#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ab4 s LYS 2 N 0.00 4.19 -0.08 2.12 3.01 -1.26 -5.08 119.74 122.64 2ab4 s LYS 2 Ca 0.00 0.90 -0.01 0.00 -1.01 0.00 0.00 55.97 55.85 2ab4 s LYS 2 Cb 0.00 -2.54 0.03 0.00 -1.01 0.00 0.00 37.83 34.31 2ab4 s LYS 2 CO 0.00 0.19 -0.02 -1.01 0.51 0.00 0.00 175.35 175.02 2ab4 s HIS 3 N -1.86 0.93 -4.54 3.18 3.76 -1.26 -4.56 115.29 110.93 2ab4 s HIS 3 Ca 0.53 -0.35 0.00 0.00 -0.15 0.00 0.00 55.06 55.09 2ab4 s HIS 3 Cb -0.13 -0.94 0.00 0.00 1.11 0.00 0.00 32.58 32.63 2ab4 s HIS 3 CO 0.18 -0.38 0.00 0.41 -0.85 0.00 0.00 174.74 174.10 2ab4 n GLY 4 N 5.07 -0.57 3.61 -2.22 0.00 -1.09 -1.99 105.19 108.00 2ab4 n GLY 4 Ca -0.09 -1.08 -0.31 0.00 0.00 0.00 0.00 46.02 44.54 2ab4 n GLY 4 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ab4 s ILE 5 N -3.00 3.68 -0.15 -0.61 1.09 -0.49 -1.09 121.20 120.63 2ab4 s ILE 5 Ca 0.00 -0.92 0.00 0.00 -1.10 0.00 0.00 60.65 58.63 2ab4 s ILE 5 Cb 0.00 -2.66 0.03 0.00 -1.06 0.00 0.00 42.46 38.77 2ab4 s ILE 5 CO 0.00 0.27 -0.11 -0.22 -0.10 0.00 0.00 174.94 174.78 2ab4 s LEU 6 N -1.79 1.63 -0.88 2.97 1.98 0.19 0.34 118.68 123.12 2ab4 s LEU 6 Ca 0.20 -0.51 -0.25 0.00 -2.89 0.00 0.00 54.13 50.68 2ab4 s LEU 6 Cb -0.11 -1.07 0.03 0.00 0.66 0.00 0.00 46.19 45.70 2ab4 s LEU 6 CO 0.11 -0.10 1.45 -0.69 -1.89 0.00 0.00 176.35 175.24 2ab4 s VAL 7 N 1.55 3.77 0.40 1.68 1.01 -1.26 -1.17 120.40 126.38 2ab4 s VAL 7 Ca 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 2ab4 s VAL 7 Cb -0.13 -4.85 -0.03 0.00 0.00 0.00 0.00 36.38 31.37 2ab4 s VAL 7 CO -0.09 -1.76 0.63 0.00 0.00 0.00 0.00 175.10 173.87 2ab4 s ALA 8 N 5.95 3.65 -0.19 5.51 0.00 -0.71 -1.28 121.76 134.67 2ab4 s ALA 8 Ca 0.45 -0.86 -0.00 0.00 0.00 0.00 0.00 51.96 51.55 2ab4 s ALA 8 Cb -0.04 -2.22 0.01 0.00 0.00 0.00 0.00 23.12 20.87 2ab4 s ALA 8 CO 0.02 -0.19 -0.15 -0.47 0.00 0.00 0.00 175.76 174.97 2ab4 s TYR 9 N -2.47 2.83 -0.36 0.00 5.04 0.36 -0.50 117.35 122.25 2ab4 s TYR 9 Ca 0.44 -1.42 -0.16 0.00 -2.44 0.00 0.00 57.07 53.49 2ab4 s TYR 9 Cb -0.10 -1.97 -0.01 0.00 0.35 0.00 0.00 41.96 40.24 2ab4 s TYR 9 CO 0.38 -0.72 0.38 0.21 -1.34 0.00 0.00 175.55 174.46 2ab4 s LYS 10 N 1.32 3.47 0.95 4.97 2.20 -0.41 -4.37 119.74 127.86 2ab4 s LYS 10 Ca 0.05 -0.48 -0.11 0.00 -0.36 0.00 0.00 55.97 55.07 2ab4 s LYS 10 Cb -0.13 -3.84 0.16 0.00 -1.51 0.00 0.00 37.83 32.51 2ab4 s LYS 10 CO -0.10 -0.59 1.11 -2.14 -0.36 0.00 0.00 175.35 173.28 2ab4 s PRO 11 N 2.05 0.79 0.19 4.03 0.02 -1.26 -2.71 135.00 138.11 2ab4 s PRO 11 Ca 0.12 1.33 -0.30 0.00 0.02 0.00 0.00 61.00 62.17 2ab4 s PRO 11 Cb -0.17 -1.72 -0.08 0.00 0.02 0.00 0.00 34.50 32.55 2ab4 s PRO 11 CO 0.12 -2.71 1.27 0.21 -0.33 0.00 0.00 177.00 175.56 2ab4 s LYS 12 N -4.66 4.42 0.00 5.54 2.20 -1.26 -4.10 119.74 121.88 2ab4 s LYS 12 Ca 0.66 1.99 0.00 0.00 -0.36 0.00 0.00 55.97 58.27 2ab4 s LYS 12 Cb -0.22 -3.21 0.00 0.00 -1.51 0.00 0.00 37.83 32.89 2ab4 s LYS 12 CO 0.59 -0.20 0.00 0.41 -0.36 0.00 0.00 175.35 175.78 2ab4 n GLY 13 N 2.33 2.14 3.74 5.54 0.00 0.65 -5.02 105.19 114.56 2ab4 n GLY 13 Ca 0.06 -0.61 -0.33 0.00 0.00 0.00 0.00 46.02 45.14 2ab4 n GLY 13 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ab4 s PRO 14 N 0.00 2.20 0.79 1.61 0.04 -1.26 -4.60 135.00 133.79 2ab4 s PRO 14 Ca 0.00 1.53 -0.12 0.00 0.04 0.00 0.00 61.00 62.46 2ab4 s PRO 14 Cb 0.00 -1.86 0.07 0.00 0.04 0.00 0.00 34.50 32.74 2ab4 s PRO 14 CO 0.00 -1.74 1.13 0.95 0.04 0.00 0.00 177.00 177.38 2ab4 s THR 15 N -2.32 2.72 0.33 1.26 -4.23 -1.26 -4.36 115.64 107.78 2ab4 s THR 15 Ca 0.69 0.23 0.10 0.00 -1.18 0.00 0.00 61.69 61.53 2ab4 s THR 15 Cb -0.24 -3.12 0.07 0.00 1.34 0.00 0.00 72.50 70.55 2ab4 s THR 15 CO 0.47 -0.30 1.77 0.28 -0.54 0.00 0.00 174.62 176.30 2ab4 h SER 16 N -1.03 0.12 0.40 3.99 0.02 -1.92 -2.40 113.55 112.73 2ab4 h SER 16 Ca -0.47 -0.04 -0.12 0.00 -0.84 0.00 0.00 61.79 60.32 2ab4 h SER 16 Cb 1.29 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.79 2ab4 h SER 16 CO 0.63 0.50 -0.50 -0.74 -1.14 0.00 0.00 176.83 175.57 2ab4 h HIS 17 N 0.10 0.15 -0.91 3.45 -0.00 -1.94 -2.70 115.15 113.29 2ab4 h HIS 17 Ca 0.01 -0.05 0.08 0.00 -0.00 0.00 0.00 60.37 60.41 2ab4 h HIS 17 Cb 0.73 -0.03 -0.06 0.00 -0.00 0.00 0.00 27.41 28.05 2ab4 h HIS 17 CO 0.01 0.60 0.59 -0.44 -0.00 0.00 0.00 177.93 178.69 2ab4 h ASP 18 N 0.10 0.87 -0.17 3.26 3.45 -1.80 0.38 116.42 122.51 2ab4 h ASP 18 Ca 0.00 0.02 -0.10 0.00 0.43 0.00 0.00 57.03 57.37 2ab4 h ASP 18 Cb 0.93 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 39.52 2ab4 h ASP 18 CO 0.07 0.53 -0.24 0.58 -1.57 0.00 0.00 179.24 178.62 2ab4 h VAL 19 N 0.97 1.27 -0.56 -1.35 2.07 -1.47 -0.97 116.25 116.20 2ab4 h VAL 19 Ca 0.41 -1.30 -0.07 0.00 0.82 0.00 0.00 66.70 66.56 2ab4 h VAL 19 Cb 0.31 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 2ab4 h VAL 19 CO -0.17 0.42 0.08 0.58 0.02 0.00 0.00 177.57 178.50 2ab4 h VAL 20 N 0.55 1.26 -0.58 2.57 2.07 -0.82 -1.30 116.25 119.99 2ab4 h VAL 20 Ca 0.08 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.58 2ab4 h VAL 20 Cb 0.70 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 2ab4 h VAL 20 CO 0.05 0.36 0.29 0.44 0.02 0.00 0.00 177.57 178.73 2ab4 h ASP 21 N 0.83 0.76 -0.10 0.57 3.32 -0.66 0.14 116.42 121.29 2ab4 h ASP 21 Ca 0.17 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2ab4 h ASP 21 Cb 0.44 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 2ab4 h ASP 21 CO 0.01 0.67 0.05 -0.08 -1.72 0.00 0.00 179.24 178.18 2ab4 h GLU 22 N 0.79 0.11 -0.55 3.56 4.57 -0.93 0.10 114.58 122.24 2ab4 h GLU 22 Ca 0.20 -0.01 -0.09 0.00 -1.18 0.00 0.00 59.36 58.29 2ab4 h GLU 22 Cb 0.10 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.65 2ab4 h GLU 22 CO -0.03 0.08 -0.01 0.28 -1.18 0.00 0.00 179.01 178.14 2ab4 h VAL 23 N 0.12 1.26 0.00 0.32 2.07 -1.09 0.45 116.25 119.38 2ab4 h VAL 23 Ca 0.04 -1.11 -0.02 0.00 0.82 0.00 0.00 66.70 66.43 2ab4 h VAL 23 Cb -0.00 0.85 -0.00 0.00 -1.52 0.00 0.00 31.29 30.62 2ab4 h VAL 23 CO -0.02 0.40 -0.08 0.08 0.02 0.00 0.00 177.57 177.97 2ab4 h ARG 24 N 0.87 0.00 0.17 1.57 0.11 -0.38 -0.93 114.38 115.79 2ab4 h ARG 24 Ca 0.16 0.00 -0.34 0.00 0.10 0.00 0.00 59.98 59.90 2ab4 h ARG 24 Cb 0.53 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.62 2ab4 h ARG 24 CO 0.03 0.08 -1.72 0.87 0.10 0.00 0.00 179.97 179.33 2ab4 h LYS 25 N 0.00 0.36 -0.40 0.08 6.56 -0.60 -0.79 116.57 121.78 2ab4 h LYS 25 Ca -0.00 -0.62 -0.10 0.00 -1.06 0.00 0.00 60.65 58.88 2ab4 h LYS 25 Cb 0.63 0.23 -0.02 0.00 -0.57 0.00 0.00 32.23 32.50 2ab4 h LYS 25 CO 0.01 1.30 -0.15 0.87 -2.06 0.00 0.00 179.45 179.42 2ab4 h LYS 26 N 0.03 0.73 -0.04 3.15 1.79 -0.78 -2.99 116.57 118.46 2ab4 h LYS 26 Ca -0.35 -0.25 0.00 0.00 -2.18 0.00 0.00 60.65 57.87 2ab4 h LYS 26 Cb 2.04 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 32.63 2ab4 h LYS 26 CO 0.15 0.84 0.00 1.28 -1.08 0.00 0.00 179.45 180.64 2ab4 n LEU 27 N -4.15 2.59 -3.69 2.94 4.77 -0.37 -4.62 117.00 114.47 2ab4 n LEU 27 Ca 0.01 -0.88 -0.32 0.00 -0.03 0.00 0.00 56.01 54.80 2ab4 n LEU 27 Cb 0.38 -0.01 0.04 0.00 -2.33 0.00 0.00 43.42 41.50 2ab4 n LEU 27 CO 0.43 0.44 -0.08 0.29 -1.33 0.00 0.00 177.39 177.14 2ab4 n LYS 28 N 1.02 -1.27 -3.68 3.23 5.02 -0.89 -5.00 118.16 116.59 2ab4 n LYS 28 Ca 0.16 0.45 -0.14 0.00 -2.02 0.00 0.00 58.31 56.76 2ab4 n LYS 28 Cb 0.53 -4.12 -0.08 0.00 -0.02 0.00 0.00 35.03 31.33 2ab4 n LYS 28 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2ab4 s THR 29 N -3.47 0.01 -0.57 -0.18 2.01 -0.35 -5.04 115.64 108.04 2ab4 s THR 29 Ca 0.47 -0.07 0.23 0.00 0.31 0.00 0.00 61.69 62.63 2ab4 s THR 29 Cb -0.17 -0.75 -0.02 0.00 0.01 0.00 0.00 72.50 71.57 