#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ac4 s ARG 3 N 0.00 4.46 -0.02 4.33 0.52 -1.26 -4.99 118.95 121.99 2ac4 s ARG 3 Ca 0.00 1.19 -0.21 0.00 -0.52 0.00 0.00 55.73 56.19 2ac4 s ARG 3 Cb 0.00 -2.74 -0.05 0.00 0.52 0.00 0.00 34.95 32.68 2ac4 s ARG 3 CO 0.00 0.27 0.63 0.21 0.02 0.00 0.00 175.30 176.42 2ac4 s LYS 4 N -2.18 4.36 -0.12 3.54 2.20 -0.56 -4.83 119.74 122.15 2ac4 s LYS 4 Ca 0.50 0.78 -0.24 0.00 -0.36 0.00 0.00 55.97 56.65 2ac4 s LYS 4 Cb -0.17 -3.37 -0.03 0.00 -1.51 0.00 0.00 37.83 32.75 2ac4 s LYS 4 CO 0.22 0.29 0.73 0.21 -0.36 0.00 0.00 175.35 176.43 2ac4 s LYS 5 N 0.07 4.36 0.03 4.03 2.47 -1.26 -1.09 119.74 128.35 2ac4 s LYS 5 Ca 0.33 0.88 0.03 0.00 -1.56 0.00 0.00 55.97 55.64 2ac4 s LYS 5 Cb -0.18 -3.50 -0.02 0.00 -1.46 0.00 0.00 37.83 32.66 2ac4 s LYS 5 CO 0.18 -0.10 -0.08 -1.64 0.16 0.00 0.00 175.35 173.87 2ac4 s MET 6 N 1.36 0.56 0.19 4.03 -1.94 -0.86 -4.64 119.30 118.00 2ac4 s MET 6 Ca 0.36 -0.66 -0.12 0.00 -1.71 0.00 0.00 55.69 53.57 2ac4 s MET 6 Cb -0.17 -0.41 -0.07 0.00 2.01 0.00 0.00 34.83 36.19 2ac4 s MET 6 CO 0.15 0.09 0.55 0.20 -0.01 0.00 0.00 175.02 176.00 2ac4 s GLY 7 N -1.26 2.38 -0.32 -0.03 0.00 -0.32 -1.75 107.32 106.02 2ac4 s GLY 7 Ca -0.06 -0.19 -0.00 0.00 0.00 0.00 0.00 44.72 44.47 2ac4 s GLY 7 CO 0.00 0.03 0.03 -2.27 0.00 0.00 0.00 173.10 170.89 2ac4 s LEU 8 N -2.35 4.24 -0.42 0.66 2.96 0.63 -1.64 118.68 122.76 2ac4 s LEU 8 Ca 0.42 -1.60 -0.21 0.00 -0.22 0.00 0.00 54.13 52.53 2ac4 s LEU 8 Cb -0.13 -1.69 0.02 0.00 0.50 0.00 0.00 46.19 44.88 2ac4 s LEU 8 CO 0.20 -0.32 0.63 -0.22 -1.32 0.00 0.00 176.35 175.32 2ac4 s LEU 9 N 1.14 4.45 -0.35 -0.68 2.96 -0.15 -0.29 118.68 125.76 2ac4 s LEU 9 Ca -0.00 -0.24 -0.08 0.00 -0.22 0.00 0.00 54.13 53.59 2ac4 s LEU 9 Cb -0.20 -2.73 0.04 0.00 0.50 0.00 0.00 46.19 43.80 2ac4 s LEU 9 CO -0.04 -0.73 0.14 -0.69 -1.32 0.00 0.00 176.35 173.71 2ac4 s VAL 10 N 2.78 4.01 0.11 1.68 1.01 0.24 -1.30 120.40 128.92 2ac4 s VAL 10 Ca 0.23 -1.07 0.04 0.00 0.00 0.00 0.00 61.98 61.17 2ac4 s VAL 10 Cb -0.14 -3.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 2ac4 s VAL 10 CO 0.18 -0.21 0.11 -0.04 0.00 0.00 0.00 175.10 175.14 2ac4 s MET 11 N 1.44 2.91 0.29 2.72 -1.94 -0.83 -1.40 119.30 122.49 2ac4 s MET 11 Ca -0.01 -0.75 -0.20 0.00 -1.71 0.00 0.00 55.69 53.03 2ac4 s MET 11 Cb -0.20 -2.71 0.02 0.00 2.01 0.00 0.00 34.83 33.96 2ac4 s MET 11 CO 0.04 0.54 0.71 0.00 -0.01 0.00 0.00 175.02 176.29 2ac4 s ALA 12 N -1.53 -1.08 0.13 3.03 0.00 -0.94 -0.54 121.76 120.84 2ac4 s ALA 12 Ca 0.30 -0.41 -0.19 0.00 0.00 0.00 0.00 51.96 51.66 2ac4 s ALA 12 Cb -0.11 0.85 -0.04 0.00 0.00 0.00 0.00 23.12 23.81 2ac4 s ALA 12 CO 0.23 -1.02 1.79 -0.92 0.00 0.00 0.00 175.76 175.84 2ac4 h TYR 13 N 2.02 0.32 0.00 0.00 3.20 -1.90 -1.59 116.97 119.02 2ac4 h TYR 13 Ca -0.21 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.67 2ac4 h TYR 13 Cb 1.25 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 39.41 2ac4 h TYR 13 CO 0.56 0.20 0.00 0.41 -1.64 0.00 0.00 178.16 177.68 2ac4 n GLY 14 N -1.17 2.51 3.16 1.82 0.00 -1.26 -1.38 105.19 108.87 2ac4 n GLY 14 Ca -0.02 -1.88 -0.11 0.00 0.00 0.00 0.00 46.02 44.01 2ac4 n GLY 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ac4 s THR 15 N -2.77 0.10 0.73 2.61 -4.23 -1.26 -4.90 115.64 105.92 2ac4 s THR 15 Ca 0.00 -0.83 -0.13 0.00 -1.18 0.00 0.00 61.69 59.55 2ac4 s THR 15 Cb 0.00 -0.77 0.04 0.00 1.34 0.00 0.00 72.50 73.11 2ac4 s THR 15 CO 0.00 -0.46 1.13 -2.16 -0.54 0.00 0.00 174.62 172.59 2ac4 s PRO 16 N -2.18 2.34 -0.05 3.99 0.04 -1.26 -4.82 135.00 133.06 2ac4 s PRO 16 Ca -0.08 1.43 0.18 0.00 0.04 0.00 0.00 61.00 62.56 2ac4 s PRO 16 Cb -0.03 -1.89 -0.21 0.00 0.04 0.00 0.00 34.50 32.41 2ac4 s PRO 16 CO -0.02 -1.62 0.52 0.66 0.04 0.00 0.00 177.00 176.58 2ac4 n TYR 17 N -2.95 0.53 -3.94 0.56 4.01 -1.26 -4.41 117.16 109.69 2ac4 n TYR 17 Ca 0.11 0.18 -0.09 0.00 -0.16 0.00 0.00 57.90 57.93 2ac4 n TYR 17 Cb 0.52 -0.98 -0.05 0.00 -0.31 0.00 0.00 39.34 38.52 2ac4 n TYR 17 CO 0.00 0.00 0.00 -1.59 -0.46 0.00 0.00 176.86 174.81 2ac4 s LYS 18 N -2.85 1.42 0.36 -0.72 -2.85 -1.26 -4.10 119.74 109.73 2ac4 s LYS 18 Ca -0.06 -1.16 0.08 0.00 -1.00 0.00 0.00 55.97 53.82 2ac4 s LYS 18 Cb 0.09 0.45 0.79 0.00 -2.06 0.00 0.00 37.83 37.10 2ac4 s LYS 18 CO 0.83 -0.58 1.92 1.49 0.10 0.00 0.00 175.35 179.12 2ac4 h GLU 19 N 2.32 0.70 0.00 1.78 4.81 -1.99 -0.93 114.58 121.26 2ac4 h GLU 19 Ca -0.28 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 2ac4 h GLU 19 Cb 1.25 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.47 2ac4 h GLU 19 CO 0.39 0.46 0.00 0.39 -0.73 0.00 0.00 179.01 179.52 2ac4 n GLU 20 N -4.51 0.04 0.09 1.92 4.71 -1.26 -2.50 120.64 119.12 2ac4 n GLU 20 Ca 0.14 0.27 0.11 0.00 -0.01 0.00 0.00 57.16 57.66 2ac4 n GLU 20 Cb 0.35 -1.50 -0.02 0.00 -1.01 0.00 0.00 31.44 29.25 2ac4 n GLU 20 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2ac4 n ASP 21 N -1.45 0.77 -0.27 1.62 8.00 -0.35 -4.42 116.55 120.44 2ac4 n ASP 21 Ca 0.03 0.30 0.08 0.00 0.71 0.00 0.00 54.79 55.92 2ac4 n ASP 21 Cb 0.13 0.57 0.22 0.00 -0.02 0.00 0.00 41.12 42.01 2ac4 n ASP 21 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2ac4 h ILE 22 N 0.00 0.35 0.37 0.53 2.04 -1.58 -0.45 117.51 118.76 2ac4 h ILE 22 Ca -0.01 -0.06 -0.00 0.00 1.00 0.00 0.00 64.86 65.78 2ac4 h ILE 22 Cb 1.05 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 2ac4 h ILE 22 CO 0.00 0.03 -0.46 -0.08 0.00 0.00 0.00 178.15 177.64 2ac4 h GLU 23 N 0.17 -0.84 -0.04 2.37 4.81 -1.81 -1.15 114.58 118.09 2ac4 h GLU 23 Ca 0.47 0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.68 2ac4 h GLU 23 Cb 0.88 0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 2ac4 h GLU 23 CO -0.65 -0.56 -0.34 0.07 -0.73 0.00 0.00 179.01 176.81 2ac4 h ARG 24 N -0.87 0.07 0.17 1.92 0.11 -1.74 -1.03 114.38 113.00 2ac4 h ARG 24 Ca -0.03 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 60.01 2ac4 h ARG 24 Cb 0.79 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.87 2ac4 h ARG 24 CO -0.12 0.40 -0.08 -0.92 0.10 0.00 0.00 179.97 179.35 2ac4 h TYR 25 N 0.06 -0.21 0.00 4.08 3.20 -0.84 -1.67 116.97 121.60 2ac4 h TYR 25 Ca 0.01 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.76 2ac4 h TYR 25 Cb 0.63 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.95 2ac4 h TYR 25 CO 0.00 -0.02 -0.51 1.88 -1.64 0.00 0.00 178.16 177.87 2ac4 h TYR 26 N -0.37 0.00 -0.54 -3.82 0.05 -1.11 -2.01 116.97 109.17 2ac4 h TYR 26 Ca -0.02 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.71 2ac4 h TYR 26 Cb 0.29 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.00 2ac4 h TYR 26 CO -0.02 0.51 0.17 1.15 -1.05 0.00 0.00 178.16 178.92 2ac4 h THR 27 N 0.00 1.23 -0.52 -2.88 2.02 -1.10 0.44 112.91 112.12 2ac4 h THR 27 Ca -0.01 -0.79 -0.08 0.00 0.77 0.00 0.00 66.41 66.31 2ac4 h THR 27 Cb 1.08 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 68.19 2ac4 h THR 27 CO 0.07 0.29 0.00 -0.74 0.37 0.00 0.00 175.52 175.51 2ac4 h HIS 28 N 0.75 0.93 -0.09 3.16 -0.00 -1.10 0.59 115.15 119.40 2ac4 h HIS 28 Ca 0.18 -0.14 -0.15 0.00 -0.00 0.00 0.00 60.37 60.26 2ac4 h HIS 28 Cb 0.27 -0.25 -0.01 0.00 -0.00 0.00 0.00 27.41 27.42 2ac4 h HIS 28 CO 0.02 0.85 -0.59 0.82 -0.00 0.00 0.00 177.93 179.02 2ac4 h ILE 29 N 0.81 1.37 -0.22 6.26 2.04 -0.81 -2.62 117.51 124.34 2ac4 h ILE 29 Ca 0.15 -1.93 0.00 0.00 1.00 0.00 0.00 64.86 64.08 2ac4 h ILE 29 Cb 0.48 1.95 0.00 0.00 -0.74 0.00 0.00 36.82 38.51 2ac4 h ILE 29 CO 0.02 0.58 0.00 0.54 0.00 0.00 0.00 178.15 179.29 2ac4 n ARG 30 N -3.89 2.23 -3.78 2.37 1.74 0.15 -4.90 116.66 110.57 2ac4 n ARG 30 Ca -0.03 -1.09 -0.23 0.00 -0.77 0.00 0.00 57.85 55.73 2ac4 n ARG 30 Cb 0.61 -1.65 0.02 0.00 -1.02 0.00 0.00 32.46 30.42 2ac4 n ARG 30 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2ac4 n ARG 31 N 0.24 -4.49 0.00 5.56 1.74 -0.80 -2.46 116.66 116.45 2ac4 n ARG 31 Ca 0.10 0.56 0.00 0.00 -0.77 0.00 0.00 57.85 57.74 2ac4 n ARG 31 Cb 0.51 -5.02 0.00 0.00 -1.02 0.00 0.00 32.46 26.93 2ac4 n ARG 31 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ac4 n GLY 32 N -1.69 0.78 3.43 -0.13 0.00 0.13 -5.03 105.19 102.69 2ac4 n GLY 32 Ca -0.29 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.29 2ac4 n GLY 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ac4 s ARG 33 N -0.80 3.11 0.13 1.61 3.00 -1.03 -5.01 118.95 119.97 2ac4 s ARG 33 Ca 0.00 -0.97 -0.31 0.00 0.00 0.00 0.00 55.73 54.45 2ac4 s ARG 33 Cb 0.00 -4.19 -0.10 0.00 0.00 0.00 0.00 34.95 30.66 2ac4 s ARG 33 CO 0.00 -1.54 1.70 0.21 0.00 0.00 0.00 175.30 175.67 2ac4 s LYS 34 N 3.20 4.17 0.49 3.54 2.20 -1.26 -4.55 119.74 127.52 2ac4 s LYS 34 Ca 0.17 2.46 -0.23 0.00 -0.36 0.00 0.00 55.97 58.02 2ac4 s LYS 34 Cb -0.20 -3.41 -0.08 0.00 -1.51 0.00 0.00 37.83 32.63 2ac4 s LYS 34 CO 0.10 -0.74 1.18 -2.30 -0.36 0.00 0.00 175.35 173.23 2ac4 n PRO 35 N 5.00 1.55 -1.11 4.03 -0.02 -1.26 -4.96 135.00 138.22 2ac4 n PRO 35 Ca 0.16 0.56 -0.30 0.00 -2.02 0.00 0.00 63.50 61.90 2ac4 n PRO 35 Cb 0.38 -2.32 0.13 0.00 -0.02 0.00 0.00 33.50 31.68 2ac4 n PRO 35 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2ac4 s GLU 36 N -2.45 1.39 0.16 -0.52 0.41 -1.26 -4.74 118.70 111.69 2ac4 s GLU 36 Ca 0.67 1.02 -0.18 0.00 -0.41 0.00 0.00 54.97 56.07 2ac4 s GLU 36 Cb -0.47 -1.81 0.08 0.00 -1.78 0.00 0.00 34.13 30.15 2ac4 s GLU 36 CO 0.53 -2.21 1.66 -1.35 -0.49 0.00 0.00 175.26 173.41 2ac4 h PRO 37 N -1.53 -0.05 -0.75 0.39 0.11 -1.99 -1.08 132.00 127.11 2ac4 h PRO 37 Ca -0.48 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.72 2ac4 h PRO 37 Cb 1.27 0.01 -0.07 0.00 0.11 0.00 0.00 31.00 32.32 2ac4 h PRO 37 CO 0.52 -0.03 0.41 0.93 -0.21 0.00 0.00 178.00 179.62 2ac4 h GLU 38 N -0.05 0.69 -0.41 1.05 4.39 -1.99 -0.34 114.58 117.93 2ac4 h GLU 38 Ca 0.18 -0.04 -0.06 0.00 0.34 0.00 0.00 59.36 59.77 2ac4 h GLU 38 Cb 0.32 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.80 2ac4 h GLU 38 CO -0.40 0.46 0.01 1.98 -1.16 0.00 0.00 179.01 179.90 2ac4 h MET 39 N 0.72 0.71 -0.56 2.33 4.05 -1.79 -0.84 114.93 119.55 2ac4 h MET 39 Ca 0.35 -0.22 0.09 0.00 -0.28 0.00 0.00 59.70 59.64 2ac4 h MET 39 Cb 0.30 -0.07 -0.07 0.00 -0.80 0.00 0.00 31.60 30.96 2ac4 h MET 39 CO -0.23 0.79 0.19 1.25 0.23 0.00 0.00 176.91 179.14 2ac4 h LEU 40 N 0.55 0.16 -0.44 3.39 5.85 -0.38 0.20 115.31 124.63 2ac4 h LEU 40 Ca 0.12 0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.84 2ac4 h LEU 40 Cb 0.47 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 2ac4 h LEU 40 CO 0.02 0.11 -0.00 -0.61 -0.34 0.00 0.00 178.44 177.61 2ac4 h GLN 41 N 0.35 0.78 -0.47 1.25 5.75 -0.86 -1.80 115.11 120.11 2ac4 h GLN 41 Ca 0.28 -0.25 0.04 0.00 -0.15 0.00 0.00 58.65 58.57 2ac4 h GLN 41 Cb 0.34 -0.07 -0.04 0.00 1.07 0.00 0.00 27.48 28.79 