15 0.00 1.01 0.00 0.00 42.92 41.18 3a2t s ASP 305 CO 0.08 -1.14 1.31 -0.26 0.21 0.00 0.00 175.17 175.37 3a2t h PHE 306 N 9.21 1.05 -3.68 4.23 0.04 -1.52 -3.46 116.94 122.81 3a2t h PHE 306 Ca -0.26 -0.45 -0.15 0.00 2.80 0.00 0.00 57.97 59.91 3a2t h PHE 306 Cb 1.08 -0.17 -0.06 0.00 2.20 0.00 0.00 35.95 39.00 3a2t h PHE 306 CO 0.89 1.28 -0.03 -1.54 -0.60 0.00 0.00 178.31 178.30 3a2t s SER 307 N -7.04 0.45 0.59 2.17 1.04 -1.03 -4.98 113.70 104.89 3a2t s SER 307 Ca -0.11 -1.27 0.33 0.00 0.48 0.00 0.00 55.95 55.38 3a2t s SER 307 Cb 0.09 0.71 1.83 0.00 0.10 0.00 0.00 66.02 68.74 3a2t s SER 307 CO 0.90 -1.39 2.21 0.11 0.98 0.00 0.00 173.24 176.04 3a2t h LYS 308 N 2.10 0.00 0.00 4.02 1.57 -2.02 -3.04 116.57 119.20 3a2t h LYS 308 Ca -0.29 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.18 3a2t h LYS 308 Cb 1.24 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.50 3a2t h LYS 308 CO 0.38 0.04 -2.31 0.54 -0.57 0.00 0.00 179.45 177.53 3a2t n ARG 309 N -3.52 0.68 -4.41 3.15 1.74 -1.26 -4.96 116.66 108.09 3a2t n ARG 309 Ca -0.02 -0.03 -0.34 0.00 -0.77 0.00 0.00 57.85 56.68 3a2t n ARG 309 Cb 0.15 -1.53 -0.11 0.00 -1.02 0.00 0.00 32.46 29.95 3a2t n ARG 309 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3a2t s THR 310 N -2.66 4.04 0.08 0.55 2.01 -1.15 -1.59 115.64 116.94 3a2t s THR 310 Ca -0.10 -0.32 0.02 0.00 0.31 0.00 0.00 61.69 61.60 3a2t s THR 310 Cb 0.07 -2.73 -0.04 0.00 0.01 0.00 0.00 72.50 69.81 3a2t s THR 310 CO 0.84 0.54 -0.08 -0.44 -0.69 0.00 0.00 174.62 174.80 3a2t s SER 311 N -0.21 1.14 -0.05 3.53 0.01 -0.48 -1.30 113.70 116.34 3a2t s SER 311 Ca 0.04 -0.84 0.01 0.00 1.31 0.00 0.00 55.95 56.47 3a2t s SER 311 Cb -0.13 0.06 -0.03 0.00 0.21 0.00 0.00 66.02 66.13 3a2t s SER 311 CO 0.02 -0.35 -0.05 0.00 0.41 0.00 0.00 173.24 173.28 3a2t s ALA 312 N -2.73 3.07 0.03 1.44 0.00 0.18 -1.85 121.76 121.90 3a2t s ALA 312 Ca 0.04 -0.90 0.07 0.00 0.00 0.00 0.00 51.96 51.17 3a2t s ALA 312 Cb -0.01 -1.27 -0.02 0.00 0.00 0.00 0.00 23.12 21.82 3a2t s ALA 312 CO -0.02 0.59 -0.20 -0.51 0.00 0.00 0.00 175.76 175.62 3a2t s LEU 313 N -0.99 2.14 -0.09 0.00 1.43 0.08 -0.26 118.68 120.99 3a2t s LEU 313 Ca 0.14 -0.48 -0.08 0.00 -1.03 0.00 0.00 54.13 52.69 3a2t s LEU 313 Cb -0.11 -0.94 0.03 0.00 0.03 0.00 0.00 46.19 45.20 3a2t s LEU 313 CO 0.03 0.16 0.24 0.68 0.23 0.00 0.00 176.35 177.69 3a2t s VAL 314 N -0.72 -0.01 -0.03 -1.59 -7.23 -0.86 -0.33 120.40 109.63 3a2t s VAL 314 Ca 0.07 0.02 -0.29 0.00 -1.81 0.00 0.00 61.98 59.98 3a2t s VAL 314 Cb -0.08 -0.34 0.10 0.00 0.56 0.00 0.00 36.38 36.62 3a2t s VAL 314 CO 0.01 0.01 0.86 -0.94 -0.31 0.00 0.00 175.10 174.73 3a2t s SER 315 N 0.31 -0.42 0.03 4.85 1.04 -0.67 -1.46 113.70 117.38 3a2t s SER 315 Ca -0.02 0.17 -0.02 0.00 0.48 0.00 0.00 55.95 56.56 3a2t s SER 315 Cb -0.03 0.41 -0.02 0.00 0.10 0.00 0.00 66.02 66.47 3a2t s SER 315 CO -0.01 -0.60 0.02 0.00 0.98 0.00 0.00 173.24 173.63 3a2t s ALA 316 N -2.52 0.15 -0.15 5.32 0.00 -0.14 -0.13 121.76 124.29 3a2t s ALA 316 Ca 0.01 -0.74 -0.11 0.00 0.00 0.00 0.00 51.96 51.12 3a2t s ALA 316 Cb -0.01 0.22 0.05 0.00 0.00 0.00 0.00 23.12 23.38 3a2t s ALA 316 CO -0.05 -0.28 0.38 0.20 0.00 0.00 0.00 175.76 176.01 3a2t s GLY 317 N -2.11 -0.29 -0.17 0.00 0.00 0.88 -1.94 107.32 103.70 3a2t s GLY 317 Ca -0.06 1.23 -0.01 0.00 0.00 0.00 0.00 44.72 45.88 3a2t s GLY 317 CO -0.05 1.22 -0.12 -0.98 0.00 0.00 0.00 173.10 173.17 3a2t s TRP 318 N 0.70 2.84 -0.04 1.90 0.51 -0.78 -1.99 118.94 122.09 3a2t s TRP 318 Ca -0.04 -0.91 0.02 0.00 -2.12 0.00 0.00 56.10 53.04 3a2t s TRP 318 Cb -0.05 -1.93 0.02 0.00 -0.81 0.00 0.00 33.47 30.69 3a2t s TRP 318 CO -0.05 -0.42 -0.06 -1.17 -0.51 0.00 0.00 176.95 174.74 3a2t s LEU 319 N 0.86 1.51 -0.07 2.99 2.96 0.16 -1.77 118.68 125.32 3a2t s LEU 319 Ca -0.03 -0.16 0.04 0.00 -0.22 0.00 0.00 54.13 53.76 3a2t s LEU 319 Cb -0.15 -0.50 -0.00 0.00 0.50 0.00 0.00 46.19 46.04 3a2t s LEU 319 CO 0.00 -0.01 -0.19 -0.54 -1.32 0.00 0.00 176.35 174.29 3a2t s LYS 320 N 0.66 2.24 -0.02 1.98 1.02 -0.25 0.95 119.74 126.32 3a2t s LYS 320 Ca -0.10 -0.69 0.07 0.00 0.02 0.00 0.00 55.97 55.27 3a2t s LYS 320 Cb -0.13 -1.83 -0.02 0.00 -0.52 0.00 0.00 37.83 35.34 3a2t s LYS 320 CO 0.01 0.21 -0.21 -0.65 -0.92 0.00 0.00 175.35 173.78 3a2t s GLN 321 N 0.21 1.76 3.22 1.68 -0.21 0.17 -1.32 119.66 125.17 3a2t s GLN 321 Ca -0.10 -0.77 0.00 0.00 0.02 0.00 0.00 55.36 54.51 3a2t s GLN 321 Cb -0.15 -1.69 0.00 0.00 1.00 0.00 0.00 33.01 32.17 3a2t s GLN 321 CO 0.05 0.45 0.00 0.41 -2.12 0.00 0.00 175.29 174.08 3a2t n GLY 322 N 2.58 -0.10 3.59 3.09 0.00 0.33 -1.50 105.19 113.17 3a2t n GLY 322 Ca -0.15 -1.01 -0.13 0.00 0.00 0.00 0.00 46.02 44.73 3a2t n GLY 322 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3a2t s LYS 323 N 0.00 0.76 4.93 