2ab4 s THR 29 CO 0.86 -0.04 1.16 0.54 -0.69 0.00 0.00 174.62 176.46 2ab4 n ARG 30 N 2.34 0.33 -2.65 4.92 5.12 -1.26 -4.42 116.66 121.04 2ab4 n ARG 30 Ca -0.15 0.05 -0.43 0.00 -1.93 0.00 0.00 57.85 55.39 2ab4 n ARG 30 Cb 0.56 -1.66 -0.00 0.00 -1.16 0.00 0.00 32.46 30.20 2ab4 n ARG 30 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2ab4 s LYS 31 N -3.21 3.99 -0.04 5.56 -0.14 -1.26 -4.90 119.74 119.75 2ab4 s LYS 31 Ca 0.04 -2.08 -0.07 0.00 -1.36 0.00 0.00 55.97 52.51 2ab4 s LYS 31 Cb 0.13 -5.44 0.01 0.00 -1.68 0.00 0.00 37.83 30.86 2ab4 s LYS 31 CO 0.76 -2.16 0.16 0.08 -0.76 0.00 0.00 175.35 173.43 2ab4 s VAL 32 N 3.74 0.03 0.33 3.17 1.01 -1.26 0.38 120.40 127.80 2ab4 s VAL 32 Ca 0.51 -0.25 -0.18 0.00 0.00 0.00 0.00 61.98 62.06 2ab4 s VAL 32 Cb 0.03 -0.32 0.03 0.00 0.00 0.00 0.00 36.38 36.12 2ab4 s VAL 32 CO 0.06 -0.14 0.74 -0.83 0.00 0.00 0.00 175.10 174.93 2ab4 s GLY 33 N -0.45 0.13 0.34 4.51 0.00 -0.75 -4.98 107.32 106.12 2ab4 s GLY 33 Ca -0.05 -0.52 0.08 0.00 0.00 0.00 0.00 44.72 44.23 2ab4 s GLY 33 CO 0.01 -0.20 -0.07 -2.38 0.00 0.00 0.00 173.10 170.46 2ab4 s HIS 34 N -3.21 2.31 -0.33 1.90 -3.43 -1.26 0.72 115.29 111.98 2ab4 s HIS 34 Ca 0.13 -0.58 0.07 0.00 -0.80 0.00 0.00 55.06 53.89 2ab4 s HIS 34 Cb -0.05 -1.37 0.49 0.00 -1.43 0.00 0.00 32.58 30.21 2ab4 s HIS 34 CO 0.09 0.48 1.46 0.41 -2.00 0.00 0.00 174.74 175.18 2ab4 n GLY 35 N -0.77 5.35 0.00 -1.38 0.00 -0.26 -4.89 105.19 103.24 2ab4 n GLY 35 Ca -0.05 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.31 2ab4 n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ab4 n GLY 36 N -1.02 1.58 3.75 -0.02 0.00 -1.26 -4.55 105.19 103.67 2ab4 n GLY 36 Ca 0.38 0.40 -0.36 0.00 0.00 0.00 0.00 46.02 46.44 2ab4 n GLY 36 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ab4 s THR 37 N 0.00 2.59 -0.05 2.61 2.01 -1.26 -4.70 115.64 116.83 2ab4 s THR 37 Ca 0.00 0.35 0.02 0.00 0.31 0.00 0.00 61.69 62.37 2ab4 s THR 37 Cb 0.00 -3.10 0.01 0.00 0.01 0.00 0.00 72.50 69.42 2ab4 s THR 37 CO 0.00 -0.09 -0.10 -0.22 -0.69 0.00 0.00 174.62 173.52 2ab4 s LEU 38 N -4.23 1.59 0.64 4.42 0.20 -1.26 -5.10 118.68 114.93 2ab4 s LEU 38 Ca 0.77 -0.24 -0.18 0.00 0.69 0.00 0.00 54.13 55.17 2ab4 s LEU 38 Cb -0.30 -0.70 -0.03 0.00 -0.43 0.00 0.00 46.19 44.73 2ab4 s LEU 38 CO 0.35 0.02 1.04 0.47 -0.29 0.00 0.00 176.35 177.93 2ab4 n ASP 39 N 3.80 0.99 -0.17 3.68 8.00 -1.26 -4.15 116.55 127.44 2ab4 n ASP 39 Ca -0.23 0.78 -0.04 0.00 0.71 0.00 0.00 54.79 56.01 2ab4 n ASP 39 Cb 0.52 -1.43 0.06 0.00 -0.02 0.00 0.00 41.12 40.24 2ab4 n ASP 39 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 2ab4 h PRO 40 N 0.33 0.50 0.00 -0.24 0.11 -1.84 -1.67 132.00 129.19 2ab4 h PRO 40 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2ab4 h PRO 40 Cb 1.36 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2ab4 h PRO 40 CO 0.50 0.33 0.00 0.27 -0.21 0.00 0.00 178.00 178.89 2ab4 h PHE 41 N 0.51 0.00 -2.24 0.65 -5.15 -1.88 0.18 116.94 109.02 2ab4 h PHE 41 Ca 0.23 0.00 -0.44 0.00 -0.20 0.00 0.00 57.97 57.56 2ab4 h PHE 41 Cb 0.14 0.00 0.05 0.00 0.22 0.00 0.00 35.95 36.36 2ab4 h PHE 41 CO -0.10 0.00 -0.04 0.00 -2.00 0.00 0.00 178.31 176.17 2ab4 s ALA 42 N -3.46 3.98 0.18 12.09 0.00 -0.63 -4.57 121.76 129.36 2ab4 s ALA 42 Ca 0.02 -1.47 -0.10 0.00 0.00 0.00 0.00 51.96 50.41 2ab4 s ALA 42 Cb 0.09 -1.98 -0.01 0.00 0.00 0.00 0.00 23.12 21.22 2ab4 s ALA 42 CO 0.36 -0.81 0.32 0.00 0.00 0.00 0.00 175.76 175.62 2ab4 n GLY 44 N -0.24 0.77 3.71 0.00 0.00 -1.10 -1.05 105.19 107.27 2ab4 n GLY 44 Ca -0.07 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.63 2ab4 n GLY 44 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ab4 s VAL 45 N -2.40 3.59 -0.20 1.61 1.01 -0.04 -1.29 120.40 122.69 2ab4 s VAL 45 Ca 0.00 1.09 -0.01 0.00 0.00 0.00 0.00 61.98 63.06 2ab4 s VAL 45 Cb 0.00 -3.70 0.06 0.00 0.00 0.00 0.00 36.38 32.73 2ab4 s VAL 45 CO 0.00 0.06 -0.01 -0.22 0.00 0.00 0.00 175.10 174.93 2ab4 s LEU 46 N 1.52 1.65 -0.02 3.92 2.96 0.34 -4.91 118.68 124.15 2ab4 s LEU 46 Ca 0.63 -0.87 -0.30 0.00 -0.22 0.00 0.00 54.13 53.37 2ab4 s LEU 46 Cb -0.34 -0.82 -0.05 0.00 0.50 0.00 0.00 46.19 45.48 2ab4 s LEU 46 CO 0.29 -0.26 1.40 -0.63 -1.32 0.00 0.00 176.35 175.83 2ab4 s ILE 47 N 1.68 3.76 -0.10 6.68 1.09 -1.26 -1.75 121.20 131.30 2ab4 s ILE 47 Ca -0.02 1.11 0.02 0.00 -1.10 0.00 0.00 60.65 60.66 2ab4 s ILE 47 Cb -0.17 -3.72 -0.01 0.00 -1.06 0.00 0.00 42.46 37.50 2ab4 s ILE 47 CO -0.07 -0.02 -0.18 -0.63 -0.10 0.00 0.00 174.94 173.94 2ab4 s ILE 48 N 2.61 2.67 -0.19 2.92 -1.09 -0.31 -1.11 121.20 126.70 2ab4 s ILE 48 Ca 0.64 -0.81 -0.05 0.00 -2.23 0.00 0.00 60.65 58.19 2ab4 s ILE 48 Cb -0.31 -2.07 -0.03 0.00 -1.58 0.00 0.00 42.46 38.47 2ab4 s ILE 48 CO 0.26 0.55 0.00 -0.83 -1.23 0.00 0.00 174.94 173.69 2ab4 s GLY 49 N 0.17 1.75 -0.19 6.18 0.00 0.22 0.56 107.32 116.01 2ab4 s GLY 49 Ca -0.10 -0.90 -0.05 0.00 0.00 0.00 0.00 44.72 43.68 2ab4 s GLY 49 CO 0.06 0.12 -0.01 0.14 0.00 0.00 0.00 173.10 173.41 2ab4 s VAL 50 N 0.72 3.94 0.00 1.40 1.01 -0.25 -1.81 120.40 125.41 2ab4 s VAL 50 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 61.66 2ab4 s VAL 50 Cb -0.14 -2.76 0.00 0.00 0.00 0.00 0.00 36.38 33.48 2ab4 s VAL 50 CO 0.02 0.45 0.00 0.59 0.00 0.00 0.00 175.10 176.16 2ab4 n ASN 51 N 4.02 0.00 0.28 3.32 3.02 0.16 -0.25 115.26 125.81 2ab4 n ASN 51 Ca -0.17 0.00 0.17 0.00 -0.03 0.00 0.00 54.58 54.54 2ab4 n ASN 51 Cb 0.52 0.00 0.88 0.00 -0.61 0.00 0.00 39.78 40.57 2ab4 n ASN 51 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 2ab4 h GLN 52 N 0.00 0.00 0.00 3.52 1.08 -1.88 -1.06 115.11 116.78 2ab4 h GLN 52 Ca 0.00 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 2ab4 h GLN 52 Cb 0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 2ab4 h GLN 52 CO 0.00 0.00 -0.10 0.78 -0.95 0.00 0.00 178.83 178.56 2ab4 h GLY 53 N 0.00 0.00 1.63 3.46 0.00 -0.78 -2.26 103.07 105.11 2ab4 h GLY 53 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2ab4 h GLY 53 CO 0.00 0.00 0.10 -0.91 0.00 0.00 0.00 176.54 175.73 2ab4 h THR 54 N 0.00 1.15 0.00 4.70 1.35 -1.36 -2.48 112.91 116.28 2ab4 h THR 54 Ca -0.00 -0.51 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 2ab4 h THR 54 Cb 0.30 0.79 0.00 0.00 -1.73 0.00 0.00 68.15 67.52 2ab4 h THR 54 CO 0.01 0.19 0.00 0.54 -0.25 0.00 0.00 175.52 176.01 2ab4 n ARG 55 N -4.37 0.06 -0.01 4.72 5.12 -0.85 -2.12 116.66 119.22 2ab4 n ARG 55 Ca 0.02 0.46 0.00 0.00 -1.93 0.00 0.00 57.85 56.40 2ab4 n ARG 55 Cb 0.17 -1.67 0.01 0.00 -1.16 0.00 0.00 32.46 29.80 2ab4 n ARG 55 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 2ab4 n ILE 56 N -1.80 0.59 0.25 0.55 -5.35 -0.94 -4.68 119.36 107.98 2ab4 n ILE 56 Ca 0.01 -0.80 0.07 0.00 -0.27 0.00 0.00 62.75 61.77 2ab4 n ILE 56 Cb 0.09 0.71 0.61 0.00 -1.74 0.00 0.00 39.64 39.30 2ab4 n ILE 56 CO 0.00 0.00 0.00 -0.07 -1.76 0.00 0.00 176.55 174.72 2ab4 h LEU 57 N 0.12 0.00 -2.46 7.28 3.38 -1.38 -2.39 115.31 119.86 2ab4 h LEU 57 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ab4 h LEU 57 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2ab4 h LEU 57 CO 0.00 0.05 0.00 1.05 0.09 0.00 0.00 178.44 179.63 2ab4 h GLU 58 N 0.00 0.00 -0.15 1.13 4.11 -1.83 -1.97 114.58 115.86 2ab4 h GLU 58 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2ab4 h GLU 58 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2ab4 h GLU 58 CO 0.01 0.00 0.00 1.19 0.07 0.00 0.00 179.01 180.28 2ab4 n PHE 59 N -2.98 0.20 0.52 2.06 3.01 -0.90 -3.22 117.46 116.15 2ab4 n PHE 59 Ca -0.02 -0.10 0.08 0.00 1.01 0.00 0.00 57.45 58.42 2ab4 n PHE 59 Cb 0.12 0.00 0.08 0.00 -0.01 0.00 0.00 39.48 39.68 2ab4 n PHE 59 