2ac4 h GLN 41 CO -0.30 0.85 0.24 0.22 -2.65 0.00 0.00 178.83 177.19 2ac4 h ASP 42 N 0.62 0.36 0.06 -0.69 3.58 -0.17 -1.12 116.42 119.06 2ac4 h ASP 42 Ca 0.12 0.02 0.01 0.00 0.42 0.00 0.00 57.03 57.61 2ac4 h ASP 42 Cb 0.50 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.48 2ac4 h ASP 42 CO 0.02 0.25 -0.12 -0.07 -2.88 0.00 0.00 179.24 176.45 2ac4 h LEU 43 N 0.48 -0.33 -0.43 2.28 3.38 -0.43 -0.61 115.31 119.66 2ac4 h LEU 43 Ca 0.20 0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.30 2ac4 h LEU 43 Cb 0.10 0.13 -0.08 0.00 0.09 0.00 0.00 40.66 40.90 2ac4 h LEU 43 CO -0.13 -0.17 -0.06 0.11 0.09 0.00 0.00 178.44 178.27 2ac4 h LYS 44 N -0.23 0.04 -0.94 1.13 1.57 -0.98 -1.00 116.57 116.16 2ac4 h LYS 44 Ca 0.02 -0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.86 2ac4 h LYS 44 Cb 0.25 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.49 2ac4 h LYS 44 CO -0.08 0.03 0.60 -0.44 -0.57 0.00 0.00 179.45 178.99 2ac4 h ASP 45 N 0.04 0.97 -0.06 0.86 3.32 -0.73 -1.47 116.42 119.35 2ac4 h ASP 45 Ca 0.21 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 2ac4 h ASP 45 Cb 0.31 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.66 2ac4 h ASP 45 CO -0.41 0.64 0.04 0.03 -1.72 0.00 0.00 179.24 177.82 2ac4 h ARG 46 N 1.12 0.08 -0.74 3.56 3.08 0.14 -0.46 114.38 121.16 2ac4 h ARG 46 Ca 0.39 -0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.45 2ac4 h ARG 46 Cb 0.11 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.10 2ac4 h ARG 46 CO -0.15 0.11 0.49 1.88 -1.07 0.00 0.00 179.97 181.22 2ac4 h TYR 47 N 0.04 0.93 -0.63 3.04 0.05 -0.93 -2.01 116.97 117.45 2ac4 h TYR 47 Ca 0.02 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.83 2ac4 h TYR 47 Cb 0.05 -0.31 -0.03 0.00 1.01 0.00 0.00 36.73 37.44 2ac4 h TYR 47 CO -0.06 0.58 0.41 1.49 -1.05 0.00 0.00 178.16 179.54 2ac4 h GLU 48 N 1.00 0.84 -0.11 4.88 4.81 -1.04 -1.52 114.58 123.43 2ac4 h GLU 48 Ca 0.27 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.42 2ac4 h GLU 48 Cb -0.11 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.08 2ac4 h GLU 48 CO -0.06 0.57 -0.03 0.00 -0.73 0.00 0.00 179.01 178.75 2ac4 h ALA 49 N 1.22 1.74 -0.30 2.92 0.00 -0.47 -2.12 119.26 122.26 2ac4 h ALA 49 Ca 0.23 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2ac4 h ALA 49 Cb -0.08 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2ac4 h ALA 49 CO -0.05 0.20 0.00 0.44 0.00 0.00 0.00 179.25 179.84 2ac4 n ILE 50 N -4.40 0.42 0.00 0.00 -5.35 -0.81 -4.88 119.36 104.33 2ac4 n ILE 50 Ca -0.01 -0.40 0.00 0.00 -0.27 0.00 0.00 62.75 62.06 2ac4 n ILE 50 Cb 0.17 0.18 0.00 0.00 -1.74 0.00 0.00 39.64 38.25 2ac4 n ILE 50 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ac4 n GLY 51 N 0.96 1.06 0.00 3.28 0.00 -0.80 -5.02 105.19 104.67 2ac4 n GLY 51 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2ac4 n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ac4 n GLY 52 N -1.53 2.27 0.11 -0.02 0.00 -0.62 -4.91 105.19 100.48 2ac4 n GLY 52 Ca 0.00 -1.92 -0.21 0.00 0.00 0.00 0.00 46.02 43.89 2ac4 n GLY 52 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2ac4 h ILE 53 N 0.00 1.01 -1.22 -0.61 2.04 -1.93 -3.41 117.51 113.40 2ac4 h ILE 53 Ca 0.00 -2.28 0.40 0.00 1.00 0.00 0.00 64.86 63.99 2ac4 h ILE 53 Cb 0.00 2.52 -0.13 0.00 -0.74 0.00 0.00 36.82 38.47 2ac4 h ILE 53 CO 0.00 0.52 0.76 0.77 0.00 0.00 0.00 178.15 180.20 2ac4 h SER 54 N -0.69 0.31 0.01 1.72 4.64 -1.87 0.39 113.55 118.06 2ac4 h SER 54 Ca -0.31 0.15 -0.08 0.00 -0.47 0.00 0.00 61.79 61.09 2ac4 h SER 54 Cb 1.48 0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 63.69 2ac4 h SER 54 CO -0.08 -0.18 -0.21 -0.65 -0.87 0.00 0.00 176.83 174.84 2ac4 h PRO 55 N 0.13 0.35 0.12 4.77 0.11 -1.91 -3.26 132.00 132.31 2ac4 h PRO 55 Ca 0.79 -0.11 0.01 0.00 0.11 0.00 0.00 66.00 66.80 2ac4 h PRO 55 Cb 2.33 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 33.38 2ac4 h PRO 55 CO -0.47 0.55 -0.36 -0.07 -0.21 0.00 0.00 178.00 177.44 2ac4 h LEU 56 N 0.32 -1.06 -1.88 2.35 -0.00 -1.18 -2.66 115.31 111.20 2ac4 h LEU 56 Ca 0.05 0.11 -0.02 0.00 -0.00 0.00 0.00 57.88 58.03 2ac4 h LEU 56 Cb 0.55 0.39 -0.00 0.00 -0.00 0.00 0.00 40.66 41.60 2ac4 h LEU 56 CO 0.04 -0.39 -0.07 0.00 -0.00 0.00 0.00 178.44 178.02 2ac4 h ALA 57 N -0.92 1.84 -0.45 1.53 0.00 -1.69 -2.09 119.26 117.48 2ac4 h ALA 57 Ca -0.01 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2ac4 h ALA 57 Cb 0.52 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2ac4 h ALA 57 CO -0.17 0.09 0.27 0.37 0.00 0.00 0.00 179.25 179.81 2ac4 h GLN 58 N 0.00 0.60 -0.11 0.00 5.75 -1.52 -2.98 115.11 116.85 2ac4 h GLN 58 Ca -0.00 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.46 2ac4 h GLN 58 Cb 0.13 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 2ac4 h GLN 58 CO 0.01 0.42 0.06 0.82 -2.65 0.00 0.00 178.83 177.49 2ac4 h ILE 59 N 0.61 1.01 -0.92 2.39 2.04 -1.14 -0.54 117.51 120.96 2ac4 h ILE 59 Ca 0.16 -0.04 0.03 0.00 1.00 0.00 0.00 64.86 66.00 2ac4 h ILE 59 Cb -0.02 0.87 -0.05 0.00 -0.74 0.00 0.00 36.82 36.87 2ac4 h ILE 59 CO -0.03 0.02 0.61 0.74 0.00 0.00 0.00 178.15 179.49 2ac4 h THR 60 N 0.13 1.19 -0.71 -0.27 2.02 -1.65 0.85 112.91 114.46 2ac4 h THR 60 Ca 0.04 -0.41 -0.05 0.00 0.77 0.00 0.00 66.41 66.76 2ac4 h THR 60 Cb 0.00 -0.12 -0.03 0.00 -1.74 0.00 0.00 68.15 66.26 2ac4 h THR 60 CO -0.03 0.22 0.25 -0.08 0.37 0.00 0.00 175.52 176.25 2ac4 h GLU 61 N 1.20 1.08 -0.55 6.66 4.57 -1.42 -0.50 114.58 125.62 2ac4 h GLU 61 Ca 0.36 -0.22 -0.09 0.00 -1.18 0.00 0.00 59.36 58.23 2ac4 h GLU 61 Cb -0.05 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.35 2ac4 h GLU 61 CO -0.10 0.92 -0.01 0.37 -1.18 0.00 0.00 179.01 179.00 2ac4 h GLN 62 N 1.03 0.98 -0.32 1.92 5.75 -0.18 -1.62 115.11 122.67 2ac4 h GLN 62 Ca 0.23 -0.32 -0.01 0.00 -0.15 0.00 0.00 58.65 58.40 2ac4 h GLN 62 Cb 0.26 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.71 2ac4 h GLN 62 CO -0.01 0.99 0.15 1.96 -2.65 0.00 0.00 178.83 179.26 2ac4 h GLN 63 N 0.86 0.47 -0.44 1.69 4.20 -0.51 -0.42 115.11 120.96 2ac4 h GLN 63 Ca 0.15 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 2ac4 h GLN 63 Cb 0.55 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 2ac4 h GLN 63 CO 0.03 0.45 0.22 0.00 -0.67 0.00 0.00 178.83 178.86 2ac4 h ALA 64 N 1.00 0.57 -0.17 3.87 0.00 -0.96 -1.90 119.26 121.67 2ac4 h ALA 64 Ca 0.11 -0.11 -0.20 0.00 0.00 0.00 0.00 54.91 54.72 2ac4 h ALA 64 Cb 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2ac4 h ALA 64 CO -0.01 0.12 -0.68 0.45 0.00 0.00 0.00 179.25 179.13 2ac4 h HIS 65 N 0.57 0.90 -0.44 0.00 3.86 -1.17 -1.58 115.15 117.29 2ac4 h HIS 65 Ca 0.15 -0.37 -0.11 0.00 -1.16 0.00 0.00 60.37 58.89 2ac4 h HIS 65 Cb 0.11 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.41 2ac4 h HIS 65 CO -0.01 1.16 -0.15 -0.91 0.86 0.00 0.00 177.93 178.88 2ac4 h ASN 66 N 0.49 0.83 -0.29 2.45 4.21 -1.09 -1.31 115.58 120.88 2ac4 h ASN 66 Ca -0.02 -0.27 -0.01 0.00 1.21 0.00 0.00 56.30 57.21 2ac4 h ASN 66 Cb 1.27 -0.23 -0.01 0.00 -1.12 0.00 0.00 38.32 38.23 2ac4 h ASN 66 CO 0.13 0.98 0.16 0.25 -1.29 0.00 0.00 177.43 177.67 2ac4 h LEU 67 N 0.74 0.36 -0.01 1.61 5.85 -1.27 0.26 115.31 122.86 2ac4 h LEU 67 Ca 0.12 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.76 2ac4 h LEU 67 Cb 0.66 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 2ac4 h LEU 67 CO 0.05 0.35 -0.10 -0.08 -0.34 0.00 0.00 178.44 178.31 2ac4 h GLU 68 N 0.35 -0.17 -0.49 1.25 4.81 -1.06 0.10 114.58 119.37 2ac4 h GLU 68 Ca 0.10 0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.25 2ac4 h GLU 68 Cb 0.07 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 2ac4 h GLU 68 CO -0.02 -0.11 -0.08 0.37 -0.73 0.00 0.00 179.01 178.44 2ac4 h GLN 69 N -0.17 0.88 -0.37 1.92 4.15 -1.06 -2.23 115.11 118.23 2ac4 h GLN 69 Ca 0.04 -0.29 -0.08 0.00 0.77 0.00 0.00 58.65 59.09 2ac4 h GLN 69 Cb 0.23 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.83 2ac4 h GLN 69 CO -0.11 0.93 -0.08 1.25 -1.93 0.00 0.00 178.83 178.89 2ac4 h HIS 70 N 0.80 0.80 -0.83 3.99 2.76 -0.19 -2.02 115.15 120.46 2ac4 h HIS 70 Ca 0.14 -0.17 -0.03 0.00 -2.20 0.00 0.00 60.37 58.11 2ac4 h HIS 70 Cb 0.59 -0.20 -0.04 0.00 1.55 0.00 0.00 27.41 29.32 2ac4 h HIS 70 CO 0.03 0.85 0.41 -0.07 -1.30 0.00 0.00 177.93 177.86 2ac4 h LEU 71 N 0.51 1.07 -1.78 0.26 3.38 -0.93 -1.62 115.31 116.20 2ac4 h LEU 71 Ca 0.10 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2ac4 h LEU 71 Cb 0.59 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2ac4 h LEU 71 CO 0.03 0.89 0.00 0.78 0.09 0.00 0.00 178.44 180.24 2ac4 h ASN 72 N 1.17 0.00 0.30 -0.43 2.35 -1.20 -3.11 115.58 114.66 2ac4 h ASN 72 Ca 0.29 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 55.71 2ac4 h ASN 72 Cb 0.10 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.41 2ac4 h ASN 72 CO -0.04 0.00 -1.96 1.21 -1.65 0.00 0.00 177.43 174.99 2ac4 n GLU 73 N -2.99 0.66 0.00 0.81 2.13 -0.75 -4.46 120.64 116.03 2ac4 n GLU 73 Ca -0.00 0.20 0.13 0.00 0.66 0.00 0.00 57.16 58.14 2ac4 n GLU 73 Cb 0.23 -1.70 0.37 0.00 0.27 0.00 0.00 31.44 30.61 2ac4 n GLU 73 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 2ac4 n ILE 74 N -3.00 0.00 -4.01 6.31 -5.35 -0.68 -4.88 119.36 107.75 2ac4 n ILE 74 Ca -0.24 -0.03 -0.08 0.00 -0.27 0.00 0.00 62.75 62.13 2ac4 n ILE 74 Cb 1.08 0.14 -0.09 0.00 -1.74 0.00 0.00 39.64 39.02 2ac4 n ILE 74 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2ac4 s GLN 75 N -2.84 0.66 -0.07 6.28 1.03 -1.21 -5.08 119.66 118.42 2ac4 s GLN 75 Ca 0.16 -1.09 0.11 0.00 0.04 0.00 0.00 55.36 54.57 2ac4 s GLN 75 Cb 0.18 0.24 0.16 0.00 0.03 0.00 0.00 33.01 33.63 2ac4 s GLN 75 CO 0.62 -0.15 1.06 -0.25 -2.54 0.00 0.00 175.29 174.02 2ac4 n ASP 76 N 0.17 1.85 -0.06 12.60 8.00 -1.26 -4.72 116.55 133.13 2ac4 n ASP 76 Ca -0.15 -2.56 -0.15 0.00 0.71 0.00 0.00 54.79 52.64 2ac4 n ASP 76 Cb 0.61 -0.27 -0.14 0.00 -0.02 0.00 0.00 41.12 41.30 2ac4 n ASP 76 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2ac4 n GLU 77 N -0.94 0.69 -4.87 -1.24 1.02 -1.26 -4.78 120.64 109.26 2ac4 n GLU 77 Ca 0.09 0.18 -0.30 0.00 -0.02 0.00 0.00 57.16 57.11 2ac4 n GLU 77 Cb 0.54 -1.64 -0.14 0.00 -0.02 0.00 0.00 31.44 30.17 2ac4 n GLU 77 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2ac4 s ILE 78 N -2.54 2.23 -0.29 -3.67 1.01 -1.26 -1.50 121.20 115.18 2ac4 s ILE 78 Ca -0.19 -1.37 -0.02 0.00 0.00 0.00 0.00 60.65 59.08 2ac4 s ILE 78 Cb 0.07 -1.88 0.04 0.00 0.01 0.00 0.00 42.46 40.71 2ac4 s ILE 78 CO 0.75 0.36 -0.02 0.28 0.00 0.00 0.00 174.94 176.32 2ac4 s THR 79 N -0.82 2.96 0.11 2.92 -1.32 -0.25 -4.73 115.64 114.51 2ac4 s THR 79 Ca 0.12 -1.30 -0.14 0.00 -1.21 0.00 0.00 61.69 59.16 2ac4 s THR 79 Cb -0.10 -2.66 -0.07 0.00 -1.51 0.00 0.00 72.50 68.17 2ac4 s THR 