1.61 2.20 -1.23 -4.79 119.74 123.21 3a2t s LYS 323 Ca 0.00 0.47 0.00 0.00 -0.36 0.00 0.00 55.97 56.08 3a2t s LYS 323 Cb 0.00 0.37 0.00 0.00 -1.51 0.00 0.00 37.83 36.69 3a2t s LYS 323 CO 0.00 -0.18 0.00 0.41 -0.36 0.00 0.00 175.35 175.22 3a2t n GLY 324 N 1.56 0.65 0.06 5.54 0.00 -1.26 -3.97 105.19 107.76 3a2t n GLY 324 Ca -0.14 -0.82 0.11 0.00 0.00 0.00 0.00 46.02 45.18 3a2t n GLY 324 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a2t n ALA 325 N 8.16 2.83 1.38 4.61 0.00 -1.26 -3.79 120.51 132.44 3a2t n ALA 325 Ca 0.00 -0.38 0.14 0.00 0.00 0.00 0.00 53.44 53.19 3a2t n ALA 325 Cb 0.00 -0.94 0.52 0.00 0.00 0.00 0.00 19.45 19.04 3a2t n ALA 325 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2t n GLY 326 N 1.25 -0.69 3.71 0.00 0.00 -1.25 -4.53 105.19 103.67 3a2t n GLY 326 Ca -0.01 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 3a2t n GLY 326 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3a2t n LYS 327 N -0.69 2.12 -4.31 1.61 4.81 -1.25 -4.85 118.16 115.59 3a2t n LYS 327 Ca 0.14 0.75 -0.22 0.00 -0.87 0.00 0.00 58.31 58.11 3a2t n LYS 327 Cb 0.31 -2.38 -0.16 0.00 0.02 0.00 0.00 35.03 32.81 3a2t n LYS 327 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3a2t s VAL 328 N -1.14 0.79 -0.10 3.15 1.01 -0.56 -4.29 120.40 119.27 3a2t s VAL 328 Ca 0.57 -0.27 0.04 0.00 0.00 0.00 0.00 61.98 62.32 3a2t s VAL 328 Cb -0.54 -0.77 -0.00 0.00 0.00 0.00 0.00 36.38 35.07 3a2t s VAL 328 CO 0.61 0.28 -0.22 -1.61 0.00 0.00 0.00 175.10 174.16 3a2t s GLU 329 N 0.86 3.05 -0.09 2.72 2.02 0.01 0.41 118.70 127.69 3a2t s GLU 329 Ca -0.12 -0.85 0.03 0.00 0.02 0.00 0.00 54.97 54.06 3a2t s GLU 329 Cb -0.15 -2.34 0.01 0.00 0.10 0.00 0.00 34.13 31.75 3a2t s GLU 329 CO 0.01 0.21 -0.19 -0.65 0.02 0.00 0.00 175.26 174.66 3a2t s GLN 330 N 0.28 2.44 -0.03 1.61 -0.21 0.27 0.29 119.66 124.32 3a2t s GLN 330 Ca -0.16 -0.67 0.04 0.00 0.02 0.00 0.00 55.36 54.59 3a2t s GLN 330 Cb -0.17 -1.90 -0.00 0.00 1.00 0.00 0.00 33.01 31.93 3a2t s GLN 330 CO 0.08 0.11 -0.15 0.95 -2.12 0.00 0.00 175.29 174.16 3a2t s THR 331 N 0.50 1.24 0.10 -0.19 -4.23 -1.09 0.36 115.64 112.33 3a2t s THR 331 Ca -0.17 -0.63 -0.21 0.00 -1.18 0.00 0.00 61.69 59.50 3a2t s THR 331 Cb -0.17 -1.06 0.05 0.00 1.34 0.00 0.00 72.50 72.67 3a2t s THR 331 CO 0.06 0.36 0.52 0.00 -0.54 0.00 0.00 174.62 175.02 3a2t s ALA 332 N -0.07 -1.32 0.01 3.99 0.00 -0.84 -2.18 