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2ab4 n TYR 60 N -0.02 0.09 -0.05 1.38 4.02 -0.74 -4.59 117.16 117.24 2ab4 n TYR 60 Ca 0.10 -0.07 -0.12 0.00 -0.01 0.00 0.00 57.90 57.81 2ab4 n TYR 60 Cb 0.19 -0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.44 2ab4 n TYR 60 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 2ab4 h LYS 61 N 2.98 0.28 -0.90 -0.72 3.64 -1.71 -3.19 116.57 116.94 2ab4 h LYS 61 Ca 0.00 -0.08 -0.09 0.00 -1.27 0.00 0.00 60.65 59.20 2ab4 h LYS 61 Cb 0.66 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.40 2ab4 h LYS 61 CO 0.00 0.49 0.12 -0.25 -2.27 0.00 0.00 179.45 177.53 2ab4 n ASP 62 N -4.75 3.12 -4.87 4.20 9.92 -1.26 -4.74 116.55 118.17 2ab4 n ASP 62 Ca -0.05 -2.51 -0.31 0.00 -0.53 0.00 0.00 54.79 51.39 2ab4 n ASP 62 Cb 0.21 -0.61 -0.04 0.00 -0.64 0.00 0.00 41.12 40.04 2ab4 n ASP 62 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2ab4 s LEU 63 N -1.24 3.97 0.61 0.64 1.43 -1.21 -4.78 118.68 118.10 2ab4 s LEU 63 Ca 0.23 1.06 -0.11 0.00 -1.03 0.00 0.00 54.13 54.28 2ab4 s LEU 63 Cb 0.18 -3.90 -0.04 0.00 0.03 0.00 0.00 46.19 42.47 2ab4 s LEU 63 CO 0.06 -0.28 1.02 -0.54 0.23 0.00 0.00 176.35 176.84 2ab4 s LYS 64 N -3.46 3.60 0.06 1.70 1.02 -1.26 -4.07 119.74 117.32 2ab4 s LYS 64 Ca 0.50 0.73 0.04 0.00 0.02 0.00 0.00 55.97 57.26 2ab4 s LYS 64 Cb -0.10 -2.09 -0.03 0.00 -0.52 0.00 0.00 37.83 35.09 2ab4 s LYS 64 CO 0.27 -0.55 -0.13 0.15 -0.92 0.00 0.00 175.35 174.17 2ab4 s LYS 65 N -5.15 0.79 -0.13 1.68 3.01 -0.66 -0.31 119.74 118.98 2ab4 s LYS 65 Ca 0.55 -0.85 0.02 0.00 -1.01 0.00 0.00 55.97 54.68 2ab4 s LYS 65 Cb -0.11 -0.76 0.01 0.00 -1.01 0.00 0.00 37.83 35.97 2ab4 s LYS 65 CO 0.53 0.17 -0.17 0.08 0.51 0.00 0.00 175.35 176.47 2ab4 s VAL 66 N -1.14 1.71 0.23 3.17 1.01 -0.78 0.75 120.40 125.35 2ab4 s VAL 66 Ca -0.02 -0.76 0.11 0.00 0.00 0.00 0.00 61.98 61.31 2ab4 s VAL 66 Cb -0.09 -1.55 -0.05 0.00 0.00 0.00 0.00 36.38 34.69 2ab4 s VAL 66 CO 0.02 0.48 -0.20 -0.36 0.00 0.00 0.00 175.10 175.03 2ab4 s PHE 67 N 1.02 2.18 -0.14 5.22 0.40 0.04 -0.73 117.98 125.97 2ab4 s PHE 67 Ca -0.04 -0.38 0.02 0.00 -0.60 0.00 0.00 56.93 55.93 2ab4 s PHE 67 Cb -0.15 -1.01 0.01 0.00 0.51 0.00 0.00 43.02 42.39 2ab4 s PHE 67 CO -0.04 0.58 -0.20 -0.46 0.70 0.00 0.00 175.22 175.80 2ab4 s TRP 68 N -2.26 2.57 0.06 0.36 -0.00 -0.32 -0.85 118.94 118.49 2ab4 s TRP 68 Ca 0.25 -1.33 0.03 0.00 -0.00 0.00 0.00 56.10 55.04 2ab4 s TRP 68 Cb -0.06 -1.77 -0.03 0.00 -0.00 0.00 0.00 33.47 31.62 2ab4 s TRP 68 CO 0.12 -0.63 -0.09 0.54 -0.00 0.00 0.00 176.95 176.89 2ab4 s VAL 69 N 0.95 0.67 -0.11 5.86 0.11 -0.07 -1.31 120.40 126.50 2ab4 s VAL 69 Ca -0.04 -1.23 0.01 0.00 -2.93 0.00 0.00 61.98 57.79 2ab4 s VAL 69 Cb -0.15 -0.83 0.02 0.00 -1.53 0.00 0.00 36.38 33.89 2ab4 s VAL 69 CO -0.04 -0.42 -0.15 -0.75 -3.33 0.00 0.00 175.10 170.42 2ab4 s LYS 70 N -1.90 2.17 0.16 1.54 2.20 -0.67 -1.06 119.74 122.19 2ab4 s LYS 70 Ca -0.06 -0.54 0.09 0.00 -0.36 0.00 0.00 55.97 55.11 2ab4 s LYS 70 Cb -0.08 -1.88 -0.04 0.00 -1.51 0.00 0.00 37.83 34.32 2ab4 s LYS 70 CO 0.00 -0.09 -0.16 0.00 -0.36 0.00 0.00 175.35 174.74 2ab4 s MET 71 N 1.08 1.84 -0.35 4.03 0.23 0.88 -0.92 119.30 126.09 2ab4 s MET 71 Ca -0.05 -1.30 -0.09 0.00 -1.03 0.00 0.00 55.69 53.22 2ab4 s MET 71 Cb -0.14 -2.07 0.03 0.00 -1.53 0.00 0.00 34.83 31.11 2ab4 s MET 71 CO -0.03 0.44 0.15 0.50 -2.03 0.00 0.00 175.02 174.05 2ab4 s ARG 72 N -2.58 2.79 0.26 3.16 6.06 0.17 -1.44 118.95 127.36 2ab4 s ARG 72 Ca 0.22 -1.09 -0.29 0.00 -2.50 0.00 0.00 55.73 52.07 2ab4 s ARG 72 Cb -0.09 -3.59 -0.09 0.00 0.06 0.00 0.00 34.95 31.24 2ab4 s ARG 72 CO 0.12 -0.65 1.20 -0.51 -2.50 0.00 0.00 175.30 172.95 2ab4 s LEU 73 N 1.49 4.48 0.00 -0.88 1.43 -0.19 -1.99 118.68 123.02 2ab4 s LEU 73 Ca 0.01 2.38 0.00 0.00 -1.03 0.00 0.00 54.13 55.48 2ab4 s LEU 73 Cb -0.19 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.40 2ab4 s LEU 73 CO 0.05 -0.33 0.00 0.61 0.23 0.00 0.00 176.35 176.91 2ab4 n GLY 74 N 1.46 0.95 3.33 -3.19 0.00 0.18 -4.66 105.19 103.26 2ab4 n GLY 74 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 2ab4 n GLY 74 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ab4 s LEU 75 N 0.00 2.50 -0.03 0.99 2.96 -1.14 -0.91 118.68 123.04 2ab4 s LEU 75 Ca 0.00 -0.39 0.02 0.00 -0.22 0.00 0.00 54.13 53.54 2ab4 s LEU 75 Cb 0.00 -1.53 0.01 0.00 0.50 0.00 0.00 46.19 45.17 2ab4 s LEU 75 CO 0.00 0.19 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.52 2ab4 s ILE 76 N 0.19 0.67 0.26 6.68 1.01 -0.43 -2.32 121.20 127.26 2ab4 s ILE 76 Ca -0.10 -0.27 0.04 0.00 0.00 0.00 0.00 60.65 60.31 2ab4 s ILE 76 Cb -0.16 -0.63 -0.05 0.00 0.01 0.00 0.00 42.46 41.63 2ab4 s ILE 76 CO 0.06 0.23 0.01 0.42 0.00 0.00 0.00 174.94 175.66 2ab4 s THR 77 N 0.39 1.07 0.28 2.92 -4.23 -1.26 -1.52 115.64 113.29 2ab4 s THR 77 Ca -0.06 -2.03 -0.01 0.00 -1.18 0.00 0.00 61.69 58.41 2ab4 s THR 77 Cb -0.10 -2.48 0.16 0.00 1.34 0.00 0.00 72.50 71.42 2ab4 s THR 77 CO 0.00 -0.22 1.82 -0.33 -0.54 0.00 0.00 174.62 175.36 2ab4 h GLU 78 N 2.37 0.84 -0.02 3.99 5.08 -1.57 -2.90 114.58 122.38 2ab4 h GLU 78 Ca -0.39 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 2ab4 h GLU 78 Cb 1.23 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.35 2ab4 h GLU 78 CO 0.65 0.75 -0.14 0.25 -1.00 0.00 0.00 179.01 179.53 2ab4 n THR 79 N -4.28 0.00 -0.92 1.13 -2.24 -1.26 -4.74 114.28 101.97 2ab4 n THR 79 Ca 0.04 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 2ab4 n THR 79 Cb 0.22 0.88 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 2ab4 n THR 79 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2ab4 n PHE 80 N 0.29 0.00 -4.43 4.78 3.01 -1.10 -4.81 117.46 115.20 2ab4 n PHE 80 Ca 0.14 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 58.38 2ab4 n PHE 80 Cb 0.44 -0.28 -0.09 0.00 -0.01 0.00 0.00 39.48 39.54 2ab4 n PHE 80 CO 0.00 0.00 0.00 0.16 1.01 0.00 0.00 176.76 177.93 2ab4 s ASP 81 N -2.74 2.22 0.00 4.37 1.47 -1.26 -2.19 116.67 118.54 2ab4 s ASP 81 Ca 0.00 -1.58 0.10 0.00 1.18 0.00 0.00 52.55 52.25 2ab4 s ASP 81 Cb 0.00 0.36 0.59 0.00 -0.34 0.00 0.00 42.92 43.53 2ab4 s ASP 81 CO 0.00 -0.86 1.15 2.30 0.68 0.00 0.00 175.17 178.44 2ab4 n ILE 82 N -0.74 0.00 0.73 2.11 -6.64 -1.07 -2.68 119.36 111.07 2ab4 n ILE 82 Ca -0.02 0.00 0.11 0.00 -1.77 0.00 0.00 62.75 61.07 2ab4 n ILE 82 Cb 0.65 -0.37 0.13 0.00 -1.44 0.00 0.00 39.64 38.61 2ab4 n ILE 82 CO 0.00 0.00 0.00 0.35 -1.77 0.00 0.00 176.55 175.13 2ab4 n THR 83 N -0.72 0.17 -4.11 7.28 -2.24 -1.26 -4.95 114.28 108.44 2ab4 n THR 83 Ca 0.07 -0.58 -0.27 0.00 -2.27 0.00 0.00 64.05 61.00 2ab4 n THR 83 Cb 0.03 1.31 -0.06 0.00 -2.10 0.00 0.00 70.33 69.51 2ab4 n THR 83 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2ab4 s GLY 84 N -1.74 1.78 0.30 3.38 0.00 -1.09 -5.01 107.32 104.94 2ab4 s GLY 84 Ca 0.30 -1.21 -0.29 0.00 0.00 0.00 0.00 44.72 43.52 2ab4 s GLY 84 CO 0.29 -1.22 1.17 1.18 0.00 0.00 0.00 173.10 174.52 2ab4 n GLU 85 N -0.08 1.71 -2.55 2.90 -0.58 -1.26 -4.61 120.64 116.18 2ab4 n GLU 85 Ca -0.09 0.60 -0.40 0.00 -0.42 0.00 0.00 57.16 56.85 2ab4 n GLU 85 Cb 0.54 -2.09 -0.05 0.00 -0.57 0.00 0.00 31.44 29.27 2ab4 n GLU 85 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2ab4 s VAL 86 N -0.92 3.74 -0.07 2.62 1.01 -1.26 -1.66 120.40 123.85 2ab4 s VAL 86 Ca 0.59 1.66 0.07 0.00 0.00 0.00 0.00 61.98 64.31 2ab4 s VAL 86 Cb -0.65 -4.06 -0.10 0.00 0.00 0.00 0.00 36.38 31.56 2ab4 s VAL 86 CO 0.59 0.36 0.04 1.33 0.00 0.00 0.00 175.10 177.43 2ab4 n VAL 87 N 1.65 0.51 -3.64 2.92 0.24 -0.58 -4.90 118.33 114.53 2ab4 n VAL 87 Ca -0.00 -0.33 -0.06 0.00 -2.04 0.00 0.00 64.34 61.90 2ab4 n VAL 87 Cb 0.46 -0.68 -0.07 0.00 -1.47 0.00 0.00 33.84 32.08 2ab4 n VAL 87 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2ab4 s GLU 88 N -2.24 0.62 -0.42 7.34 2.12 -1.12 -5.02 118.70 119.98 2ab4 s GLU 88 Ca -0.04 1.04 0.02 0.00 0.36 0.00 0.00 54.97 56.36 2ab4 s GLU 88 Cb 0.03 0.14 0.15 0.00 0.26 0.00 0.00 34.13 34.71 2ab4 s GLU 88 CO 0.34 -0.13 0.29 -2.00 -0.54 0.00 0.00 175.26 173.22 2ab4 s GLU 89 N 1.44 0.97 0.24 4.30 2.12 -1.25 -1.31 118.70 125.21 2ab4 s GLU 89 Ca -0.09 -1.91 0.03 0.00 0.36 0.00 0.00 54.97 53.36 2ab4 s GLU 89 Cb -0.05 -1.70 0.03 0.00 0.26 0.00 0.00 34.13 32.68 2ab4 s GLU 89 CO -0.17 -1.28 0.27 2.89 -0.54 0.00 0.00 175.26 176.43 2ab4 n ARG 90 N 3.32 0.97 -3.77 4.30 1.85 -0.09 -4.99 116.66 118.25 2ab4 n ARG 90 Ca 0.19 -1.36 -0.33 0.00 -1.00 0.00 0.00 57.85 55.35 2ab4 n ARG 90 Cb 0.41 0.01 -0.05 0.00 -1.05 0.00 0.00 32.46 31.78 2ab4 n ARG 90 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 2ab4 s GLU 91 N -3.03 3.56 -0.43 2.89 2.02 -1.26 -4.54 118.70 117.90 2ab4 s GLU 91 Ca 0.20 -0.16 0.04 0.00 0.02 0.00 0.00 54.97 55.06 2ab4 s GLU 91 Cb -0.02 -2.99 0.12 0.00 0.10 0.00 0.00 34.13 31.34 2ab4 s GLU 91 CO 0.13 0.58 0.16 0.00 0.02 0.00 0.00 175.26 176.15 2ab4 s ASN 93 N 0.40 6.95 0.06 0.00 2.20 -1.26 -4.98 114.94 118.31 2ab4 s ASN 93 Ca 0.14 -2.91 0.03 0.00 -0.94 0.00 0.00 52.86 49.18 2ab4 s ASN 93 Cb -0.22 -2.26 -0.03 0.00 -2.00 0.00 0.00 41.25 36.74 2ab4 s ASN 93 CO -0.04 -0.58 -0.10 0.68 -2.94 0.00 0.00 177.10 174.12 2ab4 s VAL 94 N 0.25 0.78 0.73 3.54 -7.23 -1.26 -5.15 120.40 112.05 2ab4 s VAL 94 Ca 0.27 -1.19 -0.11 0.00 -1.81 0.00 0.00 61.98 59.14 2ab4 s VAL 94 Cb -0.08 -0.82 0.03 0.00 0.56 0.00 0.00 36.38 36.07 2ab4 s VAL 94 CO -0.08 -0.32 1.07 0.42 -0.31 0.00 0.00 175.10 175.88 2ab4 s THR 95 N -1.37 3.74 0.43 5.32 -4.23 -1.26 -4.88 115.64 113.39 2ab4 s THR 95 Ca -0.06 0.57 0.13 0.00 -1.18 0.00 0.00 61.69 61.14 2ab4 s THR 95 Cb -0.10 -3.29 0.19 0.00 1.34 0.00 0.00 72.50 70.64 2ab4 s THR 95 CO 0.01 -0.74 1.99 -0.33 -0.54 0.00 0.00 174.62 175.01 2ab4 h GLU 96 N -0.84 0.09 -0.44 3.99 5.08 -2.00 -1.76 114.58 118.71 2ab4 h GLU 96 Ca -0.45 -0.02 -0.12 0.00 -1.00 0.00 0.00 59.36 57.77 2ab4 h GLU 96 Cb 1.23 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2ab4 h GLU 96 CO 0.57 0.23 -0.22 0.93 -1.00 0.00 0.00 179.01 179.52 2ab4 h GLU 97 N 0.09 0.90 -0.11 2.33 5.08 -1.99 -1.44 114.58 119.44 2ab4 h GLU 97 Ca 0.02 -0.37 -0.02 0.00 -1.00 0.00 0.00 59.36 57.99 2ab4 h GLU 97 Cb 0.29 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 2ab4 h GLU 97 CO 0.02 1.02 -0.00 0.93 -1.00 0.00 0.00 179.01 179.98 2ab4 h GLU 98 N 0.78 0.20 -0.50 2.33 5.08 -1.81 -1.26 114.58 119.39 2ab4 h GLU 98 Ca 0.10 -0.06 0.09 0.00 -1.00 0.00 0.00 59.36 58.49 2ab4 h GLU 98 Cb 0.77 -0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.92 2ab4 h GLU 98 CO 0.06 0.45 0.05 0.82 -1.00 0.00 0.00 179.01 179.39 2ab4 h ILE 99 N -0.08 0.66 -0.27 3.13 2.04 -1.19 0.74 117.51 122.53 2ab4 h ILE 99 Ca 0.03 -0.06 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 2ab4 h ILE 99 Cb 0.36 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2ab4 h ILE 99 CO 0.01 0.03 0.10 0.03 0.00 0.00 0.00 178.15 178.32 2ab4 h ARG 100 N 0.17 0.41 -0.86 2.37 3.08 -1.13 -0.53 114.38 117.90 2ab4 h ARG 100 Ca 0.26 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.23 2ab4 h ARG 100 Cb 0.37 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.31 2ab4 h ARG 100 CO -0.38 0.45 0.54 0.93 -1.07 0.00 0.00 179.97 180.44 2ab4 h GLU 101 N 0.29 1.14 -0.15 0.04 5.08 -0.73 0.71 114.58 120.97 2ab4 h GLU 101 Ca 0.09 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2ab4 h GLU 101 Cb 0.20 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 2ab4 h GLU 101 CO -0.01 0.78 0.05 0.00 -1.00 0.00 0.00 179.01 178.84 2ab4 h ALA 102 N 1.43 0.20 0.36 3.43 0.00 -0.58 -0.48 119.26 123.61 2ab4 h ALA 102 Ca 0.31 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2ab4 h ALA 102 Cb -0.09 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2ab4 h ALA 102 CO -0.06 -0.20 -0.22 0.82 0.00 0.00 0.00 179.25 179.59 2ab4 h ILE 103 N 0.07 0.55 0.00 0.00 1.08 -0.59 -2.81 117.51 115.81 2ab4 h ILE 103 Ca 0.05 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.52 2ab4 h ILE 103 Cb 0.20 0.55 0.00 0.00 -3.07 0.00 0.00 36.82 34.50 2ab4 h ILE 103 CO -0.00 0.00 0.00 0.49 -0.69 0.00 0.00 178.15 177.95 2ab4 n PHE 104 N -5.34 0.00 0.34 1.37 3.01 0.20 -2.29 117.46 114.74 2ab4 n PHE 104 Ca -0.10 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.51 2ab4 n PHE 104 Cb 0.25 -0.46 0.57 0.00 -0.01 0.00 0.00 39.48 39.84 2ab4 n PHE 104 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2ab4 h SER 105 N 0.00 0.00 0.33 4.37 4.64 -0.80 -2.76 113.55 119.33 2ab4 h SER 105 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ab4 h SER 105 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 2ab4 h SER 105 CO 0.00 0.00 -0.23 0.49 -0.87 0.00 0.00 176.83 176.22 2ab4 n PHE 106 N -2.75 0.00 -2.26 4.77 3.01 -0.97 -4.84 117.46 114.44 2ab4 n PHE 106 Ca 0.02 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.05 2ab4 n PHE 106 Cb 0.30 -0.17 -0.02 0.00 -0.01 0.00 0.00 39.48 39.58 2ab4 n PHE 106 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2ab4 s VAL 107 N -2.57 4.00 0.00 -4.37 1.01 -1.05 -4.51 120.40 112.91 2ab4 s VAL 107 Ca 0.24 1.21 0.00 0.00 0.00 0.00 0.00 61.98 63.42 2ab4 s VAL 107 Cb 0.19 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.79 2ab4 s VAL 107 CO 0.53 -0.11 0.00 0.61 0.00 0.00 0.00 175.10 176.13 2ab4 n GLY 108 N 3.82 0.43 3.23 4.51 0.00 0.07 -4.97 105.19 112.27 2ab4 n GLY 108 Ca 0.15 -1.21 -0.21 0.00 0.00 0.00 0.00 46.02 44.75 2ab4 n GLY 108 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ab4 s GLU 109 N -0.38 0.99 0.02 1.61 2.02 -1.26 0.15 118.70 121.85 2ab4 s GLU 109 Ca 0.00 -1.09 -0.27 0.00 0.02 0.00 0.00 54.97 53.62 2ab4 s GLU 109 Cb 0.00 -1.09 0.09 0.00 0.10 0.00 0.00 34.13 33.23 2ab4 s GLU 109 CO 0.00 0.24 0.80 1.52 0.02 0.00 0.00 175.26 177.84 2ab4 s TYR 110 N -1.35 -0.43 -0.53 1.61 -0.85 -0.90 -5.01 117.35 109.89 2ab4 s TYR 110 Ca 0.03 0.37 -0.25 0.00 -0.52 0.00 0.00 57.07 56.71 2ab4 s TYR 110 Cb -0.09 0.52 0.04 0.00 0.38 0.00 0.00 41.96 42.81 2ab4 s TYR 110 CO 0.03 -0.62 0.95 -0.51 -1.52 0.00 0.00 175.55 173.89 2ab4 s ASP 111 N -2.30 6.38 -0.15 -0.18 1.01 -1.26 -1.63 116.67 118.54 2ab4 s ASP 111 Ca 0.02 -0.22 -0.10 0.00 0.71 0.00 0.00 52.55 52.96 2ab4 s ASP 111 Cb -0.01 -2.45 -0.05 0.00 1.01 0.00 0.00 42.92 41.43 2ab4 s ASP 111 CO -0.07 -1.21 0.18 -1.58 0.21 0.00 0.00 175.17 172.69 2ab4 s GLN 112 N 3.98 3.86 -0.12 8.23 0.74 -0.53 -4.82 119.66 130.99 2ab4 s GLN 112 Ca 0.33 -0.10 -0.14 0.00 0.05 0.00 0.00 55.36 55.50 2ab4 s GLN 112 Cb -0.12 -3.31 -0.05 0.00 1.10 0.00 0.00 33.01 30.64 2ab4 s GLN 112 CO 0.21 0.53 0.33 0.08 -0.55 0.00 0.00 175.29 175.89 2ab4 s VAL 113 N -0.33 5.25 0.33 1.34 1.01 -1.26 -1.03 120.40 125.72 2ab4 s VAL 113 Ca 0.13 0.64 -0.29 0.00 0.00 0.00 0.00 61.98 62.46 2ab4 s VAL 113 Cb -0.12 -3.66 -0.11 0.00 0.00 0.00 0.00 36.38 32.49 2ab4 s VAL 113 CO 0.02 0.43 1.51 -2.84 0.00 0.00 0.00 175.10 174.22 2ab4 s PRO 114 N 0.11 4.15 0.71 2.72 0.02 -1.26 -4.87 135.00 136.57 2ab4 s PRO 114 Ca 0.19 2.52 -0.15 0.00 0.02 0.00 0.00 61.00 63.59 2ab4 s PRO 114 Cb -0.14 -3.01 0.03 0.00 0.02 0.00 0.00 34.50 31.40 2ab4 s PRO 114 CO 0.07 -0.53 1.16 -1.25 -0.33 0.00 0.00 177.00 176.12 2ab4 s PRO 115 N -1.33 2.35 0.22 5.54 0.04 -1.26 -4.70 135.00 135.85 2ab4 s PRO 115 Ca 0.57 1.60 -0.08 0.00 0.04 0.00 0.00 61.00 63.12 2ab4 s PRO 115 Cb -0.46 -1.88 0.23 0.00 0.04 0.00 0.00 34.50 32.43 2ab4 s PRO 115 