79 CO 0.02 -0.03 0.51 -0.36 -2.21 0.00 0.00 174.62 172.55 2ac4 s PHE 80 N 1.27 3.63 -0.18 9.09 0.08 -1.26 -2.02 117.98 128.59 2ac4 s PHE 80 Ca -0.04 1.02 0.00 0.00 0.12 0.00 0.00 56.93 58.03 2ac4 s PHE 80 Cb -0.19 -2.33 0.04 0.00 -0.57 0.00 0.00 43.02 39.97 2ac4 s PHE 80 CO -0.02 0.48 -0.10 0.21 -0.10 0.00 0.00 175.22 175.69 2ac4 s LYS 81 N -1.81 1.90 0.41 0.44 2.47 -0.72 -4.92 119.74 117.51 2ac4 s LYS 81 Ca 0.35 -0.68 -0.24 0.00 -1.56 0.00 0.00 55.97 53.85 2ac4 s LYS 81 Cb -0.15 -2.21 -0.09 0.00 -1.46 0.00 0.00 37.83 33.92 2ac4 s LYS 81 CO 0.18 -0.39 1.06 0.00 0.16 0.00 0.00 175.35 176.36 2ac4 s ALA 82 N 1.49 3.07 -0.08 3.13 0.00 -1.26 -0.27 121.76 127.84 2ac4 s ALA 82 Ca 0.01 0.71 -0.03 0.00 0.00 0.00 0.00 51.96 52.64 2ac4 s ALA 82 Cb -0.15 -3.28 0.04 0.00 0.00 0.00 0.00 23.12 19.74 2ac4 s ALA 82 CO -0.09 -0.25 0.17 0.71 0.00 0.00 0.00 175.76 176.31 2ac4 s TYR 83 N -1.67 -0.20 -0.18 0.00 1.51 0.60 -4.86 117.35 112.53 2ac4 s TYR 83 Ca 0.59 0.59 -0.14 0.00 -1.01 0.00 0.00 57.07 57.09 2ac4 s TYR 83 Cb -0.22 -0.12 -0.04 0.00 -0.11 0.00 0.00 41.96 41.46 2ac4 s TYR 83 CO 0.27 -0.22 0.32 0.42 -1.11 0.00 0.00 175.55 175.24 2ac4 s ILE 84 N 1.61 5.27 -0.17 2.71 1.01 -1.26 -0.60 121.20 129.78 2ac4 s ILE 84 Ca -0.05 0.58 0.01 0.00 0.00 0.00 0.00 60.65 61.19 2ac4 s ILE 84 Cb -0.12 -3.66 0.03 0.00 0.01 0.00 0.00 42.46 38.72 2ac4 s ILE 84 CO -0.06 0.33 -0.13 -0.83 0.00 0.00 0.00 174.94 174.25 2ac4 s GLY 85 N 0.75 1.19 0.27 6.18 0.00 -0.49 -4.51 107.32 110.71 2ac4 s GLY 85 Ca 0.17 -1.03 0.07 0.00 0.00 0.00 0.00 44.72 43.93 2ac4 s GLY 85 CO 0.06 0.57 0.19 1.08 0.00 0.00 0.00 173.10 175.01 2ac4 s LEU 86 N 1.44 3.69 -0.15 0.66 1.43 0.98 -2.21 118.68 124.52 2ac4 s LEU 86 Ca 0.03 -0.36 -0.11 0.00 -1.03 0.00 0.00 54.13 52.66 2ac4 s LEU 86 Cb -0.14 -2.24 -0.24 0.00 0.03 0.00 0.00 46.19 43.60 2ac4 s LEU 86 CO -0.10 -0.11 0.31 1.17 0.23 0.00 0.00 176.35 177.85 2ac4 n LYS 87 N -1.19 0.70 -0.20 1.70 3.00 -0.60 -1.95 118.16 119.63 2ac4 n LYS 87 Ca -0.06 0.35 0.07 0.00 -0.00 0.00 0.00 58.31 58.66 2ac4 n LYS 87 Cb 0.58 -1.72 0.17 0.00 0.00 0.00 0.00 35.03 34.07 2ac4 n LYS 87 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 2ac4 n HIS 88 N -3.76 0.52 -3.51 5.64 8.25 -0.48 -4.95 115.22 116.92 2ac4 n HIS 88 Ca -0.32 -0.47 -0.12 0.00 -0.26 0.00 0.00 57.72 56.55 2ac4 n HIS 88 Cb 0.94 -0.02 -0.04 0.00 1.12 0.00 0.00 29.99 31.99 2ac4 n HIS 88 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 2ac4 s ILE 89 N -1.01 0.00 0.55 1.59 2.07 -1.26 -4.69 121.20 118.45 2ac4 s ILE 89 Ca 0.27 0.00 -0.19 0.00 -1.41 0.00 0.00 60.65 59.32 2ac4 s ILE 89 Cb 0.14 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.68 2ac4 s ILE 89 CO 0.19 0.00 1.10 -1.83 -1.91 0.00 0.00 174.94 172.49 2ac4 s GLU 90 N -2.32 3.36 -0.03 3.50 1.03 -1.26 -3.69 118.70 119.29 2ac4 s GLU 90 Ca -0.01 1.49 -0.30 0.00 0.03 0.00 0.00 54.97 56.18 2ac4 s GLU 90 Cb -0.01 -2.02 -0.04 0.00 -0.80 0.00 0.00 34.13 31.26 2ac4 s GLU 90 CO -0.03 -0.82 1.30 -1.25 -1.33 0.00 0.00 175.26 173.13 2ac4 s PRO 91 N -3.47 4.31 0.77 -4.83 0.04 -1.26 -4.97 135.00 125.59 2ac4 s PRO 91 Ca 0.70 1.82 -0.11 0.00 0.04 0.00 0.00 61.00 63.44 2ac4 s PRO 91 Cb -0.21 -3.57 0.05 0.00 0.04 0.00 0.00 34.50 30.81 2ac4 s PRO 91 CO 0.29 -0.52 1.09 -0.06 0.04 0.00 0.00 177.00 177.84 2ac4 s PHE 92 N 2.34 2.93 0.14 0.56 0.08 -1.24 -0.01 117.98 122.76 2ac4 s PHE 92 Ca 0.60 1.19 -0.24 0.00 0.12 0.00 0.00 56.93 58.59 2ac4 s PHE 92 Cb -0.28 -3.07 -0.01 0.00 -0.57 0.00 0.00 43.02 39.09 2ac4 s PHE 92 CO 0.24 -1.62 1.63 0.82 -0.10 0.00 0.00 175.22 176.19 2ac4 h ILE 93 N -0.98 0.40 -1.00 0.64 2.04 -1.64 -0.43 117.51 116.54 2ac4 h ILE 93 Ca -0.46 0.00 0.15 0.00 1.00 0.00 0.00 64.86 65.55 2ac4 h ILE 93 Cb 1.26 0.40 -0.09 0.00 -0.74 0.00 0.00 36.82 37.65 2ac4 h ILE 93 CO 0.59 0.00 0.62 -0.33 0.00 0.00 0.00 178.15 179.03 2ac4 h GLU 94 N -0.32 0.85 -0.20 2.37 3.07 -1.88 -1.54 114.58 116.93 2ac4 h GLU 94 Ca 0.10 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 58.89 2ac4 h GLU 94 Cb 0.47 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 2ac4 h GLU 94 CO -0.31 0.56 0.04 -0.44 -1.40 0.00 0.00 179.01 177.46 2ac4 h ASP 95 N 0.88 0.31 -0.80 1.42 3.32 -1.56 -1.55 116.42 118.44 2ac4 h ASP 95 Ca 0.53 -0.25 0.06 0.00 0.02 0.00 0.00 57.03 57.38 2ac4 h ASP 95 Cb 0.68 -0.08 -0.06 0.00 0.22 0.00 0.00 39.33 40.09 2ac4 h ASP 95 CO -0.31 0.49 0.49 0.00 -1.72 0.00 0.00 179.24 178.19 2ac4 h ALA 96 N 0.84 1.10 -0.34 3.45 0.00 -0.20 -1.03 119.26 123.08 2ac4 h ALA 96 Ca 0.06 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 2ac4 h ALA 96 Cb 0.31 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2ac4 h ALA 96 CO 0.00 0.22 -0.06 0.28 0.00 0.00 0.00 179.25 179.70 2ac4 h VAL 97 N 0.90 1.27 -0.60 0.00 2.07 -1.18 -1.90 116.25 116.81 2ac4 h VAL 97 Ca 0.35 -1.09 -0.04 0.00 0.82 0.00 0.00 66.70 66.73 2ac4 h VAL 97 Cb 0.16 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 2ac4 h VAL 97 CO -0.17 0.36 0.21 0.00 0.02 0.00 0.00 177.57 177.98 2ac4 h ALA 98 N 0.82 1.24 -0.36 1.67 0.00 -0.93 -1.23 119.26 120.47 2ac4 h ALA 98 Ca 0.09 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 2ac4 h ALA 98 Cb 0.55 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2ac4 h ALA 98 CO 0.03 0.54 -0.31 1.49 0.00 0.00 0.00 179.25 181.00 2ac4 h GLU 99 N 0.86 0.79 -0.76 0.00 4.81 -1.07 -0.35 114.58 118.87 2ac4 h GLU 99 Ca 0.20 -0.37 -0.01 0.00 -0.13 0.00 0.00 59.36 59.05 2ac4 h GLU 99 Cb 0.22 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.55 2ac4 h GLU 99 CO -0.01 0.99 0.44 0.52 -0.73 0.00 0.00 179.01 180.22 2ac4 h MET 100 N 0.67 1.05 -0.78 1.92 2.86 -0.83 0.84 114.93 120.65 2ac4 h MET 100 Ca 0.07 -0.11 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 2ac4 h MET 100 Cb 0.85 -0.21 -0.04 0.00 0.06 0.00 0.00 31.60 32.26 2ac4 h MET 100 CO 0.07 0.76 0.40 1.25 1.06 0.00 0.00 176.91 180.45 2ac4 h HIS 101 N 1.05 1.09 -0.21 -0.22 -0.00 -0.90 0.05 115.15 116.01 2ac4 h HIS 101 Ca 0.27 -0.04 -0.12 0.00 -0.00 0.00 0.00 60.37 60.48 2ac4 h HIS 101 Cb -0.00 -0.34 -0.01 0.00 -0.00 0.00 0.00 27.41 27.05 2ac4 h HIS 101 CO -0.00 0.79 -0.38 -0.22 -0.00 0.00 0.00 177.93 178.11 2ac4 h LYS 102 N 1.08 0.46 0.00 5.26 3.64 -0.20 -2.52 116.57 124.30 2ac4 h LYS 102 Ca 0.27 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2ac4 h LYS 102 Cb 0.08 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 2ac4 h LYS 102 CO -0.04 0.77 0.00 -0.25 -2.27 0.00 0.00 179.45 177.66 2ac4 n ASP 103 N -4.04 0.00 0.00 4.20 8.00 0.21 -4.85 116.55 120.06 2ac4 n ASP 103 Ca -0.01 -1.07 0.00 0.00 0.71 0.00 0.00 54.79 54.41 2ac4 n ASP 103 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 2ac4 n ASP 103 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ac4 n GLY 104 N 0.54 0.76 3.75 0.44 0.00 -0.95 -5.03 105.19 104.70 2ac4 n GLY 104 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2ac4 n GLY 104 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ac4 s ILE 105 N -2.79 2.39 -0.00 -0.61 -1.09 -0.03 -4.88 121.20 114.19 2ac4 s ILE 105 Ca 0.00 0.34 0.00 0.00 -2.23 0.00 0.00 60.65 58.76 2ac4 s ILE 105 Cb 0.00 -3.22 -0.00 0.00 -1.58 0.00 0.00 42.46 37.66 2ac4 s ILE 105 CO 0.00 0.06 0.01 0.35 -1.23 0.00 0.00 174.94 174.12 2ac4 n THR 106 N 2.11 0.00 -4.59 2.92 -2.24 -1.26 -4.44 114.28 106.79 2ac4 n THR 106 Ca 0.07 -0.01 -0.22 0.00 -2.27 0.00 0.00 64.05 61.62 2ac4 n THR 106 Cb 0.39 0.22 -0.15 0.00 -2.10 0.00 0.00 70.33 68.69 2ac4 n THR 106 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2ac4 s GLU 107 N -2.02 1.20 0.10 -0.78 2.12 -1.26 -1.69 118.70 116.37 2ac4 s GLU 107 Ca -0.00 -0.45 -0.10 0.00 0.36 0.00 0.00 54.97 54.78 2ac4 s GLU 107 Cb 0.00 -1.11 0.00 0.00 0.26 0.00 0.00 34.13 33.28 2ac4 s GLU 107 CO 0.01 0.22 0.22 0.00 -0.54 0.00 0.00 175.26 175.17 2ac4 s ALA 108 N -0.06 -0.29 -0.05 6.30 0.00 -0.48 -1.18 121.76 125.99 2ac4 s ALA 108 Ca 0.00 -0.57 0.02 0.00 0.00 0.00 0.00 51.96 51.42 2ac4 s ALA 108 Cb -0.08 0.54 0.01 0.00 0.00 0.00 0.00 23.12 23.59 2ac4 s ALA 108 CO 0.00 -0.54 -0.12 0.54 0.00 0.00 0.00 175.76 175.65 2ac4 s VAL 109 N -3.86 1.08 0.20 0.00 0.11 -0.65 -1.65 120.40 115.62 2ac4 s VAL 109 Ca 0.06 -0.47 0.10 0.00 -2.93 0.00 0.00 61.98 58.74 2ac4 s VAL 109 Cb 0.04 -0.98 -0.04 0.00 -1.53 0.00 0.00 36.38 33.87 2ac4 s VAL 109 CO -0.10 0.34 -0.13 -0.94 -3.33 0.00 0.00 175.10 170.93 2ac4 s SER 110 N 0.52 4.00 -0.16 3.54 1.04 -0.28 -0.97 113.70 121.38 2ac4 s SER 110 Ca -0.11 -0.71 -0.13 0.00 0.48 0.00 0.00 55.95 55.48 2ac4 s SER 110 Cb -0.14 -0.57 0.05 0.00 0.10 0.00 0.00 66.02 65.46 2ac4 s SER 110 CO 0.03 0.09 0.43 -0.51 0.98 0.00 0.00 173.24 174.25 2ac4 s ILE 111 N -1.83 -0.01 -0.12 -1.02 2.07 -0.42 -1.16 121.20 118.70 2ac4 s ILE 111 Ca 0.25 0.03 -0.11 0.00 -1.41 0.00 0.00 60.65 59.40 2ac4 s ILE 111 Cb -0.08 -0.61 -0.05 0.00 0.13 0.00 0.00 42.46 41.86 2ac4 s ILE 111 CO 0.14 0.01 0.24 -0.69 -1.91 0.00 0.00 174.94 172.74 2ac4 s VAL 112 N 0.57 5.33 -1.35 4.00 1.01 -1.26 -1.97 120.40 126.72 2ac4 s VAL 112 Ca -0.03 0.45 -0.08 0.00 0.00 0.00 0.00 61.98 62.32 2ac4 s VAL 112 Cb -0.04 -3.55 -0.08 0.00 0.00 0.00 0.00 36.38 32.71 2ac4 s VAL 112 CO -0.03 0.50 2.64 0.18 0.00 0.00 0.00 175.10 178.39 2ac4 n LEU 113 N 2.75 7.31 -3.51 3.92 4.77 0.30 -4.51 117.00 128.03 2ac4 n LEU 113 Ca -0.15 -3.80 0.00 0.00 -0.03 0.00 0.00 56.01 52.03 2ac4 n LEU 113 Cb 0.53 -1.38 -0.03 0.00 -2.33 0.00 0.00 43.42 40.20 2ac4 n LEU 113 CO 0.36 1.52 0.32 0.00 -1.33 0.00 0.00 177.39 178.26 2ac4 s ALA 114 N 2.63 -2.24 0.43 -1.18 0.00 -1.26 -4.62 121.76 115.52 2ac4 s ALA 114 Ca 0.58 2.19 0.11 0.00 0.00 0.00 0.00 51.96 54.84 2ac4 s ALA 114 Cb 0.15 -1.91 0.93 0.00 0.00 0.00 0.00 23.12 22.29 2ac4 s ALA 114 CO -0.05 -1.01 2.01 -1.00 0.00 0.00 0.00 175.76 175.70 2ac4 h PRO 115 N 7.91 0.23 -5.55 0.00 0.13 -1.79 -3.45 132.00 129.48 2ac4 h PRO 115 Ca -0.18 -0.03 -0.63 0.00 -0.87 0.00 0.00 66.00 64.28 2ac4 h PRO 115 Cb 1.11 -0.04 -0.09 0.00 0.13 0.00 0.00 31.00 32.12 2ac4 h PRO 115 CO 0.12 0.27 -0.44 -1.01 -0.23 0.00 0.00 178.00 176.71 2ac4 s HIS 116 N -4.96 3.54 0.55 1.56 3.76 -1.26 -1.22 115.29 117.26 2ac4 s HIS 116 Ca -0.06 0.52 -0.18 0.00 -0.15 0.00 0.00 55.06 55.19 2ac4 s HIS 116 Cb 0.16 -2.08 -0.06 0.00 1.11 0.00 0.00 32.58 31.71 2ac4 s HIS 116 CO 0.71 0.54 1.07 0.12 -0.85 0.00 0.00 174.74 176.34 2ac4 s PHE 117 N -0.46 2.89 -0.07 1.40 2.19 -1.25 -4.83 117.98 117.85 2ac4 s PHE 117 Ca 0.14 1.55 -0.30 0.00 0.33 0.00 0.00 56.93 58.64 2ac4 s PHE 117 Cb -0.12 -3.10 0.07 0.00 -1.31 0.00 0.00 43.02 38.55 2ac4 s PHE 117 CO 0.03 -1.15 0.68 -1.54 1.83 0.00 0.00 175.22 175.08 2ac4 s SER 118 N -2.25 -0.67 0.31 6.13 1.04 -1.26 -3.56 113.70 113.45 2ac4 s SER 118 Ca 0.67 0.80 0.14 0.00 0.48 0.00 0.00 55.95 58.04 2ac4 s SER 118 