121.76 121.36 3a2t s ALA 332 Ca -0.00 0.40 -0.14 0.00 0.00 0.00 0.00 51.96 52.21 3a2t s ALA 332 Cb -0.09 0.63 0.02 0.00 0.00 0.00 0.00 23.12 23.68 3a2t s ALA 332 CO 0.01 -0.63 0.30 -1.54 0.00 0.00 0.00 175.76 173.90 3a2t s SER 333 N -2.45 -0.15 0.12 0.00 1.04 -0.25 -0.09 113.70 111.93 3a2t s SER 333 Ca -0.01 -0.06 -0.12 0.00 0.48 0.00 0.00 55.95 56.24 3a2t s SER 333 Cb -0.00 0.33 0.01 0.00 0.10 0.00 0.00 66.02 66.46 3a2t s SER 333 CO -0.08 -0.52 0.30 0.00 0.98 0.00 0.00 173.24 173.92 3a2t s MET 334 N -1.92 1.02 -0.02 4.02 0.23 0.82 -0.33 119.30 123.11 3a2t s MET 334 Ca -0.09 -0.91 0.01 0.00 -1.03 0.00 0.00 55.69 53.67 3a2t s MET 334 Cb -0.03 0.41 0.01 0.00 -1.53 0.00 0.00 34.83 33.69 3a2t s MET 334 CO 0.01 -0.37 -0.02 0.54 -2.03 0.00 0.00 175.02 173.14 3a2t s VAL 335 N -3.86 0.28 0.00 5.16 0.11 -0.83 -1.67 120.40 119.58 3a2t s VAL 335 Ca 0.07 -0.05 0.00 0.00 -2.93 0.00 0.00 61.98 59.06 3a2t s VAL 335 Cb 0.03 -0.30 0.00 0.00 -1.53 0.00 0.00 36.38 34.58 3a2t s VAL 335 CO -0.09 0.13 0.00 0.61 -3.33 0.00 0.00 175.10 172.42 3a2t n GLY 336 N 3.60 2.03 2.93 6.54 0.00 0.55 -0.78 105.19 120.06 3a2t n GLY 336 Ca -0.20 -1.01 -0.11 0.00 0.00 0.00 0.00 46.02 44.70 3a2t n GLY 336 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3a2t s LEU 337 N 0.00 1.99 -0.08 0.99 2.96 0.91 -0.74 118.68 124.70 3a2t s LEU 337 Ca 0.00 -0.11 -0.01 0.00 -0.22 0.00 0.00 54.13 53.79 3a2t s LEU 337 Cb 0.00 0.11 0.03 0.00 0.50 0.00 0.00 46.19 46.82 3a2t s LEU 337 CO 0.00 -0.10 -0.04 -0.60 -1.32 0.00 0.00 176.35 174.29 3a2t s ARG 338 N -0.44 0.98 -0.18 1.98 3.52 -0.77 -1.82 118.95 122.22 3a2t s ARG 338 Ca -0.05 -0.06 0.01 0.00 -0.13 0.00 0.00 55.73 55.50 3a2t s ARG 338 Cb -0.03 -1.17 0.02 0.00 -1.56 0.00 0.00 34.95 32.21 3a2t s ARG 338 CO -0.00 -0.24 -0.18 -1.58 -0.81 0.00 0.00 175.30 172.48 3a2t s HIS 339 N 1.68 2.67 -0.16 5.12 2.46 -0.28 -1.39 115.29 125.39 3a2t s HIS 339 Ca 0.02 -1.60 -0.09 0.00 0.47 0.00 0.00 55.06 53.86 3a2t s HIS 339 Cb -0.13 -1.85 -0.05 0.00 -0.13 0.00 0.00 32.58 30.42 3a2t s HIS 339 CO -0.05 -0.78 0.15 0.15 -2.47 0.00 0.00 174.74 171.74 3a2t s LYS 340 N 1.32 3.92 0.00 2.88 1.02 -0.62 -0.78 119.74 127.49 3a2t s LYS 340 Ca 0.04 -0.15 0.00 0.00 0.02 0.00 0.00 55.97 55.88 3a2t s LYS 340 Cb -0.13 -3.33 0.00 0.00 -0.52 0.00 0.00 37.83 33.84 3a2t s LYS 340 CO -0.12 0.48 0.31 1.97 -0.92 0.00 0.00 175.35 177.06