CO 0.55 -1.64 1.86 0.00 0.04 0.00 0.00 177.00 177.81 2ab4 h ALA 116 N -0.25 1.02 -1.45 8.56 0.00 -1.89 -3.29 119.26 121.96 2ab4 h ALA 116 Ca -0.47 -0.02 -0.65 0.00 0.00 0.00 0.00 54.91 53.76 2ab4 h ALA 116 Cb 1.27 -0.25 -0.13 0.00 0.00 0.00 0.00 17.79 18.68 2ab4 h ALA 116 CO 0.51 0.28 1.29 0.71 0.00 0.00 0.00 179.25 182.04 2ab4 s TYR 117 N -6.10 2.85 0.19 0.00 1.51 -1.26 -3.41 117.35 111.12 2ab4 s TYR 117 Ca -0.13 -1.22 -0.16 0.00 -1.01 0.00 0.00 57.07 54.55 2ab4 s TYR 117 Cb 0.16 -4.52 0.02 0.00 -0.11 0.00 0.00 41.96 37.52 2ab4 s TYR 117 CO 0.78 -1.71 0.49 -1.54 -1.11 0.00 0.00 175.55 172.45 2ab4 s SER 118 N 4.24 -0.21 0.00 2.29 1.04 -1.24 -4.88 113.70 114.94 2ab4 s SER 118 Ca 0.41 -0.55 0.17 0.00 0.48 0.00 0.00 55.95 56.46 2ab4 s SER 118 Cb -0.02 0.56 0.82 0.00 0.10 0.00 0.00 66.02 67.48 2ab4 s SER 118 CO -0.08 -1.03 1.55 0.00 0.98 0.00 0.00 173.24 174.66 2ab4 n ALA 119 N -0.32 2.56 -1.72 5.32 0.00 -1.26 -1.21 120.51 123.87 2ab4 n ALA 119 Ca -0.09 -0.26 -0.38 0.00 0.00 0.00 0.00 53.44 52.71 2ab4 n ALA 119 Cb 0.62 -1.18 0.05 0.00 0.00 0.00 0.00 19.45 18.95 2ab4 n ALA 119 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2ab4 n LYS 120 N -0.34 1.37 -3.95 0.00 4.76 -1.26 -4.58 118.16 114.16 2ab4 n LYS 120 Ca 0.13 0.52 -0.37 0.00 -2.87 0.00 0.00 58.31 55.72 2ab4 n LYS 120 Cb 0.15 -2.51 -0.07 0.00 -1.84 0.00 0.00 35.03 30.77 2ab4 n LYS 120 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2ab4 s LYS 121 N -3.05 3.42 -0.00 1.97 -0.14 -1.26 -0.08 119.74 120.60 2ab4 s LYS 121 Ca 0.76 -0.18 -0.01 0.00 -1.36 0.00 0.00 55.97 55.18 2ab4 s LYS 121 Cb -0.40 -3.14 -0.00 0.00 -1.68 0.00 0.00 37.83 32.60 2ab4 s LYS 121 CO 0.45 0.73 -0.01 0.98 -0.76 0.00 0.00 175.35 176.74 2ab4 n TYR 122 N 2.12 0.00 -3.20 3.18 9.36 -0.29 -4.90 117.16 123.44 2ab4 n TYR 122 Ca -0.19 0.00 -0.23 0.00 3.32 0.00 0.00 57.90 60.79 2ab4 n TYR 122 Cb 0.55 -0.02 -0.06 0.00 -0.63 0.00 0.00 39.34 39.18 2ab4 n TYR 122 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 2ab4 n LYS 123 N -2.61 1.47 -0.99 2.98 5.02 -1.26 -4.81 118.16 117.96 2ab4 n LYS 123 Ca -0.01 -3.77 0.00 0.00 -2.02 0.00 0.00 58.31 52.52 2ab4 n LYS 123 Cb 0.02 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.34 2ab4 n LYS 123 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ab4 n GLY 124 N 0.77 0.52 3.15 0.72 0.00 -1.26 -5.01 105.19 104.07 2ab4 n GLY 124 Ca 0.25 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.07 2ab4 n GLY 124 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ab4 s GLU 125 N -0.15 0.93 0.37 1.61 2.02 -1.26 -5.12 118.70 117.09 2ab4 s GLU 125 Ca 0.00 -0.77 -0.26 0.00 0.02 0.00 0.00 54.97 53.96 2ab4 s GLU 125 Cb 0.00 -0.93 -0.09 0.00 0.10 0.00 0.00 34.13 33.21 2ab4 s GLU 125 CO 0.00 0.23 1.12 1.03 0.02 0.00 0.00 175.26 177.66 2ab4 s ARG 126 N -1.19 4.22 0.33 1.61 1.81 -1.26 -1.13 118.95 123.34 2ab4 s ARG 126 Ca 0.01 1.74 0.06 0.00 -1.72 0.00 0.00 55.73 55.82 2ab4 s ARG 126 Cb -0.08 -2.76 0.57 0.00 -0.45 0.00 0.00 34.95 32.23 2ab4 s ARG 126 CO 0.01 -0.14 1.80 -0.07 -0.68 0.00 0.00 175.30 176.22 2ab4 h LEU 127 N 2.87 0.33 -1.36 2.53 3.38 -0.31 -2.48 115.31 120.27 2ab4 h LEU 127 Ca -0.48 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.33 2ab4 h LEU 127 Cb 1.22 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 2ab4 h LEU 127 CO 0.63 0.57 -0.27 0.10 0.09 0.00 0.00 178.44 179.57 2ab4 h TYR 128 N 0.31 0.00 0.04 1.13 -0.00 -1.18 0.45 116.97 117.72 2ab4 h TYR 128 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 58.78 2ab4 h TYR 128 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.31 2ab4 h TYR 128 CO 0.01 0.27 -0.02 -0.22 -0.00 0.00 0.00 178.16 178.20 2ab4 h LYS 129 N 0.00 -0.05 0.00 0.10 3.11 -1.75 -1.49 116.57 116.49 2ab4 h LYS 129 Ca -0.00 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.82 2ab4 h LYS 129 Cb 0.63 0.01 -0.00 0.00 -1.00 0.00 0.00 32.23 31.87 2ab4 h LYS 129 CO 0.04 0.48 -0.12 -0.07 -2.81 0.00 0.00 179.45 176.97 2ab4 h LEU 130 N -0.62 0.00 -0.21 5.20 3.38 -1.26 -2.46 115.31 119.34 2ab4 h LEU 130 Ca -0.01 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.75 2ab4 h LEU 130 Cb 0.55 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.31 2ab4 h LEU 130 CO 0.01 0.12 -0.74 0.00 0.09 0.00 0.00 178.44 177.92 2ab4 h ALA 131 N 1.88 0.36 0.00 1.53 0.00 -0.67 1.00 119.26 123.37 2ab4 h ALA 131 Ca -0.00 -0.59 -0.05 0.00 0.00 0.00 0.00 54.91 54.27 2ab4 h ALA 131 Cb 0.22 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2ab4 h ALA 131 CO 0.02 0.69 -0.25 0.00 0.00 0.00 0.00 179.25 179.70 2ab4 h ARG 132 N 0.54 0.00 -0.02 0.00 3.08 -0.81 -1.15 114.38 116.02 2ab4 h ARG 132 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2ab4 h ARG 132 Cb 1.36 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.41 2ab4 h ARG 132 CO 0.15 0.25 0.00 0.39 -1.07 0.00 0.00 179.97 179.69 2ab4 n GLU 133 N -3.66 1.16 -0.21 0.04 1.02 -1.06 -4.88 120.64 113.06 2ab4 n GLU 133 Ca -0.01 -0.24 0.00 0.00 -0.02 0.00 0.00 57.16 56.89 2ab4 n GLU 133 Cb 0.37 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.41 2ab4 n GLU 133 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ab4 n GLY 134 N 0.93 1.00 3.54 0.62 0.00 -0.43 -5.03 105.19 105.82 2ab4 n GLY 134 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2ab4 n GLY 134 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ab4 s LYS 135 N -0.58 3.45 -0.32 1.61 2.20 0.34 -4.96 119.74 121.48 2ab4 s LYS 135 Ca 0.00 -0.20 -0.14 0.00 -0.36 0.00 0.00 55.97 55.27 2ab4 s LYS 135 Cb 0.00 -3.89 -0.02 0.00 -1.51 0.00 0.00 37.83 32.41 2ab4 s LYS 135 CO 0.00 -0.89 0.32 0.42 -0.36 0.00 0.00 175.35 174.84 2ab4 s ILE 136 N 2.76 5.21 -0.15 5.43 1.01 -1.26 -2.64 121.20 131.56 2ab4 s ILE 136 Ca 0.23 0.12 -0.07 0.00 0.00 0.00 0.00 60.65 60.93 2ab4 s ILE 136 Cb -0.14 -3.74 -0.04 0.00 0.01 0.00 0.00 42.46 38.55 2ab4 s ILE 136 CO 0.17 0.02 0.10 -0.63 0.00 0.00 0.00 174.94 174.60 2ab4 s ILE 137 N 1.94 5.14 -0.64 2.92 1.09 -1.26 -5.06 121.20 125.33 2ab4 s ILE 137 Ca 0.11 0.08 -0.09 0.00 -1.10 0.00 0.00 60.65 59.65 2ab4 s ILE 137 Cb -0.16 -3.28 0.17 0.00 -1.06 0.00 0.00 42.46 38.13 2ab4 s ILE 137 CO 0.11 0.53 0.52 0.20 -0.10 0.00 0.00 174.94 176.21 2ab4 s ASN 138 N -0.32 5.92 0.52 3.58 -0.87 -1.26 -4.60 114.94 117.91 2ab4 s ASN 138 Ca 0.10 -2.47 -0.19 0.00 -1.57 0.00 0.00 52.86 48.73 2ab4 s ASN 138 Cb -0.12 -2.03 -0.07 0.00 -0.02 0.00 0.00 41.25 39.01 2ab4 s ASN 138 CO 0.01 -0.56 1.05 -0.76 -2.57 0.00 0.00 177.10 174.27 2ab4 s LEU 139 N 0.52 3.73 0.53 0.60 1.43 -1.26 -4.97 118.68 119.25 2ab4 s LEU 139 Ca 0.13 1.90 -0.20 0.00 -1.03 0.00 0.00 54.13 54.93 2ab4 s LEU 139 Cb -0.19 -4.55 -0.08 0.00 0.03 0.00 0.00 46.19 41.40 2ab4 s LEU 139 CO -0.04 -0.92 0.87 -0.81 0.23 0.00 0.00 176.35 175.67 2ab4 n PRO 140 N -1.33 0.95 -1.39 1.29 -0.04 -1.26 -4.61 135.00 128.61 2ab4 n PRO 140 Ca 0.09 0.36 -0.32 0.00 -0.04 0.00 0.00 63.50 63.59 2ab4 n PRO 140 Cb 0.53 -2.00 0.09 0.00 -0.04 0.00 0.00 33.50 32.07 2ab4 n PRO 140 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2ab4 s PRO 141 N -2.32 2.27 -0.11 0.54 0.04 -1.26 -4.73 135.00 129.42 2ab4 s PRO 141 Ca 0.70 1.38 0.03 0.00 0.04 0.00 0.00 61.00 63.15 2ab4 s PRO 141 Cb -0.47 -1.88 -0.00 0.00 0.04 0.00 0.00 34.50 32.18 2ab4 s PRO 141 CO 0.52 -1.66 -0.21 0.21 0.04 0.00 0.00 177.00 175.90 2ab4 s LYS 142 N -4.44 3.12 -0.56 4.56 2.20 -0.20 -4.89 119.74 119.54 2ab4 s LYS 142 Ca 0.66 -0.83 -0.27 0.00 -0.36 0.00 0.00 55.97 55.17 2ab4 s LYS 142 Cb -0.21 -2.38 -0.01 0.00 -1.51 0.00 0.00 37.83 33.72 2ab4 s LYS 142 CO 0.50 0.20 1.66 0.50 -0.36 0.00 0.00 175.35 177.84 2ab4 s ARG 143 N 0.32 3.00 0.27 4.03 6.06 -1.26 -1.46 118.95 129.91 2ab4 s ARG 143 Ca -0.16 0.62 0.06 0.00 -2.50 0.00 0.00 55.73 53.75 2ab4 s ARG 143 Cb -0.17 -4.26 -0.03 0.00 0.06 0.00 0.00 34.95 30.55 2ab4 s ARG 143 CO 0.08 -2.29 0.29 0.14 -2.50 0.00 0.00 175.30 171.02 2ab4 s VAL 144 N 7.49 4.54 -0.11 7.11 -7.23 -0.65 -4.93 120.40 126.60 2ab4 s VAL 144 Ca 0.62 -1.22 0.03 0.00 -1.81 0.00 0.00 61.98 59.59 2ab4 s VAL 144 Cb -0.13 -3.52 0.01 0.00 0.56 0.00 0.00 36.38 33.30 2ab4 s VAL 144 CO 0.24 -0.30 -0.21 -0.75 -0.31 0.00 0.00 175.10 173.77 2ab4 s LYS 145 N -3.94 2.82 -0.54 4.82 2.20 -1.26 -2.12 119.74 121.72 2ab4 s LYS 145 Ca 0.36 -0.79 -0.12 0.00 -0.36 0.00 0.00 55.97 55.06 2ab4 s LYS 145 Cb -0.08 -2.23 0.13 0.00 -1.51 0.00 0.00 37.83 34.14 2ab4 s LYS 145 CO 0.27 0.06 0.45 0.42 -0.36 0.00 0.00 175.35 176.19 2ab4 s ILE 146 N 0.65 4.71 0.13 5.43 1.09 0.12 -1.89 121.20 131.44 2ab4 s ILE 146 Ca -0.12 -1.79 -0.16 0.00 -1.10 0.00 0.00 60.65 57.48 2ab4 s ILE 146 Cb -0.16 -4.04 -0.01 0.00 -1.06 0.00 0.00 42.46 37.18 2ab4 s ILE 146 CO 0.03 -0.84 1.69 -0.26 -0.10 0.00 0.00 174.94 175.46 2ab4 h PHE 147 N 8.50 0.56 -1.73 3.97 0.04 -1.66 0.22 116.94 126.85 2ab4 h PHE 147 Ca -0.21 -0.04 0.03 0.00 2.80 0.00 0.00 57.97 60.55 2ab4 h PHE 147 Cb 1.08 -0.17 -0.22 0.00 2.20 0.00 0.00 35.95 38.83 2ab4 h PHE 147 CO 0.71 0.49 0.40 0.21 -0.60 0.00 0.00 178.31 179.53 2ab4 s LYS 148 N -5.63 0.74 -0.00 1.51 2.20 -1.23 -4.80 119.74 112.53 2ab4 s LYS 148 Ca -0.13 0.28 0.05 0.00 -0.36 0.00 0.00 55.97 55.80 2ab4 s LYS 148 Cb 0.10 0.35 -0.01 0.00 -1.51 0.00 0.00 37.83 36.76 2ab4 s LYS 148 CO 0.74 -0.21 -0.15 0.42 -0.36 0.00 0.00 175.35 175.80 2ab4 s ILE 149 N -0.90 1.15 0.18 5.43 1.01 -1.26 -1.82 121.20 124.99 2ab4 s ILE 149 Ca -0.04 -0.69 -0.06 0.00 0.00 0.00 0.00 60.65 59.87 2ab4 s ILE 149 Cb -0.01 -0.97 0.02 0.00 0.01 0.00 0.00 42.46 41.51 2ab4 s ILE 149 CO 0.03 0.27 0.34 -2.67 0.00 0.00 0.00 174.94 172.92 2ab4 n TRP 150 N 2.58 -1.48 -3.92 3.97 2.14 -0.54 -4.99 117.44 115.21 2ab4 n TRP 150 Ca -0.15 -0.95 -0.28 0.00 2.07 0.00 0.00 57.50 58.20 2ab4 n TRP 150 Cb 0.55 0.40 0.01 0.00 -0.81 0.00 0.00 31.31 31.46 2ab4 n TRP 150 CO 0.00 0.00 0.00 -0.25 2.07 0.00 0.00 177.69 179.51 2ab4 n ASP 151 N -1.41 -2.44 -4.68 -0.67 8.00 -1.26 -0.77 116.55 113.32 2ab4 n ASP 151 Ca -0.03 -0.89 -0.43 0.00 0.71 0.00 0.00 54.79 54.16 2ab4 n ASP 151 Cb 0.28 -3.53 -0.02 0.00 -0.02 0.00 0.00 41.12 37.82 2ab4 n ASP 151 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2ab4 s VAL 152 N -3.57 4.44 -0.09 2.53 1.01 -1.26 -3.97 120.40 119.49 2ab4 s VAL 152 Ca 0.33 1.74 0.02 0.00 0.00 0.00 0.00 61.98 64.08 2ab4 s VAL 152 Cb -0.17 -4.12 0.01 0.00 0.00 0.00 0.00 36.38 32.10 2ab4 s VAL 152 CO 0.86 -0.04 -0.16 0.21 0.00 0.00 0.00 175.10 175.97 2ab4 s ASN 153 N 1.43 2.33 -0.23 3.32 2.47 0.31 -4.99 114.94 119.58 2ab4 s ASN 153 Ca 0.52 -0.41 -0.01 0.00 0.42 0.00 0.00 52.86 53.39 2ab4 s ASN 153 Cb -0.21 -1.06 0.02 0.00 -1.45 0.00 0.00 41.25 38.55 2ab4 s ASN 153 CO 0.18 0.06 -0.09 -0.63 -3.72 0.00 0.00 177.10 172.89 2ab4 s ILE 154 N 0.71 2.73 -0.58 -5.21 1.01 -1.26 -0.76 121.20 117.84 2ab4 s ILE 154 Ca -0.13 -0.96 0.05 0.00 0.00 0.00 0.00 60.65 59.61 2ab4 s ILE 154 Cb -0.16 -2.33 0.17 0.00 0.01 0.00 0.00 42.46 40.15 2ab4 s ILE 154 CO 0.03 0.30 0.44 -0.62 0.00 0.00 0.00 174.94 175.09 2ab4 n GLU 155 N 4.66 1.16 0.00 2.79 1.02 -0.29 -5.03 120.64 124.95 2ab4 n GLU 155 Ca -0.18 -3.94 0.00 0.00 -0.02 0.00 0.00 57.16 53.03 2ab4 n GLU 155 Cb 0.48 -2.02 0.00 0.00 -0.02 0.00 0.00 31.44 29.88 2ab4 n GLU 155 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ab4 n GLY 156 N 2.28 2.16 0.05 0.62 0.00 -1.26 -2.80 105.19 106.25 2ab4 n GLY 156 Ca 0.24 -0.42 0.11 0.00 0.00 0.00 0.00 46.02 45.96 2ab4 n GLY 156 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2ab4 n ARG 157 N 9.73 0.42 -3.05 1.61 1.85 -1.26 -4.83 116.66 121.13 2ab4 n ARG 157 Ca 0.00 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.44 2ab4 n ARG 157 Cb 0.00 -1.65 -0.06 0.00 -1.05 0.00 0.00 32.46 29.71 2ab4 n ARG 157 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2ab4 s ASP 158 N -4.38 6.54 -0.08 2.89 1.11 -1.12 -1.02 116.67 120.61 2ab4 s ASP 158 Ca 0.01 0.43 0.05 0.00 0.18 0.00 0.00 52.55 53.23 2ab4 s ASP 158 Cb 0.13 -2.36 -0.01 0.00 1.07 0.00 0.00 42.92 41.76 2ab4 s ASP 158 CO 0.81 -0.57 -0.24 -0.69 1.18 0.00 0.00 175.17 175.65 2ab4 s VAL 159 N 2.79 2.04 0.22 -1.27 1.01 -0.52 -1.13 120.40 123.54 2ab4 s VAL 159 Ca 0.28 -1.04 0.09 0.00 0.00 0.00 0.00 61.98 61.31 2ab4 s VAL 159 Cb -0.14 -1.74 -0.05 0.00 0.00 0.00 0.00 36.38 34.44 2ab4 s VAL 159 CO 0.13 0.56 -0.16 -0.94 0.00 0.00 0.00 175.10 174.69 2ab4 s SER 160 N 0.06 2.84 0.02 3.32 1.04 0.06 -0.08 113.70 120.96 2ab4 s SER 160 Ca -0.10 -1.01 -0.29 0.00 0.48 0.00 0.00 55.95 55.02 2ab4 s SER 160 Cb -0.16 -0.18 0.11 0.00 0.10 0.00 0.00 66.02 65.89 2ab4 s SER 160 CO 0.06 -0.11 1.22 0.72 0.98 0.00 0.00 173.24 176.11 2ab4 s PHE 161 N -2.81 -0.05 0.06 5.02 -0.12 -0.22 -0.53 117.98 119.34 2ab4 s PHE 161 Ca 0.24 -0.11 0.06 0.00 -0.05 0.00 0.00 56.93 57.08 2ab4 s PHE 161 Cb -0.02 0.57 -0.04 0.00 -0.63 0.00 0.00 43.02 42.91 2ab4 s PHE 161 CO 0.09 -0.40 -0.13 1.03 -0.05 0.00 0.00 175.22 175.76 2ab4 s ARG 162 N -2.53 2.17 -0.07 1.99 0.52 0.05 -0.89 118.95 120.19 2ab4 s ARG 162 Ca 0.15 -0.96 -0.04 0.00 -0.52 0.00 0.00 55.73 54.36 2ab4 s ARG 162 Cb 0.03 -2.29 0.03 0.00 0.52 0.00 0.00 34.95 33.24 2ab4 s ARG 162 CO -0.02 0.54 0.16 0.14 0.02 0.00 0.00 175.30 176.14 2ab4 s VAL 163 N -1.06 -0.02 -0.26 3.52 -7.23 -0.03 -1.47 120.40 113.85 2ab4 s VAL 163 Ca 0.18 0.09 -0.12 0.00 -1.81 0.00 0.00 61.98 60.32 2ab4 s VAL 163 Cb -0.11 -0.25 -0.05 0.00 0.56 0.00 0.00 36.38 36.54 2ab4 s VAL 163 CO 0.09 0.04 0.23 -0.70 -0.31 0.00 0.00 175.10 174.45 2ab4 s GLU 164 N 0.67 4.03 0.16 4.82 2.12 -0.75 -0.78 118.70 128.96 2ab4 s GLU 164 Ca -0.05 -0.19 0.08 0.00 0.36 0.00 0.00 54.97 55.17 2ab4 s GLU 164 Cb -0.06 -3.60 -0.04 0.00 0.26 0.00 0.00 34.13 30.68 2ab4 s GLU 164 CO -0.03 -0.09 -0.16 0.54 -0.54 0.00 0.00 175.26 174.97 2ab4 s VAL 165 N 1.50 1.68 0.60 3.70 0.11 0.23 -2.09 120.40 126.13 2ab4 s VAL 165 Ca 0.10 -1.94 -0.11 0.00 -2.93 0.00 0.00 61.98 57.09 2ab4 s VAL 165 Cb -0.15 -1.82 -0.04 0.00 -1.53 0.00 0.00 36.38 32.84 2ab4 s VAL 165 CO 0.08 -0.41 1.00 -0.94 -3.33 0.00 0.00 175.10 171.50 2ab4 s SER 166 N -2.78 6.26 0.37 3.54 1.04 -0.79 -1.65 113.70 119.69 2ab4 s SER 166 Ca 0.16 1.38 -0.27 0.00 0.48 0.00 0.00 55.95 57.69 2ab4 s SER 166 Cb -0.04 -2.45 -0.11 0.00 0.10 0.00 0.00 66.02 63.51 2ab4 s SER 166 CO 0.06 -0.82 1.28 -0.81 0.98 0.00 0.00 173.24 173.93 2ab4 n PRO 167 N -2.63 2.07 -0.74 4.02 -0.04 -1.26 -2.64 135.00 133.78 2ab4 n PRO 167 Ca 0.05 0.73 0.00 0.00 -0.04 0.00 0.00 63.50 64.24 2ab4 n PRO 167 Cb 0.54 -2.35 0.00 0.00 -0.04 0.00 0.00 33.50 31.66 2ab4 n PRO 167 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ab4 n GLY 168 N 0.78 0.74 3.73 0.55 0.00 -1.26 -4.96 105.19 104.77 2ab4 n GLY 168 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 2ab4 n GLY 168 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ab4 s THR 169 N -2.66 5.01 -0.25 2.61 2.01 -1.08 -5.05 115.64 116.24 2ab4 s THR 169 Ca 0.00 1.32 -0.10 0.00 0.31 0.00 0.00 61.69 63.22 2ab4 s THR 169 Cb 0.00 -3.98 -0.05 0.00 0.01 0.00 0.00 72.50 68.48 2ab4 s THR 169 CO 0.00 0.31 0.16 -0.31 -0.69 0.00 0.00 174.62 174.10 2ab4 s TYR 170 N 0.46 3.29 0.24 4.92 1.51 -1.26 -4.95 117.35 121.56 2ab4 s TYR 170 Ca 0.34 0.19 0.13 0.00 -1.01 0.00 0.00 57.07 56.72 2ab4 s TYR 170 Cb -0.18 -2.29 0.47 0.00 -0.11 0.00 0.00 41.96 39.85 2ab4 s TYR 170 CO 0.17 0.01 1.66 0.82 -1.11 0.00 0.00 175.55 177.10 