Cb -0.18 0.64 0.48 0.00 0.10 0.00 0.00 66.02 67.06 2ac4 s SER 118 CO 0.29 -0.57 1.65 0.71 0.98 0.00 0.00 173.24 176.30 2ac4 h THR 119 N 3.11 1.18 -0.20 2.02 1.35 -1.97 -1.64 112.91 116.76 2ac4 h THR 119 Ca -0.27 -1.89 -0.16 0.00 -0.55 0.00 0.00 66.41 63.53 2ac4 h THR 119 Cb 1.14 2.08 0.00 0.00 -1.73 0.00 0.00 68.15 69.64 2ac4 h THR 119 CO 0.35 0.50 -0.51 0.15 -0.25 0.00 0.00 175.52 175.76 2ac4 h PHE 120 N 0.00 0.91 0.00 4.73 3.04 -1.98 -3.31 116.94 120.34 2ac4 h PHE 120 Ca -0.01 -0.35 0.00 0.00 3.98 0.00 0.00 57.97 61.60 2ac4 h PHE 120 Cb 1.03 -0.16 0.00 0.00 2.56 0.00 0.00 35.95 39.38 2ac4 h PHE 120 CO 0.00 1.14 0.00 -1.13 -2.02 0.00 0.00 178.31 176.30 2ac4 n SER 121 N -4.13 0.00 -0.25 0.41 3.41 -1.23 -4.49 113.62 107.34 2ac4 n SER 121 Ca -0.06 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.43 2ac4 n SER 121 Cb 0.60 -0.02 -0.08 0.00 -0.26 0.00 0.00 64.21 64.45 2ac4 n SER 121 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2ac4 h VAL 122 N 0.00 0.01 -0.93 -3.33 2.07 -1.84 0.28 116.25 112.52 2ac4 h VAL 122 Ca 0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.65 2ac4 h VAL 122 Cb 0.00 0.01 -0.09 0.00 -1.52 0.00 0.00 31.29 29.70 2ac4 h VAL 122 CO 0.00 0.00 0.55 -0.61 0.02 0.00 0.00 177.57 177.53 2ac4 h GLN 123 N -0.22 0.82 0.01 1.57 4.15 -1.51 0.17 115.11 120.10 2ac4 h GLN 123 Ca 0.13 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.50 2ac4 h GLN 123 Cb 0.53 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.04 2ac4 h GLN 123 CO -0.74 0.54 -0.01 1.03 -1.93 0.00 0.00 178.83 177.73 2ac4 h SER 124 N 0.85 -0.01 -0.39 -0.69 0.87 -1.06 0.12 113.55 113.23 2ac4 h SER 124 Ca 0.47 -0.29 0.06 0.00 -1.23 0.00 0.00 61.79 60.80 2ac4 h SER 124 Cb 0.53 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.44 2ac4 h SER 124 CO -0.29 0.28 0.08 1.88 -0.53 0.00 0.00 176.83 178.25 2ac4 h TYR 125 N -0.31 0.14 -0.46 2.24 -1.99 0.27 -0.40 116.97 116.46 2ac4 h TYR 125 Ca -0.00 0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.74 2ac4 h TYR 125 Cb 0.30 -0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.01 2ac4 h TYR 125 CO 0.03 0.02 0.23 -0.91 -0.00 0.00 0.00 178.16 177.53 2ac4 h ASN 126 N 0.21 0.60 -0.59 3.88 2.35 -0.58 -1.68 115.58 119.77 2ac4 h ASN 126 Ca 0.19 -0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 2ac4 h ASN 126 Cb 0.22 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.41 2ac4 h ASN 126 CO -0.24 0.54 0.28 0.50 -1.65 0.00 0.00 177.43 176.86 2ac4 h LYS 127 N 0.61 0.86 -0.65 0.81 3.64 -0.30 -2.21 116.57 119.33 2ac4 h LYS 127 Ca 0.16 -0.13 -0.07 0.00 -1.27 0.00 0.00 60.65 59.34 2ac4 h LYS 127 Cb 0.09 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 2ac4 h LYS 127 CO -0.02 0.70 0.15 0.00 -2.27 0.00 0.00 179.45 178.01 2ac4 h ARG 128 N 0.81 1.04 -0.36 1.90 3.08 -0.90 -0.97 114.38 118.98 2ac4 h ARG 128 Ca 0.20 -0.24 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 2ac4 h ARG 128 Cb 0.13 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2ac4 h ARG 128 CO -0.02 0.93 0.10 0.00 -1.07 0.00 0.00 179.97 179.90 2ac4 h ALA 129 N 1.17 0.48 -0.53 0.04 0.00 -1.09 -2.41 119.26 116.92 2ac4 h ALA 129 Ca 0.21 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 2ac4 h ALA 129 Cb 0.36 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2ac4 h ALA 129 CO 0.00 0.14 -0.12 0.87 0.00 0.00 0.00 179.25 180.14 2ac4 h LYS 130 N 0.43 1.00 -0.74 0.00 1.57 -1.23 -2.28 116.57 115.32 2ac4 h LYS 130 Ca 0.11 -0.37 -0.06 0.00 -1.87 0.00 0.00 60.65 58.46 2ac4 h LYS 130 Cb 0.29 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 2ac4 h LYS 130 CO -0.00 1.05 0.22 0.93 -0.57 0.00 0.00 179.45 181.07 2ac4 h GLU 131 N 0.88 1.17 -0.36 3.15 5.08 -1.09 0.18 114.58 123.58 2ac4 h GLU 131 Ca 0.14 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 2ac4 h GLU 131 Cb 0.68 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 2ac4 h GLU 131 CO 0.05 1.00 0.17 1.49 -1.00 0.00 0.00 179.01 180.72 2ac4 h GLU 132 N 1.11 0.52 0.09 2.33 4.57 -1.36 0.96 114.58 122.81 2ac4 h GLU 132 Ca 0.24 -0.08 0.01 0.00 -1.18 0.00 0.00 59.36 58.35 2ac4 h GLU 132 Cb 0.33 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.81 2ac4 h GLU 132 CO -0.00 0.47 -0.12 0.00 -1.18 0.00 0.00 179.01 178.18 2ac4 h ALA 133 N 1.03 -0.21 -0.43 2.92 0.00 -0.90 -0.50 119.26 121.17 2ac4 h ALA 133 Ca 0.12 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.06 2ac4 h ALA 133 Cb 0.12 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2ac4 h ALA 133 CO -0.02 -0.64 0.29 1.49 0.00 0.00 0.00 179.25 180.37 2ac4 h GLU 134 N -0.25 0.36 -0.15 0.00 4.81 -0.41 0.84 114.58 119.79 2ac4 h GLU 134 Ca 0.01 -0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 59.08 2ac4 h GLU 134 Cb 0.26 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 2ac4 h GLU 134 CO -0.05 0.24 -0.52 -0.22 -0.73 0.00 0.00 179.01 177.72 2ac4 h LYS 135 N 0.38 0.42 0.09 1.92 3.64 0.11 -3.19 116.57 119.93 2ac4 h LYS 135 Ca 0.19 -0.25 -0.30 0.00 -1.27 0.00 0.00 60.65 59.01 2ac4 h LYS 135 Cb 0.26 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 2ac4 h LYS 135 CO -0.04 0.84 -1.52 -0.07 -2.27 0.00 0.00 179.45 176.39 2ac4 h LEU 136 N 0.33 0.30 0.00 5.20 3.38 0.36 -3.51 115.31 121.37 2ac4 h LEU 136 Ca 0.01 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.55 2ac4 h LEU 136 Cb 1.03 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2ac4 h LEU 136 CO 0.09 1.36 0.00 0.61 0.09 0.00 0.00 178.44 180.59 2ac4 n GLY 137 N 1.63 -1.72 2.26 0.83 0.00 0.28 -4.92 105.19 103.55 2ac4 n GLY 137 Ca -0.15 -1.52 -0.15 0.00 0.00 0.00 0.00 46.02 44.19 2ac4 n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ac4 n GLY 138 N -2.11 0.72 3.17 -0.02 0.00 -1.26 -4.93 105.19 100.77 2ac4 n GLY 138 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2ac4 n GLY 138 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ac4 s LEU 139 N -4.65 -0.24 0.21 0.99 2.96 -1.26 -4.50 118.68 112.19 2ac4 s LEU 139 Ca 0.00 0.79 0.11 0.00 -0.22 0.00 0.00 54.13 54.82 2ac4 s LEU 139 Cb 0.00 1.09 -0.05 0.00 0.50 0.00 0.00 46.19 47.74 2ac4 s LEU 139 CO 0.00 -0.21 -0.22 0.42 -1.32 0.00 0.00 176.35 175.02 2ac4 s THR 140 N 2.01 2.45 -0.03 3.68 -4.23 -0.68 -4.53 115.64 114.31 2ac4 s THR 140 Ca -0.04 -2.08 0.00 0.00 -1.18 0.00 0.00 61.69 58.39 2ac4 s THR 140 Cb -0.11 -2.20 0.03 0.00 1.34 0.00 0.00 72.50 71.56 2ac4 s THR 140 CO -0.11 -0.18 0.00 -0.63 -0.54 0.00 0.00 174.62 173.16 2ac4 s ILE 141 N -1.86 0.17 -0.21 2.99 1.01 -1.26 -1.39 121.20 120.66 2ac4 s ILE 141 Ca 0.23 0.08 -0.09 0.00 0.00 0.00 0.00 60.65 60.87 2ac4 s ILE 141 Cb -0.07 -0.27 -0.05 0.00 0.01 0.00 0.00 42.46 42.08 2ac4 s ILE 141 CO 0.11 0.14 0.11 -0.89 0.00 0.00 0.00 174.94 174.42 2ac4 s THR 142 N 1.00 5.16 -0.10 2.92 2.01 -0.66 -4.98 115.64 120.98 2ac4 s THR 142 Ca -0.10 0.10 0.01 0.00 0.31 0.00 0.00 61.69 62.01 2ac4 s THR 142 Cb -0.14 -3.36 -0.02 0.00 0.01 0.00 0.00 72.50 69.00 2ac4 s THR 142 CO -0.02 0.42 -0.12 -0.44 -0.69 0.00 0.00 174.62 173.77 2ac4 s SER 143 N 0.57 4.13 0.13 3.53 0.01 -1.26 -1.12 113.70 119.68 2ac4 s SER 143 Ca 0.06 -0.25 -0.30 0.00 1.31 0.00 0.00 55.95 56.77 2ac4 s SER 143 Cb -0.12 -1.38 -0.07 0.00 0.21 0.00 0.00 66.02 64.66 2ac4 s SER 143 CO 0.00 0.23 1.11 -0.69 0.41 0.00 0.00 173.24 174.30 2ac4 s VAL 144 N -0.04 4.03 -0.22 3.43 1.01 -0.31 -4.94 120.40 123.36 2ac4 s VAL 144 Ca -0.02 1.64 0.09 0.00 0.00 0.00 0.00 61.98 63.68 2ac4 s VAL 144 Cb -0.14 -4.05 -0.20 0.00 0.00 0.00 0.00 36.38 32.00 2ac4 s VAL 144 CO 0.04 0.23 -0.09 -0.62 0.00 0.00 0.00 175.10 174.65 2ac4 n GLU 145 N 2.90 0.72 -3.59 2.72 1.02 -1.26 -4.52 120.64 118.63 2ac4 n GLU 145 Ca 0.04 0.08 -0.15 0.00 -0.02 0.00 0.00 57.16 57.11 2ac4 n GLU 145 Cb 0.47 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.33 2ac4 n GLU 145 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2ac4 s SER 146 N -5.95 -0.47 0.00 1.62 1.04 -1.26 -3.82 113.70 104.86 2ac4 s SER 146 Ca -0.23 0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.55 2ac4 s SER 146 Cb 0.07 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.67 2ac4 s SER 146 CO 0.67 -0.63 0.47 -2.67 0.98 0.00 0.00 173.24 172.06 2ac4 n TRP 147 N 0.74 0.00 0.27 5.02 4.27 -0.36 -4.89 117.44 122.49 2ac4 n TRP 147 Ca -0.19 0.00 0.16 0.00 -3.89 0.00 0.00 57.50 53.58 2ac4 n TRP 147 Cb 0.58 0.11 0.91 0.00 -1.36 0.00 0.00 31.31 31.54 2ac4 n TRP 147 CO 0.00 0.00 0.00 0.10 -2.29 0.00 0.00 177.69 175.50 2ac4 h TYR 148 N 0.00 0.00 -0.09 -2.67 -0.00 -1.73 -1.44 116.97 111.04 2ac4 h TYR 148 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 2ac4 h TYR 148 Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.82 2ac4 h TYR 148 CO -0.07 0.00 0.00 -0.40 -0.00 0.00 0.00 178.16 177.69 2ac4 n ASP 149 N -3.74 1.74 -4.69 0.10 5.75 -1.26 -4.58 116.55 109.87 2ac4 n ASP 149 Ca -0.01 -1.63 -0.42 0.00 -0.01 0.00 0.00 54.79 52.71 2ac4 n ASP 149 Cb 0.18 -0.05 -0.03 0.00 -1.03 0.00 0.00 41.12 40.19 2ac4 n ASP 149 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 2ac4 s GLU 150 N -1.89 4.17 0.27 0.11 2.56 -0.54 -4.88 118.70 118.49 2ac4 s GLU 150 Ca 0.35 2.46 0.00 0.00 0.00 0.00 0.00 54.97 57.78 2ac4 s GLU 150 Cb 0.20 -3.65 0.60 0.00 2.00 0.00 0.00 34.13 33.27 2ac4 s GLU 150 CO 0.30 -0.80 1.73 -1.35 -0.56 0.00 0.00 175.26 174.58 2ac4 h PRO 151 N 8.65 0.48 -0.20 4.30 0.11 -1.90 -0.02 132.00 143.41 2ac4 h PRO 151 Ca -0.44 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 2ac4 h PRO 151 Cb 1.21 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2ac4 h PRO 151 CO 0.94 0.32 -0.06 0.87 -0.21 0.00 0.00 178.00 179.85 2ac4 h LYS 152 N 0.49 0.30 -0.09 1.05 1.57 -1.93 0.17 116.57 118.13 2ac4 h LYS 152 Ca 0.49 -0.06 -0.21 0.00 -1.87 0.00 0.00 60.65 59.01 2ac4 h LYS 152 Cb 0.82 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 33.09 2ac4 h LYS 152 CO -0.44 0.38 -0.75 0.35 -0.57 0.00 0.00 179.45 178.42 2ac4 h PHE 153 N 0.29 0.93 -0.17 -1.35 3.57 -1.39 -2.35 116.94 116.48 2ac4 h PHE 153 Ca 0.06 -0.44 -0.01 0.00 3.53 0.00 0.00 57.97 61.11 2ac4 h PHE 153 Cb 0.30 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 2ac4 h PHE 153 CO 0.01 1.26 0.07 0.28 -2.23 0.00 0.00 178.31 177.70 2ac4 h VAL 154 N 0.34 1.15 -0.91 1.41 2.07 -0.89 -2.73 116.25 116.69 2ac4 h VAL 154 Ca -0.07 -0.45 0.11 0.00 0.82 0.00 0.00 66.70 67.11 2ac4 h VAL 154 Cb 1.40 1.14 -0.07 0.00 -1.52 0.00 0.00 31.29 32.24 2ac4 h VAL 154 CO 0.15 0.14 0.59 0.74 0.02 0.00 0.00 177.57 179.21 2ac4 h THR 155 N 0.12 0.95 -0.27 2.57 2.02 -0.68 0.95 112.91 118.57 2ac4 h THR 155 Ca 0.06 -0.30 0.03 0.00 0.77 0.00 0.00 66.41 66.97 2ac4 h THR 155 Cb 0.16 -0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 66.52 2ac4 h THR 155 CO -0.01 0.16 0.06 0.22 0.37 0.00 0.00 175.52 176.33 2ac4 h TYR 156 N 0.89 0.10 -0.08 3.16 3.20 -1.11 -0.87 116.97 122.27 2ac4 h TYR 156 Ca 0.43 0.02 -0.20 0.00 3.14 0.00 0.00 58.73 62.12 2ac4 h TYR 156 Cb 0.45 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.72 2ac4 h TYR 156 CO -0.00 0.03 -0.78 -1.49 -1.64 0.00 0.00 178.16 174.28 2ac4 h TRP 157 N 0.17 0.67 -0.07 -3.82 4.06 -1.23 -2.62 115.95 113.10 2ac4 h TRP 157 Ca 0.12 -0.31 0.01 0.00 2.06 0.00 0.00 58.89 60.77 2ac4 h TRP 157 Cb 0.12 -0.10 -0.01 0.00 -1.00 0.00 0.00 29.16 28.17 2ac4 h TRP 157 CO -0.15 1.09 0.01 0.28 -3.56 0.00 0.00 178.44 176.10 2ac4 h VAL 158 N 0.32 0.96 -0.43 1.49 2.07 -0.59 -0.31 116.25 119.77 2ac4 h VAL 158 Ca -0.05 -0.01 -0.09 0.00 0.82 0.00 0.00 66.70 67.38 2ac4 h VAL 158 Cb 1.38 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 32.05 2ac4 h VAL 158 CO 0.14 0.01 -0.08 0.44 0.02 0.00 0.00 177.57 178.09 2ac4 h ASP 159 N 0.04 0.73 -0.72 0.57 3.32 -1.20 0.57 116.42 119.72 2ac4 h ASP 159 Ca 0.03 -0.21 -0.07 0.00 0.02 0.00 0.00 57.03 56.81 2ac4 h ASP 159 Cb 0.03 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 2ac4 h ASP 159 CO -0.05 0.85 0.19 0.03 -1.72 0.00 0.00 179.24 178.54 2ac4 h ARG 160 N 0.69 1.14 -0.39 3.56 2.47 -1.22 -1.39 114.38 119.24 2ac4 h ARG 160 Ca 0.12 -0.27 -0.06 0.00 -1.26 0.00 0.00 59.98 58.52 2ac4 h ARG 160 Cb 0.54 -0.15 -0.01 0.00 -1.65 0.00 0.00 29.97 28.70 2ac4 h ARG 160 CO 0.03 1.00 0.03 0.28 0.56 0.00 0.00 179.97 181.86 2ac4 h VAL 161 N 1.09 1.25 -0.71 2.04 2.07 -0.63 -1.65 116.25 119.71 2ac4 h VAL 161 Ca 0.23 -0.95 0.05 0.00 0.82 0.00 0.00 66.70 66.85 2ac4 h VAL 161 Cb 0.36 1.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.18 2ac4 h VAL 161 CO -0.00 0.32 0.42 0.11 0.02 0.00 0.00 177.57 178.44 2ac4 h LYS 162 N 0.50 0.77 -0.38 1.57 1.57 -0.58 -0.58 116.57 119.45 2ac4 h LYS 162 Ca 0.11 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.81 2ac4 h LYS 162 Cb 0.43 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 2ac4 h LYS 162 CO 0.02 0.51 0.09 0.93 -0.57 0.00 0.00 179.45 180.43 2ac4 h GLU 163 N 0.80 0.61 -0.23 3.15 5.08 -1.13 -0.23 114.58 122.62 2ac4 h GLU 163 Ca 0.30 -0.15 0.03 0.00 -1.00 0.00 0.00 59.36 58.54 2ac4 h GLU 163 Cb 0.11 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 2ac4 h GLU 163 CO -0.15 0.65 0.07 1.15 -1.00 0.00 0.00 179.01 179.73 2ac4 h THR 164 N 0.47 0.93 -0.41 1.13 2.02 -0.63 -0.55 112.91 115.87 2ac4 h THR 164 Ca 0.12 -0.06 -0.10 0.00 0.77 0.00 0.00 66.41 67.14 2ac4 h THR 164 Cb 0.31 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 2ac4 h THR 164 CO 0.00 0.03 -0.17 1.88 0.37 0.00 0.00 175.52 177.63 2ac4 h TYR 165 N 0.17 0.86 -0.59 3.16 -1.99 -1.02 -2.76 116.97 114.80 2ac4 h TYR 165 Ca 0.10 -0.18 0.01 0.00 2.00 0.00 0.00 58.73 60.66 2ac4 h TYR 165 Cb 0.08 -0.21 -0.03 0.00 2.00 0.00 0.00 36.73 38.57 2ac4 h TYR 165 CO -0.13 0.88 0.39 0.00 -0.00 0.00 0.00 178.16 179.30 2ac4 h ALA 166 N 1.12 1.59 0.00 3.88 0.00 -0.51 -1.65 119.26 123.69 2ac4 h ALA 166 Ca 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2ac4 h ALA 166 Cb 0.67 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2ac4 h ALA 166 CO 0.05 0.38 0.00 -1.13 0.00 0.00 0.00 179.25 178.55 2ac4 n SER 167 N -4.45 0.08 -4.81 0.00 3.41 -0.26 -4.87 113.62 102.71 2ac4 n SER 167 Ca 0.06 0.51 -0.33 0.00 -0.26 0.00 0.00 58.87 58.85 2ac4 n SER 167 Cb 0.05 -0.53 -0.02 0.00 -0.26 0.00 0.00 64.21 63.45 2ac4 n SER 167 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2ac4 s MET 168 N -3.02 3.65 0.91 4.33 1.00 -0.62 -5.04 119.30 120.51 2ac4 s MET 168 Ca 0.12 1.20 -0.11 0.00 0.00 0.00 0.00 55.69 56.90 2ac4 s MET 168 Cb 0.16 -2.08 0.14 0.00 0.00 0.00 0.00 34.83 33.05 2ac4 s MET 168 CO 0.47 -0.54 1.10 -2.14 0.00 0.00 0.00 175.02 173.91 2ac4 s PRO 169 N -3.75 1.15 0.19 2.03 0.02 -1.26 -4.67 135.00 128.72 2ac4 s PRO 169 Ca 0.64 1.08 -0.12 0.00 0.02 0.00 0.00 61.00 62.62 2ac4 s PRO 169 Cb -0.14 -1.78 0.12 0.00 0.02 0.00 0.00 34.50 32.72 2ac4 s PRO 169 CO 0.29 -2.39 1.85 0.93 -0.33 0.00 0.00 177.00 177.35 2ac4 h GLU 170 N -1.67 0.79 0.00 5.54 5.08 -1.96 0.16 114.58 122.52 2ac4 h GLU 170 Ca -0.48 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 57.76 2ac4 h GLU 170 Cb 1.27 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 2ac4 h GLU 170 CO 0.50 0.52 -0.37 0.38 -1.00 0.00 0.00 179.01 179.05 2ac4 h ASP 171 N 0.81 0.00 0.28 1.42 2.03 -1.99 -2.29 116.42 116.68 2ac4 h ASP 171 Ca 0.24 0.00 -0.29 0.00 -0.73 0.00 0.00 57.03 56.25 2ac4 h ASP 171 Cb -0.05 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 38.47 2ac4 h ASP 171 CO -0.07 0.37 -1.22 -0.33 -1.03 0.00 0.00 179.24 176.95 2ac4 h GLU 172 N 0.00 0.51 0.00 4.15 5.08 -1.79 -2.94 114.58 119.59 2ac4 h GLU 172 Ca -0.00 -0.70 -0.02 0.00 -1.00 0.00 0.00 59.36 57.63 2ac4 h GLU 172 Cb 0.66 0.24 -0.00 0.00 0.50 0.00 0.00 28.75 30.15 2ac4 h GLU 172 CO 0.05 1.31 -0.10 -0.09 -1.00 0.00 0.00 179.01 179.17 2ac4 h ARG 173 N 0.21 0.00 0.00 2.33 2.43 -0.38 -2.21 114.38 116.76 2ac4 h ARG 173 Ca -0.17 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 2ac4 h ARG 173 Cb 1.90 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.45 2ac4 h ARG 173 CO 0.22 0.10 -0.70 0.39 -1.51 0.00 0.00 179.97 178.48 2ac4 n GLU 174 N -4.12 0.08 -2.61 0.20 1.02 -0.89 -4.42 120.64 109.89 2ac4 n GLU 174 Ca -0.02 0.01 -0.13 0.00 -0.02 0.00 0.00 57.16 56.99 2ac4 n GLU 174 Cb 0.19 -1.53 0.02 0.00 -0.02 0.00 0.00 31.44 30.10 2ac4 n GLU 174 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2ac4 n ASN 175 N -1.63 2.27 -4.67 1.62 5.15 -0.85 -5.09 115.26 112.05 2ac4 n ASN 175 Ca 0.04 -2.96 -0.23 0.00 -0.60 0.00 0.00 54.58 50.84 2ac4 n ASN 175 Cb 0.36 -0.51 -0.07 0.00 -0.53 0.00 0.00 39.78 39.03 2ac4 n ASN 175 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2ac4 s ALA 176 N -3.24 3.24 -0.05 5.20 0.00 -1.06 0.05 121.76 125.90 2ac4 s ALA 176 Ca 0.32 -1.63 0.03 0.00 0.00 0.00 0.00 51.96 50.68 2ac4 s ALA 176 Cb 0.44 -0.84 0.01 0.00 0.00 0.00 0.00 23.12 22.73 2ac4 s ALA 176 CO -0.02 0.25 -0.13 1.41 0.00 0.00 0.00 175.76 177.27 2ac4 s MET 177 N -3.71 1.62 -0.35 0.00 0.00 0.13 -4.85 119.30 112.13 2ac4 s MET 177 Ca 0.32 -0.45 -0.14 0.00 0.00 0.00 0.00 55.69 55.42 2ac4 s MET 177 Cb -0.06 -1.37 -0.01 0.00 0.00 0.00 0.00 34.83 33.39 2ac4 s MET 177 CO 0.21 0.10 0.28 -1.17 0.00 0.00 0.00 175.02 174.43 2ac4 s LEU 178 N 0.43 4.61 -0.34 4.11 2.96 -1.08 -0.83 118.68 128.54 2ac4 s LEU 178 Ca -0.10 -0.47 -0.09 0.00 -0.22 0.00 0.00 54.13 53.25 2ac4 s LEU 178 Cb -0.14 -2.19 0.02 0.00 0.50 0.00 0.00 46.19 44.38 2ac4 s LEU 178 CO 0.03 -0.30 0.16 -0.63 -1.32 0.00 0.00 176.35 174.29 2ac4 s ILE 179 N 1.79 4.41 -0.18 6.68 1.01 0.34 -0.16 121.20 135.08 2ac4 s ILE 179 Ca 0.07 -0.73 -0.09 0.00 0.00 0.00 0.00 60.65 59.90 2ac4 s ILE 179 Cb -0.17 -3.37 -0.05 0.00 0.01 0.00 0.00 42.46 38.88 2ac4 s ILE 179 CO 0.11 -0.09 0.12 -0.69 0.00 0.00 0.00 174.94 174.38 2ac4 s VAL 180 N 1.55 5.31 0.24 2.92 1.01 -0.50 -1.40 120.40 129.53 2ac4 s VAL 180 Ca 0.02 0.15 -0.01 0.00 0.00 0.00 0.00 61.98 62.15 2ac4 s VAL 180 Cb -0.18 -3.40 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 2ac4 s VAL 180 CO 0.05 0.48 0.22 -0.94 0.00 0.00 0.00 175.10 174.91 2ac4 s SER 181 N 0.07 0.46 0.22 3.32 1.04 -0.53 -1.40 113.70 116.89 2ac4 s SER 181 Ca 0.09 -1.42 -0.14 0.00 0.48 0.00 0.00 55.95 54.96 2ac4 s SER 181 Cb -0.11 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.46 2ac4 s SER 181 CO -0.00 -0.94 0.48 0.00 0.98 0.00 0.00 173.24 173.75 2ac4 s ALA 182 N -3.94 -0.44 0.26 5.32 0.00 -1.23 -1.87 121.76 119.86 2ac4 s ALA 182 Ca 0.37 -0.68 -0.30 0.00 0.00 0.00 0.00 51.96 51.35 2ac4 s ALA 182 Cb 0.05 0.97 -0.11 0.00 0.00 0.00 0.00 23.12 24.03 2ac4 s ALA 182 CO 0.15 -0.82 1.58 0.00 0.00 0.00 0.00 175.76 176.67 2ac4 s SER 184 N 0.62 5.65 0.09 0.00 0.15 -0.24 -4.81 113.70 115.17 2ac4 s SER 184 Ca 0.65 1.94 -0.02 0.00 0.70 0.00 0.00 55.95 59.21 2ac4 s SER 184 Cb -0.46 -2.55 -0.04 0.00 -1.71 0.00 0.00 66.02 61.26 2ac4 s SER 184 CO 0.43 -1.26 0.03 -0.76 1.20 0.00 0.00 173.24 172.89 2ac4 s LEU 185 N -4.37 2.08 0.36 3.45 1.43 -1.26 -4.72 118.68 115.64 2ac4 s LEU 185 Ca 0.66 -1.03 -0.29 0.00 -1.03 0.00 0.00 54.13 52.44 2ac4 s LEU 185 Cb -0.19 0.35 -0.11 0.00 0.03 0.00 0.00 46.19 46.28 2ac4 s LEU 185 CO 0.34 -0.67 1.51 -2.65 0.23 0.00 0.00 176.35 175.12 2ac4 n PRO 186 N 0.01 2.67 0.23 1.29 -0.02 -1.26 0.51 135.00 138.43 2ac4 n PRO 186 Ca -0.11 0.94 0.09 0.00 -2.02 0.00 0.00 63.50 62.40 2ac4 n PRO 186 Cb 0.62 -2.68 0.64 0.00 -0.02 0.00 0.00 33.50 32.06 2ac4 n PRO 186 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2ac4 h GLU 187 N 3.41 0.02 -1.03 -0.52 5.08 -1.13 -2.89 114.58 117.52 2ac4 h GLU 187 Ca -0.50 -0.00 0.30 0.00 -1.00 0.00 0.00 59.36 58.16 2ac4 h GLU 187 Cb 1.24 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.44 2ac4 h GLU 187 CO 0.68 0.01 0.92 1.57 -1.00 0.00 0.00 179.01 181.19 2ac4 h LYS 188 N 0.02 0.00 -0.16 2.33 2.10 -1.89 0.12 116.57 119.09 2ac4 h LYS 188 Ca 0.03 0.00 0.05 0.00 -2.00 0.00 0.00 60.65 58.72 2ac4 h LYS 188 Cb 0.08 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.41 2ac4 h LYS 188 CO -0.00 0.00 0.29 -0.84 -2.00 0.00 0.00 179.45 176.89 2ac4 h ILE 189 N 0.00 0.24 -0.10 0.07 3.07 -1.89 0.29 117.51 119.18 2ac4 h ILE 189 Ca 0.49 0.00 0.03 0.00 1.55 0.00 0.00 64.86 66.93 2ac4 h ILE 189 Cb 2.32 0.75 -0.00 0.00 -0.27 0.00 0.00 36.82 39.62 2ac4 h ILE 189 CO -0.01 0.00 0.12 0.07 -1.05 0.00 0.00 178.15 177.28 2ac4 h LYS 190 N 0.00 0.00 -0.07 0.16 2.10 -1.01 -1.40 116.57 116.35 2ac4 h LYS 190 Ca 0.08 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.73 2ac4 h LYS 190 Cb 0.65 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.97 2ac4 h LYS 190 CO -0.00 0.00 0.04 1.49 -2.00 0.00 0.00 179.45 178.98 2ac4 h GLU 191 N 0.00 0.09 -0.54 0.07 4.81 -0.64 -1.56 114.58 116.81 2ac4 h GLU 191 Ca 0.05 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2ac4 h GLU 191 Cb 0.28 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.64 2ac4 h GLU 191 CO -0.00 0.07 0.00 1.19 -0.73 0.00 0.00 179.01 179.54 2ac4 n PHE 192 N -4.52 0.71 -2.00 0.92 3.72 -0.54 -4.94 117.46 110.82 2ac4 n PHE 192 Ca -0.02 -0.36 -0.09 0.00 -0.05 0.00 0.00 57.45 56.94 2ac4 n PHE 192 Cb 0.09 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.62 2ac4 n PHE 192 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ac4 n GLY 193 N 1.58 0.20 3.67 1.37 0.00 -0.59 -4.94 105.19 106.48 2ac4 n GLY 193 Ca 0.22 -0.54 -0.48 0.00 0.00 0.00 0.00 46.02 45.22 2ac4 n GLY 193 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ac4 n ASP 194 N 0.35 3.25 -0.09 1.61 -0.08 -1.14 -4.87 116.55 115.58 2ac4 n ASP 194 Ca -0.10 1.02 0.15 0.00 -1.51 0.00 0.00 54.79 54.35 2ac4 n ASP 194 Cb 0.53 -1.39 0.82 0.00 2.34 0.00 0.00 41.12 43.42 2ac4 n ASP 194 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2ac4 n PRO 195 N 5.23 1.13 -0.21 -0.67 -0.04 -1.26 -4.39 135.00 134.79 2ac4 n PRO 195 Ca 0.20 -0.19 -0.03 0.00 -0.04 0.00 0.00 63.50 63.44 2ac4 n PRO 195 Cb 0.29 -1.47 0.03 0.00 -0.04 0.00 0.00 33.50 32.31 2ac4 n PRO 195 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 2ac4 h TYR 196 N 0.44 -0.72 -0.24 0.54 3.20 -1.90 0.24 116.97 118.54 2ac4 h TYR 196 Ca 0.00 0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.94 2ac4 h TYR 196 Cb 0.09 0.41 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 2ac4 h TYR 196 CO 0.00 -0.35 0.15 -1.35 -1.64 0.00 0.00 178.16 174.98 2ac4 h PRO 197 N -0.11 0.33 -0.81 1.82 0.11 -1.89 -1.72 132.00 129.72 2ac4 h PRO 197 Ca 0.26 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.33 2ac4 h PRO 197 Cb 0.53 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 31.53 2ac4 h PRO 197 CO -0.67 0.24 0.46 -0.44 -0.21 0.00 0.00 178.00 177.38 2ac4 h ASP 198 N 0.32 1.01 -0.54 -2.05 3.32 -1.62 -1.91 116.42 114.94 2ac4 h ASP 198 Ca 0.09 -0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 2ac4 h ASP 198 Cb -0.01 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.26 2ac4 h ASP 198 CO -0.02 0.80 0.24 1.56 -1.72 0.00 0.00 179.24 180.10 2ac4 h GLN 199 N 1.13 0.83 -0.47 3.56 4.20 -0.25 0.84 115.11 124.95 2ac4 h GLN 199 Ca 0.29 -0.12 -0.14 0.00 0.06 0.00 0.00 58.65 58.74 2ac4 h GLN 199 Cb 0.01 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.63 2ac4 h GLN 199 CO -0.05 0.68 -0.24 1.25 -0.67 0.00 0.00 178.83 179.80 2ac4 h LEU 200 N 0.83 1.01 -0.87 1.46 5.85 -0.84 -0.49 115.31 122.25 2ac4 h LEU 200 Ca 0.20 -0.39 -0.06 0.00 0.84 0.00 0.00 57.88 58.47 2ac4 h LEU 200 Cb 0.15 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 2ac4 h LEU 200 CO -0.02 1.19 0.15 0.45 -0.34 0.00 0.00 178.44 179.87 2ac4 h HIS 201 N 0.84 1.03 -0.66 1.25 3.86 -0.69 -0.93 115.15 119.86 2ac4 h HIS 201 Ca 0.10 -0.11 -0.07 0.00 -1.16 0.00 0.00 60.37 59.13 2ac4 h HIS 201 Cb 0.82 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.96 2ac4 h HIS 201 CO 0.05 0.85 0.13 1.49 0.86 0.00 0.00 177.93 181.31 2ac4 h GLU 202 N 0.95 1.06 -0.45 2.45 4.57 -0.56 -0.53 114.58 122.07 2ac4 h GLU 202 Ca 0.20 -0.26 -0.02 0.00 -1.18 0.00 0.00 59.36 58.10 2ac4 h GLU 202 Cb 0.34 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 2ac4 h GLU 202 CO 0.00 0.95 0.20 0.77 -1.18 0.00 0.00 179.01 179.75 2ac4 h SER 203 N 1.00 0.60 -0.04 1.04 0.02 -0.54 -1.22 113.55 114.41 2ac4 h SER 203 Ca 0.20 -0.15 -0.00 0.00 -0.84 0.00 0.00 61.79 61.01 2ac4 h SER 203 Cb 0.39 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.78 2ac4 h SER 203 CO 0.01 0.58 0.02 0.00 -1.14 0.00 0.00 176.83 176.30 2ac4 h ALA 204 N 1.04 0.05 -0.60 3.77 0.00 -0.79 -1.19 119.26 121.55 2ac4 h ALA 204 Ca 0.15 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.04 2ac4 h ALA 204 Cb 0.15 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2ac4 h ALA 204 CO -0.02 -0.41 0.37 -0.22 0.00 0.00 0.00 179.25 178.97 2ac4 h LYS 205 N -0.02 0.70 -0.24 0.00 3.11 -1.00 -0.75 116.57 118.37 2ac4 h LYS 205 Ca 0.02 -0.04 -0.01 0.00 -2.81 0.00 0.00 60.65 57.80 2ac4 h LYS 205 Cb 0.08 -0.16 -0.01 0.00 -1.00 0.00 0.00 32.23 31.14 2ac4 h LYS 205 CO -0.00 0.46 0.11 -0.07 -2.81 0.00 0.00 179.45 177.14 2ac4 h LEU 206 N 0.72 0.32 -0.29 5.20 3.38 -1.05 -0.99 115.31 122.61 2ac4 h LEU 206 Ca 0.24 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 2ac4 h LEU 206 Cb 0.02 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2ac4 h LEU 206 CO -0.10 0.38 -0.04 0.40 0.09 0.00 0.00 178.44 179.16 2ac4 h ILE 207 N 0.24 1.27 -0.36 1.22 2.04 -1.03 -1.34 117.51 119.56 2ac4 h ILE 207 Ca 0.08 -1.04 -0.02 0.00 1.00 0.00 0.00 64.86 64.88 2ac4 h ILE 207 Cb 0.15 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 2ac4 h ILE 207 CO -0.01 0.33 0.15 0.00 0.00 0.00 0.00 178.15 178.63 2ac4 h ALA 208 N 0.80 0.46 -0.55 1.87 0.00 -1.12 -0.55 119.26 120.18 2ac4 h ALA 208 Ca 0.08 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2ac4 h ALA 208 Cb 0.51 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 2ac4 h ALA 208 CO 0.02 0.05 0.36 1.49 0.00 0.00 0.00 179.25 181.18 2ac4 h GLU 209 N 0.43 0.72 -0.63 0.00 4.81 -1.16 -0.17 114.58 118.59 2ac4 h GLU 209 Ca 0.12 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.25 2ac4 h GLU 209 Cb 0.17 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.36 2ac4 h GLU 209 CO -0.01 0.48 0.17 0.78 -0.73 0.00 0.00 179.01 179.70 2ac4 h GLY 210 N 0.74 1.04 0.66 1.92 0.00 -0.99 -2.86 103.07 103.59 2ac4 h GLY 210 Ca 0.20 -0.61 0.00 0.00 0.00 0.00 0.00 47.33 46.92 2ac4 h GLY 210 CO -0.04 0.57 -0.07 0.00 0.00 0.00 0.00 176.54 177.00 2ac4 n ALA 211 N -2.46 2.72 -1.38 3.60 0.00 -0.24 -4.91 120.51 117.84 2ac4 n ALA 211 Ca 0.05 -0.29 -0.08 0.00 0.00 0.00 0.00 53.44 53.12 2ac4 n ALA 211 Cb 0.23 -1.34 -0.03 0.00 0.00 0.00 0.00 19.45 18.31 2ac4 n ALA 211 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ac4 n GLY 212 N 1.20 0.81 3.53 0.00 0.00 -0.44 -4.81 105.19 105.48 2ac4 n GLY 212 Ca 0.17 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 45.09 2ac4 n GLY 212 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ac4 s VAL 213 N -2.30 5.03 -0.04 1.61 1.01 -0.21 -4.95 120.40 120.55 2ac4 s VAL 213 Ca 0.00 0.04 0.12 0.00 0.00 0.00 0.00 61.98 62.14 2ac4 s VAL 213 Cb 0.00 -4.01 -0.09 0.00 0.00 0.00 0.00 36.38 32.28 2ac4 s VAL 213 CO 0.00 -0.33 1.21 0.77 0.00 0.00 0.00 175.10 176.75 2ac4 h SER 214 N 8.62 0.00 -3.65 3.32 4.64 -1.94 -3.40 113.55 121.13 2ac4 h SER 214 Ca -0.27 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.37 2ac4 h SER 214 Cb 1.12 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 62.98 2ac4 h SER 214 CO 0.79 0.74 -0.54 -1.61 -0.87 0.00 0.00 176.83 175.33 2ac4 s GLU 215 N -2.83 3.28 0.22 4.77 0.41 -1.26 -5.06 118.70 118.24 2ac4 s GLU 215 Ca 0.01 -0.76 -0.19 0.00 -0.41 0.00 0.00 54.97 53.62 2ac4 s GLU 215 Cb 0.09 -3.61 0.03 0.00 -1.78 0.00 0.00 34.13 28.85 2ac4 s GLU 215 CO 0.79 -0.46 0.59 1.52 -0.49 0.00 0.00 175.26 177.21 2ac4 s TYR 216 N 1.62 -0.14 0.10 1.61 1.13 -1.26 -2.64 117.35 117.76 2ac4 s TYR 216 Ca 0.04 -0.22 -0.09 0.00 -1.41 0.00 0.00 57.07 55.40 2ac4 s TYR 216 Cb -0.17 0.48 -0.00 0.00 -1.10 0.00 0.00 41.96 41.17 2ac4 s TYR 216 CO 0.07 -1.01 0.20 0.00 -2.51 0.00 0.00 175.55 172.30 2ac4 s ALA 217 N -3.89 -0.20 -0.13 9.51 0.00 0.77 -4.90 121.76 122.92 2ac4 s ALA 217 Ca 0.10 -0.65 -0.03 0.00 0.00 0.00 0.00 51.96 51.38 2ac4 s ALA 217 Cb -0.02 0.52 -0.03 0.00 0.00 0.00 0.00 23.12 23.59 2ac4 s ALA 217 CO -0.00 -0.52 -0.03 0.08 0.00 0.00 0.00 175.76 175.29 2ac4 s VAL 218 N -3.87 4.01 0.27 0.00 1.01 -1.26 -1.41 120.40 119.16 2ac4 s VAL 218 Ca 0.06 -0.33 0.03 0.00 0.00 0.00 0.00 61.98 61.74 2ac4 s VAL 218 Cb 0.05 -2.74 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 2ac4 s VAL 218 CO -0.10 0.52 0.19 -0.83 0.00 0.00 0.00 175.10 174.88 2ac4 s GLY 219 N 0.01 1.92 0.19 4.51 0.00 -0.49 -4.74 107.32 108.72 2ac4 s GLY 219 Ca 0.01 -1.84 0.05 0.00 0.00 0.00 0.00 44.72 42.94 2ac4 s GLY 219 CO 0.02 -1.48 -0.07 -0.98 0.00 0.00 0.00 173.10 170.59 2ac4 s TRP 220 N -3.76 1.47 0.32 1.90 0.52 -0.45 -3.47 118.94 115.47 2ac4 s TRP 220 Ca 0.39 -0.78 -0.10 0.00 0.02 0.00 0.00 56.10 55.63 2ac4 s TRP 220 Cb 0.05 -0.78 0.01 0.00 -1.15 0.00 0.00 33.47 31.60 2ac4 s TRP 220 CO 0.19 0.10 0.56 1.14 0.02 0.00 0.00 176.95 178.96 2ac4 s GLN 221 N -3.77 1.87 -1.63 4.98 -2.07 -1.00 0.73 119.66 118.76 2ac4 s GLN 221 Ca 0.22 -1.48 -0.16 0.00 -1.82 0.00 0.00 55.36 52.11 2ac4 s GLN 221 Cb 0.03 0.50 0.13 0.00 -1.09 0.00 0.00 33.01 32.58 2ac4 s GLN 221 CO 0.05 -0.81 0.86 0.43 -1.32 0.00 0.00 175.29 174.50 2ac4 n SER 222 N -1.04 -3.86 -4.77 12.60 7.64 -1.26 -1.08 113.62 121.86 2ac4 n SER 222 Ca -0.02 -0.92 -0.32 0.00 1.01 0.00 0.00 58.87 58.62 2ac4 n SER 222 Cb 0.61 -3.21 0.08 0.00 -1.01 0.00 0.00 64.21 60.69 2ac4 n SER 222 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2ac4 s GLU 223 N -6.80 2.38 0.01 1.43 -1.05 -1.26 -4.56 118.70 108.84 2ac4 s GLU 223 Ca 0.70 1.24 -0.00 0.00 -0.15 0.00 0.00 54.97 56.77 2ac4 s GLU 223 Cb -0.37 -1.91 0.00 0.00 -0.44 0.00 0.00 34.13 31.41 2ac4 s GLU 223 CO 0.89 -1.56 0.01 0.41 0.95 0.00 0.00 175.26 175.96 2ac4 n GLY 224 N -0.97 -0.38 2.84 -3.83 0.00 -1.26 -5.05 105.19 96.54 2ac4 n GLY 224 Ca 0.10 -1.78 -0.29 0.00 0.00 0.00 0.00 46.02 44.04 2ac4 n GLY 224 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2ac4 s ASN 225 N -1.05 4.06 0.17 1.61 3.04 -1.26 -5.04 114.94 116.48 2ac4 s ASN 225 Ca 0.01 -3.01 0.06 0.00 0.04 0.00 0.00 52.86 49.96 2ac4 s ASN 225 Cb -0.00 -1.39 -0.04 0.00 -1.54 0.00 0.00 41.25 38.28 2ac4 s ASN 225 CO 0.01 -0.22 -0.13 0.42 -3.04 0.00 0.00 177.10 174.14 2ac4 s THR 226 N -0.24 1.46 0.44 -5.21 -4.23 -1.26 -5.04 115.64 101.56 2ac4 s THR 226 Ca 0.19 -2.08 0.10 0.00 -1.18 0.00 0.00 61.69 58.72 2ac4 s THR 226 Cb -0.21 -1.89 0.26 0.00 1.34 0.00 0.00 72.50 71.99 2ac4 s THR 226 CO -0.03 -0.62 2.07 1.55 -0.54 0.00 0.00 174.62 177.05 2ac4 h PRO 227 N 2.79 0.34 -6.71 3.99 0.13 -2.08 -3.43 132.00 127.04 2ac4 h PRO 227 Ca -0.38 -0.03 -0.52 0.00 -0.87 0.00 0.00 66.00 64.21 2ac4 h PRO 227 Cb 1.21 -0.08 0.02 0.00 0.13 0.00 0.00 31.00 32.28 2ac4 h PRO 227 CO 0.61 0.25 0.55 -0.51 -0.23 0.00 0.00 178.00 178.66 2ac4 s ASP 228 N -6.82 7.10 0.28 1.44 1.01 -1.26 -4.98 116.67 113.44 2ac4 s ASP 228 Ca -0.07 2.27 -0.30 0.00 0.71 0.00 0.00 52.55 55.16 2ac4 s ASP 228 Cb 0.17 -2.61 -0.13 0.00 1.01 0.00 0.00 42.92 41.36 2ac4 s ASP 228 CO 0.71 -0.33 1.41 -0.81 0.21 0.00 0.00 175.17 176.35 2ac4 n PRO 229 N 2.14 2.18 -3.98 8.23 -0.04 -1.26 -4.86 135.00 137.40 2ac4 n PRO 229 Ca 0.03 0.77 -0.21 0.00 -0.04 0.00 0.00 63.50 64.05 2ac4 n PRO 229 Cb 0.44 -2.43 -0.03 0.00 -0.04 0.00 0.00 33.50 31.44 2ac4 n PRO 229 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2ac4 s TRP 230 N -0.34 3.20 0.36 0.54 0.52 -1.26 -0.62 118.94 121.33 2ac4 s TRP 230 Ca 0.64 -0.11 -0.28 0.00 0.02 0.00 0.00 56.10 56.36 2ac4 s TRP 230 Cb -0.60 -1.56 -0.12 0.00 -1.15 0.00 0.00 33.47 30.05 2ac4 s TRP 230 CO 0.53 0.41 1.43 1.28 0.02 0.00 0.00 176.95 180.61 2ac4 n LEU 231 N -1.32 4.31 0.00 2.99 4.77 0.18 -4.63 117.00 123.30 2ac4 n LEU 231 Ca -0.07 1.21 -0.17 0.00 -0.03 0.00 0.00 56.01 56.96 2ac4 n LEU 231 Cb 0.58 -1.57 -0.06 0.00 -2.33 0.00 0.00 43.42 40.04 2ac4 n LEU 231 CO 0.43 -0.07 -0.03 0.61 -1.33 0.00 0.00 177.39 177.01 2ac4 n GLY 232 N 0.70 2.80 3.85 -0.72 0.00 -1.26 -4.66 105.19 105.90 2ac4 n GLY 232 Ca 0.03 -1.80 -0.32 0.00 0.00 0.00 0.00 46.02 43.93 2ac4 n GLY 232 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ac4 s PRO 233 N -3.11 3.88 0.40 1.61 0.04 -1.26 -4.84 135.00 131.73 2ac4 s PRO 233 Ca 0.34 0.91 -0.25 0.00 0.04 0.00 0.00 61.00 62.03 2ac4 s PRO 233 Cb 0.01 -2.13 -0.08 0.00 0.04 0.00 0.00 34.50 32.34 2ac4 s PRO 233 CO 0.24 -0.32 1.20 0.34 0.04 0.00 0.00 177.00 178.50 2ac4 s ASP 234 N -3.28 6.46 0.49 6.66 2.15 -1.26 -1.33 116.67 126.57 2ac4 s ASP 234 Ca 0.58 2.42 0.27 0.00 0.43 0.00 0.00 52.55 56.24 2ac4 s ASP 234 Cb -0.10 -2.62 1.34 0.00 -0.30 0.00 0.00 42.92 41.24 2ac4 s ASP 234 CO 0.35 -0.72 1.87 -0.37 -0.17 0.00 0.00 175.17 176.14 2ac4 h VAL 235 N 2.34 0.59 -0.12 1.11 -1.51 -0.04 -1.30 116.25 117.33 2ac4 h VAL 235 Ca -0.49 -0.05 -0.01 0.00 -1.23 0.00 0.00 66.70 64.92 2ac4 h VAL 235 Cb 1.24 0.44 -0.00 0.00 -2.13 0.00 0.00 31.29 30.83 2ac4 h VAL 235 CO 0.62 0.03 0.02 1.56 -1.23 0.00 0.00 177.57 178.57 2ac4 h GLN 236 N 0.14 0.20 -0.19 5.19 4.20 -1.91 -1.45 115.11 121.29 2ac4 h GLN 236 Ca 0.44 -0.06 -0.17 0.00 0.06 0.00 0.00 58.65 58.93 2ac4 h GLN 236 Cb 1.53 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 29.28 2ac4 h GLN 236 CO -0.07 0.40 -0.57 -0.44 -0.67 0.00 0.00 178.83 177.48 2ac4 h ASP 237 N -0.03 0.68 -0.41 1.46 3.32 -1.74 -2.87 116.42 116.83 2ac4 h ASP 237 Ca 0.04 -0.37 0.01 0.00 0.02 0.00 0.00 57.03 56.73 2ac4 h ASP 237 Cb 0.30 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 2ac4 h ASP 237 CO 0.00 1.11 0.25 0.25 -1.72 0.00 0.00 179.24 179.13 2ac4 h LEU 238 N 0.46 0.41 0.24 1.55 5.85 -1.22 0.32 115.31 122.92 2ac4 h LEU 238 Ca 0.00 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 2ac4 h LEU 238 Cb 1.13 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.07 2ac4 h LEU 238 CO 0.11 0.30 -0.14 0.74 -0.34 0.00 0.00 178.44 179.11 2ac4 h THR 239 N 0.51 0.71 -0.67 1.05 2.02 -1.23 0.23 112.91 115.53 2ac4 h THR 239 Ca 0.16 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.27 2ac4 h THR 239 Cb -0.01 0.71 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 2ac4 h THR 239 CO -0.06 0.00 0.15 -0.09 0.37 0.00 0.00 175.52 175.88 2ac4 h ARG 240 N -0.35 1.08 0.01 6.66 2.43 -1.35 -0.91 114.38 121.94 2ac4 h ARG 240 Ca -0.03 -0.26 -0.00 0.00 -0.81 0.00 0.00 59.98 58.88 2ac4 h ARG 240 Cb 0.29 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 2ac4 h ARG 240 CO 0.03 0.96 -0.00 0.22 -1.51 0.00 0.00 179.97 179.67 2ac4 h ASP 241 N 1.02 -0.01 -0.96 -3.80 3.58 -0.09 -0.40 116.42 115.76 2ac4 h ASP 241 Ca 0.21 -0.18 0.04 0.00 0.42 0.00 0.00 57.03 57.52 2ac4 h ASP 241 Cb 0.38 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.38 2ac4 h ASP 241 CO 0.01 0.17 0.63 -0.07 -2.88 0.00 0.00 179.24 177.10 2ac4 h LEU 242 N -0.19 1.05 -0.28 2.28 3.38 -0.39 -2.09 115.31 119.06 2ac4 h LEU 242 Ca -0.00 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 2ac4 h LEU 242 Cb 0.18 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2ac4 h LEU 242 CO 0.00 0.71 0.04 0.15 0.09 0.00 0.00 178.44 179.44 2ac4 h PHE 243 N 1.21 0.50 0.00 1.13 3.57 -0.98 -1.35 116.94 121.03 2ac4 h PHE 243 Ca 0.39 -0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.80 2ac4 h PHE 243 Cb 0.01 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 38.61 2ac4 h PHE 243 CO -0.01 0.57 -0.08 0.93 -2.23 0.00 0.00 178.31 177.50 2ac4 h GLU 244 N 0.29 0.00 0.00 1.11 5.08 -0.68 0.53 114.58 120.91 2ac4 h GLU 244 Ca 0.09 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.22 2ac4 h GLU 244 Cb 0.34 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.55 2ac4 h GLU 244 CO 0.01 0.08 -1.74 0.00 -1.00 0.00 0.00 179.01 176.36 2ac4 n GLN 245 N -4.17 0.64 0.00 2.33 10.64 -0.82 -4.68 117.38 121.31 2ac4 n GLN 245 Ca -0.03 0.15 0.00 0.00 -1.83 0.00 0.00 57.00 55.29 2ac4 n GLN 245 Cb 0.16 -1.72 0.00 0.00 -0.86 0.00 0.00 30.24 27.82 2ac4 n GLN 245 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 2ac4 n LYS 246 N -2.83 0.22 -3.48 2.61 5.02 -0.53 -5.07 118.16 114.10 2ac4 n LYS 246 Ca -0.16 -0.08 -0.24 0.00 -2.02 0.00 0.00 58.31 55.82 2ac4 n LYS 246 Cb 0.93 -0.47 0.07 0.00 -0.02 0.00 0.00 35.03 35.53 2ac4 n LYS 246 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ac4 n GLY 247 N 0.05 -0.54 3.63 0.72 0.00 0.18 -4.96 105.19 104.27 2ac4 n GLY 247 Ca 0.00 0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 2ac4 n GLY 247 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2ac4 n TYR 248 N -4.91 1.45 0.84 1.61 4.01 -1.26 -4.91 117.16 113.99 2ac4 n TYR 248 Ca -0.02 0.56 0.11 0.00 -0.16 0.00 0.00 57.90 58.40 2ac4 n TYR 248 Cb 0.57 -2.27 0.09 0.00 -0.31 0.00 0.00 39.34 37.41 2ac4 n TYR 248 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2ac4 n GLN 249 N 0.23 0.10 -3.70 -0.72 6.02 0.11 -4.79 117.38 114.63 2ac4 n GLN 249 Ca 0.08 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.95 2ac4 n GLN 249 Cb 0.38 -1.54 -0.09 0.00 1.02 0.00 0.00 30.24 30.01 2ac4 n GLN 249 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ac4 s ALA 250 N -3.07 -1.23 -0.10 -1.58 0.00 -1.21 -0.17 121.76 114.41 2ac4 s ALA 250 Ca 0.08 1.48 0.03 0.00 0.00 0.00 0.00 51.96 53.55 2ac4 s ALA 250 Cb 0.16 -0.87 -0.01 0.00 0.00 0.00 0.00 23.12 22.40 2ac4 s ALA 250 CO 0.77 -0.25 -0.20 -0.06 0.00 0.00 0.00 175.76 176.03 2ac4 s PHE 251 N 0.56 2.63 -0.25 0.00 0.40 -0.14 -0.69 117.98 120.48 2ac4 s PHE 251 Ca -0.02 -0.81 -0.06 0.00 -0.60 0.00 0.00 56.93 55.44 2ac4 s PHE 251 Cb -0.04 -1.73 -0.01 0.00 0.51 0.00 0.00 43.02 41.74 2ac4 s PHE 251 CO -0.03 -0.28 0.04 0.08 0.70 0.00 0.00 175.22 175.73 2ac4 s VAL 252 N 0.19 3.93 -0.25 -0.44 1.01 -0.01 -1.68 120.40 123.15 2ac4 s VAL 252 Ca -0.12 -0.43 -0.09 0.00 0.00 0.00 0.00 61.98 61.34 2ac4 s VAL 252 Cb -0.16 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.29 2ac4 s VAL 252 CO 0.07 0.28 0.13 -0.31 0.00 0.00 0.00 175.10 175.26 2ac4 s TYR 253 N 1.54 3.19 -0.46 5.22 1.51 0.46 -0.50 117.35 128.31 2ac4 s TYR 253 Ca 0.05 -0.06 0.04 0.00 -1.01 0.00 0.00 57.07 56.09 2ac4 s TYR 253 Cb -0.15 -2.27 0.12 0.00 -0.11 0.00 0.00 41.96 39.55 2ac4 s TYR 253 CO 0.01 -0.15 0.19 0.08 -1.11 0.00 0.00 175.55 174.58 2ac4 s VAL 254 N 1.40 2.53 -1.47 0.71 1.01 -0.50 -3.86 120.40 120.23 2ac4 s VAL 254 Ca 0.06 -2.98 -0.10 0.00 0.00 0.00 0.00 61.98 58.97 2ac4 s VAL 254 Cb -0.15 -2.79 -0.07 0.00 0.00 0.00 0.00 36.38 33.37 2ac4 s VAL 254 CO 0.06 -0.73 2.73 -2.65 0.00 0.00 0.00 175.10 174.51 2ac4 n PRO 255 N 3.51 3.30 -0.16 2.72 -0.02 -1.26 -1.46 135.00 141.64 2ac4 n PRO 255 Ca 0.05 -2.08 0.29 0.00 -2.02 0.00 0.00 63.50 59.73 2ac4 n PRO 255 Cb 0.36 -2.77 0.67 0.00 -0.02 0.00 0.00 33.50 31.73 2ac4 n PRO 255 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 2ac4 h VAL 256 N 3.19 0.26 0.00 -1.45 3.04 -1.77 0.64 116.25 120.15 2ac4 h VAL 256 Ca 0.78 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 66.46 2ac4 h VAL 256 Cb 0.29 0.37 -0.00 0.00 -2.01 0.00 0.00 31.29 29.94 2ac4 h VAL 256 CO 1.74 0.00 -0.03 1.23 -1.01 0.00 0.00 177.57 179.50 2ac4 h GLY 257 N 0.00 0.00 -4.22 3.17 0.00 -1.66 -3.44 103.07 96.92 2ac4 h GLY 257 Ca 0.42 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 47.16 2ac4 h GLY 257 CO -0.00 0.00 -0.55 -1.36 0.00 0.00 0.00 176.54 174.62 2ac4 s PHE 258 N -3.83 3.26 -0.16 5.60 0.08 0.22 -4.41 117.98 118.73 2ac4 s PHE 258 Ca -0.01 0.07 0.01 0.00 0.12 0.00 0.00 56.93 57.12 2ac4 s PHE 258 Cb 0.10 -1.60 0.01 0.00 -0.57 0.00 0.00 43.02 40.96 2ac4 s PHE 258 CO 0.52 0.53 0.54 1.33 -0.10 0.00 0.00 175.22 178.04 2ac4 n VAL 259 N -0.06 0.00 -3.96 -0.44 0.24 -1.26 -4.82 118.33 108.03 2ac4 n VAL 259 Ca -0.08 -0.50 -0.10 0.00 -2.04 0.00 0.00 64.34 61.63 2ac4 n VAL 259 Cb 0.53 1.03 -0.06 0.00 -1.47 0.00 0.00 33.84 33.87 2ac4 n VAL 259 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ac4 s ALA 260 N -0.11 -0.09 -0.99 2.33 0.00 -1.26 -0.33 121.76 121.31 2ac4 s ALA 260 Ca 0.02 -0.86 -0.19 0.00 0.00 0.00 0.00 51.96 50.92 2ac4 s ALA 260 Cb 0.01 0.96 -0.10 0.00 0.00 0.00 0.00 23.12 23.99 2ac4 s ALA 260 CO 0.02 -0.72 2.03 -0.25 0.00 0.00 0.00 175.76 176.84 2ac4 n ASP 261 N -0.28 3.04 -4.59 0.00 9.92 -1.26 -4.81 116.55 118.57 2ac4 n ASP 261 Ca -0.05 -2.72 -0.19 0.00 -0.53 0.00 0.00 54.79 51.30 2ac4 n ASP 261 Cb 0.63 -1.28 0.04 0.00 -0.64 0.00 0.00 41.12 39.87 2ac4 n ASP 261 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 2ac4 n HIS 262 N 6.94 -1.89 -0.28 1.24 8.25 -1.26 -4.78 115.22 123.44 2ac4 n HIS 262 Ca 0.50 -1.94 0.10 0.00 -0.26 0.00 0.00 57.72 56.12 2ac4 n HIS 262 Cb 0.39 -0.46 0.34 0.00 1.12 0.00 0.00 29.99 31.37 2ac4 n HIS 262 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2ac4 h LEU 263 N 0.00 0.73 -2.12 2.41 5.85 -1.97 -0.43 115.31 119.78 2ac4 h LEU 263 Ca -0.26 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.48 2ac4 h LEU 263 Cb 1.12 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.03 2ac4 h LEU 263 CO 0.38 0.39 -0.08 -0.33 -0.34 0.00 0.00 178.44 178.47 2ac4 h GLU 264 N 0.78 0.00 0.00 1.25 3.07 -1.95 -0.63 114.58 117.11 2ac4 h GLU 264 Ca 0.44 0.00 -0.44 0.00 -0.50 0.00 0.00 59.36 58.86 2ac4 h GLU 264 Cb 0.58 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.43 2ac4 h GLU 264 CO -0.20 0.08 -2.48 0.28 -1.40 0.00 0.00 179.01 175.28 2ac4 n VAL 265 N -3.73 1.46 -0.02 3.13 0.31 -0.64 -3.31 118.33 115.52 2ac4 n VAL 265 Ca -0.02 -0.39 0.02 0.00 -0.01 0.00 0.00 64.34 63.94 2ac4 n VAL 265 Cb 0.18 -1.82 0.37 0.00 -0.91 0.00 0.00 33.84 31.66 2ac4 n VAL 265 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2ac4 h LEU 266 N -0.87 0.51 0.00 7.52 3.38 -1.15 -0.22 115.31 124.48 2ac4 h LEU 266 Ca -0.67 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.26 2ac4 h LEU 266 Cb 1.62 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 42.24 2ac4 h LEU 266 CO -0.38 0.44 -0.79 0.00 0.09 0.00 0.00 178.44 177.80 2ac4 n TYR 267 N -4.41 0.00 0.29 1.13 9.36 -0.26 -3.36 117.16 119.91 2ac4 n TYR 267 Ca 0.03 0.00 0.18 0.00 3.32 0.00 0.00 57.90 61.43 2ac4 n TYR 267 Cb 0.12 -0.39 0.97 0.00 -0.63 0.00 0.00 39.34 39.41 2ac4 n TYR 267 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 2ac4 h ASP 268 N -0.79 0.00 0.00 2.98 3.32 -1.51 0.74 116.42 121.17 2ac4 h ASP 268 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2ac4 h ASP 268 Cb 0.79 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.34 2ac4 h ASP 268 CO 0.00 0.00 -0.13 0.59 -1.72 0.00 0.00 179.24 177.98 2ac4 n ASN 269 N -3.40 0.36 0.33 6.45 3.02 -0.93 -3.51 115.26 117.58 2ac4 n ASN 269 Ca -0.01 0.06 0.18 0.00 -0.03 0.00 0.00 54.58 54.78 2ac4 n ASN 269 Cb 0.21 -0.34 0.98 0.00 -0.61 0.00 0.00 39.78 40.02 2ac4 n ASN 269 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2ac4 h ASP 270 N -0.13 0.00 0.00 6.41 5.19 -1.13 -1.78 116.42 124.98 2ac4 h ASP 270 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2ac4 h ASP 270 Cb 0.13 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.64 2ac4 h ASP 270 CO 0.00 0.00 -0.36 0.00 -3.12 0.00 0.00 179.24 175.76 2ac4 n TYR 271 N -3.02 0.00 -0.04 4.55 9.36 -0.00 -4.39 117.16 123.62 2ac4 n TYR 271 Ca -0.02 0.00 -0.10 0.00 3.32 0.00 0.00 57.90 61.10 2ac4 n TYR 271 Cb 0.26 -0.18 -0.03 0.00 -0.63 0.00 0.00 39.34 38.76 2ac4 n TYR 271 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 2ac4 h GLU 272 N -0.36 0.21 -0.05 2.98 5.08 -1.01 0.20 114.58 121.62 2ac4 h GLU 272 Ca 0.00 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.23 2ac4 h GLU 272 Cb 0.36 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2ac4 h GLU 272 CO 0.00 0.14 -0.51 0.00 -1.00 0.00 0.00 179.01 177.63 2ac4 h LYS 274 N 0.11 0.95 -0.50 0.00 1.63 -1.18 -0.31 116.57 117.26 2ac4 h LYS 274 Ca 0.00 -0.25 0.04 0.00 -0.85 0.00 0.00 60.65 59.59 2ac4 h LYS 274 Cb 0.94 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 32.42 2ac4 h LYS 274 CO 0.07 0.90 0.25 0.28 -3.45 0.00 0.00 179.45 177.51 2ac4 h VAL 275 N 0.89 0.97 -0.12 2.00 2.07 -0.39 0.62 116.25 122.29 2ac4 h VAL 275 Ca 0.18 -0.17 -0.04 0.00 0.82 0.00 0.00 66.70 67.49 2ac4 h VAL 275 Cb 0.44 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 2ac4 h VAL 275 CO 0.01 0.09 -0.08 0.58 0.02 0.00 0.00 177.57 178.20 2ac4 h VAL 276 N 0.50 1.33 -0.72 2.57 2.07 -1.29 -0.73 116.25 119.98 2ac4 h VAL 276 Ca 0.22 -1.16 -0.02 0.00 0.82 0.00 0.00 66.70 66.55 2ac4 h VAL 276 Cb 0.12 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.71 2ac4 h VAL 276 CO -0.15 0.33 0.35 0.71 0.02 0.00 0.00 177.57 178.84 2ac4 h THR 277 N -0.11 1.23 -0.56 2.57 1.35 -0.91 -0.31 112.91 116.16 2ac4 h THR 277 Ca 0.02 -0.63 -0.05 0.00 -0.55 0.00 0.00 66.41 65.20 2ac4 h THR 277 Cb 0.56 0.30 -0.02 0.00 -1.73 0.00 0.00 68.15 67.26 2ac4 h THR 277 CO 0.02 0.27 0.16 0.44 -0.25 0.00 0.00 175.52 176.16 2ac4 h ASP 278 N 1.02 0.84 -0.78 5.36 5.19 -0.83 0.23 116.42 127.44 2ac4 h ASP 278 Ca 0.25 -0.22 -0.02 0.00 -0.62 0.00 0.00 57.03 56.43 2ac4 h ASP 278 Cb 0.10 -0.22 -0.04 0.00 0.18 0.00 0.00 39.33 39.35 2ac4 h ASP 278 CO -0.03 0.84 0.43 -0.78 -3.12 0.00 0.00 179.24 176.57 2ac4 h ASP 279 N 0.80 0.98 0.72 6.45 3.58 -0.26 -2.37 116.42 126.33 2ac4 h ASP 279 Ca 0.18 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.53 2ac4 h ASP 279 Cb 0.31 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.11 2ac4 h ASP 279 CO -0.00 0.80 -0.31 2.30 -2.88 0.00 0.00 179.24 179.14 2ac4 n ILE 280 N -4.43 0.03 -0.70 2.25 -5.35 -0.21 -4.95 119.36 106.00 2ac4 n ILE 280 Ca 0.07 -0.02 0.00 0.00 -0.27 0.00 0.00 62.75 62.53 2ac4 n ILE 280 Cb 0.09 -0.06 0.00 0.00 -1.74 0.00 0.00 39.64 37.93 2ac4 n ILE 280 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ac4 n GLY 281 N 1.49 0.59 3.98 3.28 0.00 0.52 -5.07 105.19 109.98 2ac4 n GLY 281 Ca 0.06 -0.51 -0.21 0.00 0.00 0.00 0.00 46.02 45.37 2ac4 n GLY 281 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ac4 s ALA 282 N -2.00 4.03 0.15 4.61 0.00 0.33 -4.99 121.76 123.89 2ac4 s ALA 282 Ca 0.00 -1.32 -0.21 0.00 0.00 0.00 0.00 51.96 50.43 2ac4 s ALA 282 Cb 0.00 -1.93 -0.08 0.00 0.00 0.00 0.00 23.12 21.12 2ac4 s ALA 282 CO 0.00 -0.35 0.68 -1.12 0.00 0.00 0.00 175.76 174.97 2ac4 s SER 283 N -4.27 7.16 -0.17 0.00 0.01 0.77 -4.31 113.70 112.88 2ac4 s SER 283 Ca 0.50 1.42 -0.08 0.00 1.31 0.00 0.00 55.95 59.11 2ac4 s SER 283 Cb -0.10 -2.42 -0.04 0.00 0.21 0.00 0.00 66.02 63.67 2ac4 s SER 283 CO 0.35 0.18 0.08 -0.47 0.41 0.00 0.00 173.24 173.79 2ac4 s TYR 284 N -1.26 3.32 -0.01 2.43 5.04 -1.26 -0.97 117.35 124.64 2ac4 s TYR 284 Ca 0.36 0.19 0.00 0.00 -2.44 0.00 0.00 57.07 55.18 2ac4 s TYR 284 Cb -0.20 -2.06 0.01 0.00 0.35 0.00 0.00 41.96 40.07 2ac4 s TYR 284 CO 0.22 0.28 0.01 0.71 -1.34 0.00 0.00 175.55 175.43 2ac4 s TYR 285 N 0.10 0.08 -0.31 4.97 2.02 -0.68 -4.98 117.35 118.56 2ac4 s TYR 285 Ca 0.06 0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.81 2ac4 s TYR 285 Cb -0.12 -0.16 0.14 0.00 -0.40 0.00 0.00 41.96 41.43 2ac4 s TYR 285 CO 0.00 -0.05 0.32 0.50 -1.57 0.00 0.00 175.55 174.75 2ac4 s ARG 286 N 0.50 0.40 0.79 -0.62 3.00 -1.26 -0.40 118.95 121.35 2ac4 s ARG 286 Ca -0.04 -0.29 -0.15 0.00 -1.00 0.00 0.00 55.73 54.24 2ac4 s ARG 286 Cb -0.06 -0.65 -0.03 0.00 0.00 0.00 0.00 34.95 34.21 2ac4 s ARG 286 CO -0.01 -1.07 0.44 -2.30 0.00 0.00 0.00 175.30 172.35 2ac4 n PRO 287 N 5.07 0.14 -1.65 5.12 -0.02 -1.25 -4.88 135.00 137.52 2ac4 n PRO 287 Ca 0.01 0.09 -0.46 0.00 -2.02 0.00 0.00 63.50 61.12 2ac4 n PRO 287 Cb 0.46 -1.79 -0.04 0.00 -0.02 0.00 0.00 33.50 32.11 2ac4 n PRO 287 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2ac4 n GLU 288 N -0.81 1.92 -2.01 -0.52 4.07 -1.26 -4.96 120.64 117.07 2ac4 n GLU 288 Ca 0.09 0.69 -0.32 0.00 -0.06 0.00 0.00 57.16 57.55 2ac4 n GLU 288 Cb 0.51 -2.38 0.01 0.00 -0.06 0.00 0.00 31.44 29.52 2ac4 n GLU 288 CO 0.00 0.00 0.00 -1.64 -0.06 0.00 0.00 177.13 175.43 2ac4 s MET 289 N 0.24 3.34 0.15 5.31 -1.94 -1.26 -4.96 119.30 120.17 2ac4 s MET 289 Ca 0.75 1.13 -0.19 0.00 -1.71 0.00 0.00 55.69 55.67 2ac4 s MET 289 Cb -0.71 -2.04 0.04 0.00 2.01 0.00 0.00 34.83 34.13 2ac4 s MET 289 CO 0.45 -0.79 1.67 -1.35 -0.01 0.00 0.00 175.02 174.99 2ac4 h PRO 290 N 0.31 -0.04 0.00 2.03 0.11 -1.88 -3.46 132.00 129.07 2ac4 h PRO 290 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2ac4 h PRO 290 Cb 1.21 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2ac4 h PRO 290 CO 0.58 -0.03 0.00 0.09 -0.21 0.00 0.00 178.00 178.43 2ac4 n ASN 291 N -5.28 0.00 -0.90 -2.05 3.02 0.56 -2.29 115.26 108.31 2ac4 n ASN 291 Ca 0.00 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.59 2ac4 n ASN 291 Cb 0.20 0.00 0.22 0.00 -0.61 0.00 0.00 39.78 39.59 2ac4 n ASN 291 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ac4 n ALA 292 N 10.56 3.44 -1.78 5.41 0.00 -1.26 -4.83 120.51 132.05 2ac4 n ALA 292 Ca 0.00 -2.69 -0.41 0.00 0.00 0.00 0.00 53.44 50.34 2ac4 n ALA 292 Cb 0.00 -0.68 -0.02 0.00 0.00 0.00 0.00 19.45 18.75 2ac4 n ALA 292 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2ac4 s LYS 293 N -3.01 4.34 0.34 0.00 1.02 -0.97 -4.77 119.74 116.69 2ac4 s LYS 293 Ca 0.42 2.24 0.12 0.00 0.02 0.00 0.00 55.97 58.77 2ac4 s LYS 293 Cb 0.36 -3.07 1.07 0.00 -0.52 0.00 0.00 37.83 35.67 2ac4 s LYS 293 CO 0.04 -0.22 1.57 -1.35 -0.92 0.00 0.00 175.35 174.48 2ac4 h PRO 294 N 3.47 0.00 -0.63 -1.68 0.11 -1.96 0.25 132.00 131.56 2ac4 h PRO 294 Ca -0.49 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 2ac4 h PRO 294 Cb 1.23 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 2ac4 h PRO 294 CO 0.66 0.00 0.24 1.49 -0.21 0.00 0.00 178.00 180.18 2ac4 h GLU 295 N 0.00 0.95 -0.03 1.05 4.81 -1.96 -1.51 114.58 117.90 2ac4 h GLU 295 Ca 0.73 -0.18 -0.00 0.00 -0.13 0.00 0.00 59.36 59.78 2ac4 h GLU 295 Cb 1.77 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 31.00 2ac4 h GLU 295 CO -0.85 0.81 0.00 0.35 -0.73 0.00 0.00 179.01 178.60 2ac4 h PHE 296 N 0.89 0.05 -0.98 0.92 3.57 -0.85 -2.57 116.94 117.96 2ac4 h PHE 296 Ca 0.21 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.84 2ac4 h PHE 296 Cb 0.23 -0.01 -0.09 0.00 2.79 0.00 0.00 35.95 38.86 2ac4 h PHE 296 CO 0.01 0.30 0.61 0.82 -2.23 0.00 0.00 178.31 177.82 2ac4 h ILE 297 N -0.21 0.87 -0.59 1.41 1.08 -1.18 -0.87 117.51 118.01 2ac4 h ILE 297 Ca 0.01 -0.32 -0.09 0.00 -0.39 0.00 0.00 64.86 64.08 2ac4 h ILE 297 Cb 0.28 -0.13 -0.02 0.00 -3.07 0.00 0.00 36.82 33.87 2ac4 h ILE 297 CO 0.00 0.17 0.03 -0.78 -0.69 0.00 0.00 178.15 176.88 2ac4 h ASP 298 N 0.92 1.00 -0.25 1.72 3.58 -1.16 0.61 116.42 122.84 2ac4 h ASP 298 Ca 0.51 -0.29 0.00 0.00 0.42 0.00 0.00 57.03 57.67 2ac4 h ASP 298 Cb 0.57 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.34 2ac4 h ASP 298 CO -0.29 1.04 0.16 0.00 -2.88 0.00 0.00 179.24 177.27 2ac4 h ALA 299 N 0.99 0.31 -0.60 -0.78 0.00 -0.84 -0.60 119.26 117.73 2ac4 h ALA 299 Ca 0.17 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 2ac4 h ALA 299 Cb 0.51 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 2ac4 h ALA 299 CO 0.02 -0.22 0.14 -0.07 0.00 0.00 0.00 179.25 179.13 2ac4 h LEU 300 N 0.33 0.89 -0.51 0.00 3.38 -0.96 -1.21 115.31 117.23 2ac4 h LEU 300 Ca 0.09 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.90 2ac4 h LEU 300 Cb -0.03 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 2ac4 h LEU 300 CO -0.02 0.86 0.34 0.00 0.09 0.00 0.00 178.44 179.70 2ac4 h ALA 301 N 1.25 0.65 -0.83 1.53 0.00 -0.44 -1.31 119.26 120.11 2ac4 h ALA 301 Ca 0.19 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2ac4 h ALA 301 Cb 0.33 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2ac4 h ALA 301 CO 0.00 0.08 0.40 1.15 0.00 0.00 0.00 179.25 180.88 2ac4 h THR 302 N 0.69 1.26 -0.18 0.00 2.02 -0.65 -0.73 112.91 115.31 2ac4 h THR 302 Ca 0.19 -0.71 0.03 0.00 0.77 0.00 0.00 66.41 66.69 2ac4 h THR 302 Cb -0.07 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 66.51 2ac4 h THR 302 CO -0.04 0.31 -0.02 0.58 0.37 0.00 0.00 175.52 176.71 2ac4 h VAL 303 N 1.17 0.85 -0.29 3.16 2.07 -0.53 0.19 116.25 122.88 2ac4 h VAL 303 Ca 0.28 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.78 2ac4 h VAL 303 Cb 0.11 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 2ac4 h VAL 303 CO -0.04 0.01 0.13 0.58 0.02 0.00 0.00 177.57 178.27 2ac4 h VAL 304 N 0.04 1.16 -0.76 2.57 2.07 -0.91 -1.69 116.25 118.72 2ac4 h VAL 304 Ca 0.09 -0.47 -0.05 0.00 0.82 0.00 0.00 66.70 67.09 2ac4 h VAL 304 Cb 0.12 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 2ac4 h VAL 304 CO -0.16 0.16 0.27 -0.07 0.02 0.00 0.00 177.57 177.80 2ac4 h LEU 305 N 0.33 1.07 -0.73 2.57 3.38 -0.81 -2.24 115.31 118.88 2ac4 h LEU 305 Ca 0.10 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2ac4 h LEU 305 Cb 0.14 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 2ac4 h LEU 305 CO -0.01 0.97 0.40 0.11 0.09 0.00 0.00 178.44 180.01 2ac4 h LYS 306 N 1.11 1.02 -0.16 1.13 1.57 -0.46 0.29 116.57 121.06 2ac4 h LYS 306 Ca 0.25 -0.12 0.04 0.00 -1.87 0.00 0.00 60.65 58.95 2ac4 h LYS 306 Cb 0.26 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2ac4 h LYS 306 CO -0.01 0.76 0.11 -0.22 -0.57 0.00 0.00 179.45 179.52 2ac4 h LYS 307 N 1.01 0.05 -0.27 3.15 1.63 -0.73 -1.11 116.57 120.30 2ac4 h LYS 307 Ca 0.26 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.06 2ac4 h LYS 307 Cb 0.03 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.65 2ac4 h LYS 307 CO -0.04 0.03 0.00 1.28 -3.45 0.00 0.00 179.45 177.27 2ac4 n LEU 308 N -4.50 2.32 -0.53 5.20 4.77 -0.69 -4.92 117.00 118.65 2ac4 n LEU 308 Ca 0.01 -1.00 -0.06 0.00 -0.03 0.00 0.00 56.01 54.92 2ac4 n LEU 308 Cb 0.21 -0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 41.11 2ac4 n LEU 308 CO 0.35 0.50 -0.06 0.61 -1.33 0.00 0.00 177.39 177.45 2ac4 n GLY 309 N 1.26 0.75 0.07 -0.72 0.00 -0.42 -5.08 105.19 101.04 2ac4 n GLY 309 Ca 0.17 -0.74 0.01 0.00 0.00 0.00 0.00 46.02 45.46 2ac4 n GLY 309 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86