2ab4 h ILE 171 N 5.10 1.26 -0.12 2.71 1.08 -1.98 -2.25 117.51 123.30 2ab4 h ILE 171 Ca -0.37 -1.91 0.02 0.00 -0.39 0.00 0.00 64.86 62.20 2ab4 h ILE 171 Cb 1.17 2.06 -0.02 0.00 -3.07 0.00 0.00 36.82 36.97 2ab4 h ILE 171 CO 0.63 0.52 0.00 -0.09 -0.69 0.00 0.00 178.15 178.53 2ab4 h ARG 172 N 0.00 0.05 -0.32 2.37 9.65 -1.92 -0.13 114.38 124.08 2ab4 h ARG 172 Ca -0.01 -0.00 -0.10 0.00 -1.10 0.00 0.00 59.98 58.77 2ab4 h ARG 172 Cb 1.02 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.58 2ab4 h ARG 172 CO 0.07 0.03 -0.22 0.77 2.80 0.00 0.00 179.97 183.42 2ab4 h SER 173 N 0.05 0.61 -0.16 -3.80 0.02 -1.86 -2.55 113.55 105.86 2ab4 h SER 173 Ca 0.05 -0.21 0.01 0.00 -0.84 0.00 0.00 61.79 60.81 2ab4 h SER 173 Cb 0.06 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 2ab4 h SER 173 CO -0.09 0.83 0.07 0.25 -1.14 0.00 0.00 176.83 176.75 2ab4 h LEU 174 N 0.53 0.11 -0.13 5.07 6.46 -0.79 0.22 115.31 126.78 2ab4 h LEU 174 Ca 0.08 0.01 0.01 0.00 -0.12 0.00 0.00 57.88 57.85 2ab4 h LEU 174 Cb 0.68 -0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.58 2ab4 h LEU 174 CO 0.05 0.09 0.06 0.00 -0.62 0.00 0.00 178.44 178.02 2ab4 h MET 176 N 0.13 1.02 -0.68 0.00 2.86 -1.22 0.89 114.93 117.94 2ab4 h MET 176 Ca 0.05 -0.06 -0.08 0.00 -2.06 0.00 0.00 59.70 57.55 2ab4 h MET 176 Cb 0.01 -0.23 -0.03 0.00 0.06 0.00 0.00 31.60 31.41 2ab4 h MET 176 CO -0.04 0.68 0.13 -0.44 1.06 0.00 0.00 176.91 178.30 2ab4 h ASP 177 N 1.05 1.06 0.03 1.22 3.45 0.33 0.13 116.42 123.70 2ab4 h ASP 177 Ca 0.37 -0.25 -0.13 0.00 0.43 0.00 0.00 57.03 57.44 2ab4 h ASP 177 Cb 0.09 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.57 2ab4 h ASP 177 CO -0.15 1.04 -0.43 0.40 -1.57 0.00 0.00 179.24 178.54 2ab4 h ILE 178 N 1.04 1.31 -0.60 0.35 2.04 -0.37 -1.26 117.51 120.02 2ab4 h ILE 178 Ca 0.21 -1.61 -0.08 0.00 1.00 0.00 0.00 64.86 64.38 2ab4 h ILE 178 Cb 0.42 1.62 -0.02 0.00 -0.74 0.00 0.00 36.82 38.10 2ab4 h ILE 178 CO 0.01 0.50 0.07 1.23 0.00 0.00 0.00 178.15 179.96 2ab4 h GLY 179 N 1.10 1.09 1.10 5.37 0.00 -0.32 -1.53 103.07 109.89 2ab4 h GLY 179 Ca 0.03 -0.75 -0.06 0.00 0.00 0.00 0.00 47.33 46.55 2ab4 h GLY 179 CO 0.08 0.70 0.23 -1.82 0.00 0.00 0.00 176.54 175.73 2ab4 h TYR 180 N 0.92 1.16 -0.62 5.60 3.20 -0.48 -0.15 116.97 126.59 2ab4 h TYR 180 Ca 0.18 -0.11 -0.03 0.00 3.14 0.00 0.00 58.73 61.91 2ab4 h TYR 180 Cb 0.47 -0.34 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 2ab4 h TYR 180 CO 0.03 0.92 0.28 -0.22 -1.64 0.00 0.00 178.16 177.53 2ab4 h LYS 181 N 1.08 0.89 0.00 1.82 1.63 -0.81 -0.56 116.57 120.62 2ab4 h LYS 181 Ca 0.24 -0.13 0.00 0.00 -0.85 0.00 0.00 60.65 59.91 2ab4 h LYS 181 Cb 0.30 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 31.76 2ab4 h LYS 181 CO -0.01 0.71 0.00 1.28 -3.45 0.00 0.00 179.45 177.98 2ab4 n LEU 182 N -4.34 0.75 -0.06 5.20 4.77 -0.61 -4.92 117.00 117.79 2ab4 n LEU 182 Ca 0.06 0.59 -0.01 0.00 -0.03 0.00 0.00 56.01 56.61 2ab4 n LEU 182 Cb 0.15 -0.37 -0.00 0.00 -2.33 0.00 0.00 43.42 40.87 2ab4 n LEU 182 CO 0.38 -0.23 -0.01 0.61 -1.33 0.00 0.00 177.39 176.81 2ab4 n GLY 183 N 1.11 0.48 0.00 -0.72 0.00 -0.13 -4.90 105.19 101.04 2ab4 n GLY 183 Ca 0.05 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.56 2ab4 n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ab4 n GLY 185 N -0.08 -3.09 3.47 0.00 0.00 -0.89 -2.45 105.19 102.15 2ab4 n GLY 185 Ca 0.00 -1.20 -0.15 0.00 0.00 0.00 0.00 46.02 44.67 2ab4 n GLY 185 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ab4 s ALA 186 N -4.28 -1.50 -0.01 4.61 0.00 -1.19 0.49 121.76 119.88 2ab4 s ALA 186 Ca 0.00 1.35 0.03 0.00 0.00 0.00 0.00 51.96 53.34 2ab4 s ALA 186 Cb 0.00 -0.45 -0.01 0.00 0.00 0.00 0.00 23.12 22.66 2ab4 s ALA 186 CO 0.00 -0.32 -0.09 0.99 0.00 0.00 0.00 175.76 176.34 2ab4 s THR 187 N -0.51 0.73 -0.17 0.00 2.01 -0.84 -3.57 115.64 113.29 2ab4 s THR 187 Ca -0.06 -0.39 -0.29 0.00 0.31 0.00 0.00 61.69 61.25 2ab4 s THR 187 Cb -0.03 -0.62 -0.01 0.00 0.01 0.00 0.00 72.50 71.85 2ab4 s THR 187 CO 0.05 0.21 1.28 0.00 -0.69 0.00 0.00 174.62 175.46 2ab4 s ALA 188 N -0.21 3.65 -0.06 7.40 0.00 -0.93 0.41 121.76 132.03 2ab4 s ALA 188 Ca 0.03 0.46 0.18 0.00 0.00 0.00 0.00 51.96 52.64 2ab4 s ALA 188 Cb -0.04 -3.63 -0.28 0.00 0.00 0.00 0.00 23.12 19.18 2ab4 s ALA 188 CO -0.00 -1.20 0.34 1.33 0.00 0.00 0.00 175.76 176.23 2ab4 n VAL 189 N 5.40 0.26 -3.79 0.00 0.24 -0.10 -2.61 118.33 117.73 2ab4 n VAL 189 Ca 0.14 -0.50 -0.13 0.00 -2.04 0.00 0.00 64.34 61.81 2ab4 n VAL 189 Cb 0.45 -0.06 -0.13 0.00 -1.47 0.00 0.00 33.84 32.63 2ab4 n VAL 189 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2ab4 s GLU 190 N -3.13 0.18 -0.08 7.34 2.02 -1.10 -4.76 118.70 119.17 2ab4 s GLU 190 Ca -0.07 0.29 -0.03 0.00 0.02 0.00 0.00 54.97 55.17 2ab4 s GLU 190 Cb 0.11 0.03 0.05 0.00 0.10 0.00 0.00 34.13 34.41 2ab4 s GLU 190 CO 0.78 -0.06 0.17 -1.17 0.02 0.00 0.00 175.26 174.99 2ab4 s LEU 191 N 0.39 0.25 -0.19 1.80 2.96 -1.26 -1.67 118.68 120.94 2ab4 s LEU 191 Ca -0.02 0.36 -0.00 0.00 -0.22 0.00 0.00 54.13 54.24 2ab4 s LEU 191 Cb -0.04 0.38 0.05 0.00 0.50 0.00 0.00 46.19 47.08 2ab4 s LEU 191 CO -0.02 -0.20 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.06 2ab4 s VAL 192 N 1.80 1.28 -0.63 1.68 1.01 -0.43 -1.26 120.40 123.84 2ab4 s VAL 192 Ca -0.03 -0.84 -0.27 0.00 0.00 0.00 0.00 61.98 60.84 2ab4 s VAL 192 Cb -0.12 -1.48 0.03 0.00 0.00 0.00 0.00 36.38 34.82 2ab4 s VAL 192 CO -0.06 0.06 1.17 -0.60 0.00 0.00 0.00 175.10 175.66 2ab4 s ARG 193 N 1.54 3.36 0.23 2.72 3.52 -0.21 -1.18 118.95 128.92 2ab4 s ARG 193 Ca -0.01 -0.06 0.25 0.00 -0.13 0.00 0.00 55.73 55.78 2ab4 s ARG 193 Cb -0.16 -4.09 0.64 0.00 -1.56 0.00 0.00 34.95 29.77 2ab4 s ARG 193 CO -0.07 -1.81 1.65 0.93 -0.81 0.00 0.00 175.30 175.19 2ab4 h GLU 194 N 9.66 0.00 -1.59 5.12 5.08 -1.25 -0.06 114.58 131.55 2ab4 h GLU 194 Ca -0.26 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.16 2ab4 h GLU 194 Cb 1.06 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 30.05 2ab4 h GLU 194 CO 1.20 0.00 0.47 -1.54 -1.00 0.00 0.00 179.01 178.14 2ab4 s SER 195 N -4.74 -0.43 -0.30 1.42 1.04 -1.09 -0.75 113.70 108.84 2ab4 s SER 195 Ca 0.09 0.77 0.02 0.00 0.48 0.00 0.00 55.95 57.32 2ab4 s SER 195 Cb 0.11 0.76 0.09 0.00 0.10 0.00 0.00 66.02 67.08 2ab4 s SER 195 CO 0.64 -0.19 0.02 -0.69 0.98 0.00 0.00 173.24 174.00 2ab4 s VAL 196 N -0.03 1.87 0.00 5.02 1.01 0.15 -1.87 120.40 126.55 2ab4 s VAL 196 Ca 0.02 -1.87 0.00 0.00 0.00 0.00 0.00 61.98 60.13 2ab4 s VAL 196 Cb -0.04 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 34.05 2ab4 s VAL 196 CO -0.05 -0.45 0.00 0.61 0.00 0.00 0.00 175.10 175.22 2ab4 n GLY 197 N 4.46 2.28 0.06 4.51 0.00 0.58 -2.17 105.19 114.90 2ab4 n GLY 197 Ca -0.02 -0.34 0.13 0.00 0.00 0.00 0.00 46.02 45.79 2ab4 n GLY 197 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ab4 n PRO 198 N 13.17 0.31 -2.93 1.61 -0.04 -1.26 -4.84 135.00 141.02 2ab4 n PRO 198 Ca 0.00 -0.12 -0.41 0.00 -0.04 0.00 0.00 63.50 62.92 2ab4 n PRO 198 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.92 2ab4 n PRO 198 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2ab4 s HIS 199 N -2.77 3.32 0.34 0.54 3.76 -0.92 -5.05 115.29 114.50 2ab4 s HIS 199 Ca 0.19 1.09 0.07 0.00 -0.15 0.00 0.00 55.06 56.26 2ab4 s HIS 199 Cb 0.19 -3.01 -0.02 0.00 1.11 0.00 0.00 32.58 30.85 2ab4 s HIS 199 CO 0.56 -0.37 0.32 0.95 -0.85 0.00 0.00 174.74 175.35 2ab4 s THR 200 N 2.71 3.59 0.32 1.30 -4.23 -1.26 -0.67 115.64 117.40 2ab4 s THR 200 Ca 0.33 -1.32 0.20 0.00 -1.18 0.00 0.00 61.69 59.73 2ab4 s THR 200 Cb -0.15 -3.21 0.18 0.00 1.34 0.00 0.00 72.50 70.65 2ab4 s THR 200 CO 0.08 -0.17 1.89 -0.29 -0.54 0.00 0.00 174.62 175.59 2ab4 h ILE 201 N 1.19 0.88 -0.07 2.99 2.10 -1.23 -2.17 117.51 121.20 2ab4 h ILE 201 Ca -0.45 -1.06 -0.02 0.00 1.08 0.00 0.00 64.86 64.41 2ab4 h ILE 201 Cb 1.25 1.63 -0.01 0.00 -1.09 0.00 0.00 36.82 38.61 2ab4 h ILE 201 CO 0.58 0.27 -0.04 -0.33 -1.08 0.00 0.00 178.15 177.55 2ab4 h GLU 202 N 0.00 0.10 0.00 2.19 3.07 -1.95 -1.98 114.58 116.01 2ab4 h GLU 202 Ca -0.00 -0.01 -0.05 0.00 -0.50 0.00 0.00 59.36 58.79 2ab4 h GLU 202 Cb 0.61 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.49 2ab4 h GLU 202 CO 0.04 0.15 -1.06 0.93 -1.40 0.00 0.00 179.01 177.66 2ab4 h GLU 203 N 0.10 0.00 -6.77 2.33 5.08 -1.78 -3.48 114.58 110.05 2ab4 h GLU 203 Ca 0.02 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.83 2ab4 h GLU 203 Cb 0.14 0.00 0.19 0.00 0.50 0.00 0.00 28.75 29.57 2ab4 h GLU 203 CO 0.01 0.10 -0.23 -1.13 -1.00 0.00 0.00 179.01 176.76 2ab4 n SER 204 N -2.78 -0.67 -4.07 1.42 3.41 -0.75 -4.88 113.62 105.31 2ab4 n SER 204 Ca -0.03 0.60 -0.25 0.00 -0.26 0.00 0.00 58.87 58.93 2ab4 n SER 204 Cb 0.64 -1.28 -0.16 0.00 -0.26 0.00 0.00 64.21 63.14 2ab4 n SER 204 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2ab4 s LEU 205 N -1.36 1.76 -0.81 1.04 2.96 -0.41 -4.76 118.68 117.11 2ab4 s LEU 205 Ca 0.67 -0.33 -0.25 0.00 -0.22 0.00 0.00 54.13 54.01 2ab4 s LEU 205 Cb -0.34 -0.90 0.05 0.00 0.50 0.00 0.00 46.19 45.50 2ab4 s LEU 205 CO 0.56 0.08 1.27 0.21 -1.32 0.00 0.00 176.35 177.14 2ab4 s ASN 206 N 0.44 6.28 0.47 3.68 3.84 -1.26 -0.49 114.94 127.90 2ab4 s ASN 206 Ca -0.12 -0.88 0.14 0.00 0.21 0.00 0.00 52.86 52.21 2ab4 s ASN 206 Cb -0.14 -2.53 1.11 0.00 -0.55 0.00 0.00 41.25 39.13 2ab4 s ASN 206 CO 0.04 -1.65 2.06 -0.37 -2.79 0.00 0.00 177.10 174.38 2ab4 h VAL 207 N 6.20 0.96 0.00 -5.21 -1.51 -1.91 -0.90 116.25 113.89 2ab4 h VAL 207 Ca -0.13 -0.09 -0.00 0.00 -1.23 0.00 0.00 66.70 65.24 2ab4 h VAL 207 Cb 1.04 0.67 -0.00 0.00 -2.13 0.00 0.00 31.29 30.87 2ab4 h VAL 207 CO 1.29 0.05 -0.02 -0.26 -1.23 0.00 0.00 177.57 177.40 2ab4 h PHE 208 N 0.27 0.00 0.00 5.19 0.04 -1.89 -2.83 116.94 117.72 2ab4 h PHE 208 Ca 0.15 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.92 2ab4 h PHE 208 Cb 0.27 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.42 2ab4 h PHE 208 CO -0.00 0.02 -0.70 0.39 -0.60 0.00 0.00 178.31 177.42 2ab4 n GLU 209 N -4.43 2.35 -3.26 1.51 1.02 -0.55 -5.00 120.64 112.29 2ab4 n GLU 209 Ca -0.03 -0.01 -0.30 0.00 -0.02 0.00 0.00 57.16 56.80 2ab4 n GLU 209 Cb 0.11 -1.16 -0.04 0.00 -0.02 0.00 0.00 31.44 30.33 2ab4 n GLU 209 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ab4 s ALA 210 N -2.33 3.53 0.32 0.62 0.00 -0.45 -5.08 121.76 118.37 2ab4 s ALA 210 Ca 0.05 -0.35 -0.04 0.00 0.00 0.00 0.00 51.96 51.62 2ab4 s ALA 210 Cb 0.10 -2.46 -0.05 0.00 0.00 0.00 0.00 23.12 20.72 2ab4 s ALA 210 CO 0.56 0.30 0.58 0.00 0.00 0.00 0.00 175.76 177.20 2ab4 s ALA 211 N -2.03 3.61 0.37 0.00 0.00 -1.26 -4.88 121.76 117.56 2ab4 s ALA 211 Ca 0.47 -0.63 0.18 0.00 0.00 0.00 0.00 51.96 51.98 2ab4 s ALA 211 Cb -0.11 -2.29 1.16 0.00 0.00 0.00 0.00 23.12 21.88 2ab4 s ALA 211 CO 0.26 0.11 1.67 -1.35 0.00 0.00 0.00 175.76 176.46 2ab4 h PRO 212 N 1.30 0.29 0.07 0.00 0.11 -1.96 0.47 132.00 132.28 2ab4 h PRO 212 Ca -0.48 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 2ab4 h PRO 212 Cb 1.20 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2ab4 h PRO 212 CO 0.64 0.19 -0.03 0.93 -0.21 0.00 0.00 178.00 179.52 2ab4 h GLU 213 N 0.29 -0.09 -0.53 1.05 3.07 -1.93 -1.27 114.58 115.17 2ab4 h GLU 213 Ca 0.73 0.01 -0.04 0.00 -0.50 0.00 0.00 59.36 59.55 2ab4 h GLU 213 Cb 1.82 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 29.73 2ab4 h GLU 213 CO -0.51 -0.02 0.16 1.49 -1.40 0.00 0.00 179.01 178.73 2ab4 h GLU 214 N -0.13 0.83 -0.64 2.33 4.81 -1.33 -1.87 114.58 118.58 2ab4 h GLU 214 Ca -0.01 -0.18 -0.06 0.00 -0.13 0.00 0.00 59.36 58.98 2ab4 h GLU 214 Cb 0.11 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 2ab4 h GLU 214 CO 0.02 0.77 0.16 0.82 -0.73 0.00 0.00 179.01 180.04 2ab4 h ILE 215 N 0.74 1.25 -0.41 2.32 2.04 -1.21 -2.22 117.51 120.02 2ab4 h ILE 215 Ca 0.17 -0.91 -0.08 0.00 1.00 0.00 0.00 64.86 65.04 2ab4 h ILE 215 Cb 0.28 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 2ab4 h ILE 215 CO -0.00 0.35 -0.05 -0.08 0.00 0.00 0.00 178.15 178.36 2ab4 h GLU 216 N 0.96 0.76 0.00 2.37 4.81 -1.04 -2.70 114.58 119.74 2ab4 h GLU 216 Ca 0.20 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2ab4 h GLU 216 Cb 0.34 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.67 2ab4 h GLU 216 CO 0.00 0.87 0.00 0.09 -0.73 0.00 0.00 179.01 179.24 2ab4 n ASN 217 N -4.37 0.00 0.05 1.04 3.02 -0.72 -2.81 115.26 111.46 2ab4 n ASN 217 Ca -0.01 0.06 0.11 0.00 -0.03 0.00 0.00 54.58 54.71 2ab4 n ASN 217 Cb 0.33 -0.34 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 2ab4 n ASN 217 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 2ab4 n ARG 218 N -1.34 0.56 -1.78 3.52 3.00 -0.85 -4.92 116.66 114.85 2ab4 n ARG 218 Ca 0.11 -0.02 -0.42 0.00 -0.00 0.00 0.00 57.85 57.52 2ab4 n ARG 218 Cb 0.22 -1.67 -0.03 0.00 0.00 0.00 0.00 32.46 30.99 2ab4 n ARG 218 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2ab4 s ILE 219 N -3.39 2.56 -0.24 5.15 1.01 -1.08 -4.74 121.20 120.47 2ab4 s ILE 219 Ca -0.02 0.16 -0.27 0.00 0.00 0.00 0.00 60.65 60.52 2ab4 s ILE 219 Cb 0.12 -3.11 0.00 0.00 0.01 0.00 0.00 42.46 39.49 2ab4 s ILE 219 CO 0.84 0.00 0.95 -0.63 0.00 0.00 0.00 174.94 176.10 2ab4 s ILE 220 N 2.33 4.74 0.81 2.92 1.01 0.15 -4.90 121.20 128.27 2ab4 s ILE 220 Ca 0.78 1.81 -0.13 0.00 0.00 0.00 0.00 60.65 63.10 2ab4 s ILE 220 Cb -0.45 -4.23 0.08 0.00 0.01 0.00 0.00 42.46 37.87 2ab4 s ILE 220 CO 0.34 -0.15 1.21 -0.81 0.00 0.00 0.00 174.94 175.54 2ab4 n PRO 221 N 6.21 0.18 -0.28 2.79 -0.04 -1.26 -1.40 135.00 141.19 2ab4 n PRO 221 Ca 0.09 0.14 0.12 0.00 -0.04 0.00 0.00 63.50 63.81 2ab4 n PRO 221 Cb 0.47 -2.44 0.37 0.00 -0.04 0.00 0.00 33.50 31.86 2ab4 n PRO 221 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2ab4 h LEU 222 N -0.92 0.66 -2.72 1.53 3.38 -1.77 -0.44 115.31 115.04 2ab4 h LEU 222 Ca -0.46 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.55 2ab4 h LEU 222 Cb 1.30 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 2ab4 h LEU 222 CO 0.46 0.33 -0.01 -0.33 0.09 0.00 0.00 178.44 178.98 2ab4 h GLU 223 N 0.70 0.00 -0.27 1.13 3.07 -1.90 -2.05 114.58 115.26 2ab4 h GLU 223 Ca 0.46 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 59.30 2ab4 h GLU 223 Cb 0.73 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.63 2ab4 h GLU 223 CO -0.21 0.01 0.00 1.63 -1.40 0.00 0.00 179.01 179.03 2ab4 n LYS 224 N -3.35 2.87 -3.82 2.33 4.76 -0.18 -4.96 118.16 115.81 2ab4 n LYS 224 Ca -0.03 -2.87 -0.21 0.00 -2.87 0.00 0.00 58.31 52.33 2ab4 n LYS 224 Cb 0.09 -1.85 -0.03 0.00 -1.84 0.00 0.00 35.03 31.40 2ab4 n LYS 224 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ab4 n LEU 226 N -1.40 -1.91 -0.35 0.00 4.77 -1.26 -4.79 117.00 112.06 2ab4 n LEU 226 Ca -0.04 -0.35 0.36 0.00 -0.03 0.00 0.00 56.01 55.95 2ab4 n LEU 226 Cb 0.58 -2.40 0.62 0.00 -2.33 0.00 0.00 43.42 39.90 2ab4 n LEU 226 CO 0.43 0.18 1.33 -0.08 -1.33 0.00 0.00 177.39 177.92 2ab4 h GLU 227 N -1.10 0.00 -0.04 3.23 4.57 -1.96 -1.16 114.58 118.13 2ab4 h GLU 227 Ca -0.46 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 2ab4 h GLU 227 Cb 1.31 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.90 2ab4 h GLU 227 CO 0.54 0.00 0.00 -2.67 -1.18 0.00 0.00 179.01 175.70 2ab4 n TRP 228 N -3.59 0.04 -3.86 0.92 2.14 -1.26 -4.88 117.44 106.95 2ab4 n TRP 228 Ca 0.28 -0.02 -0.37 0.00 2.07 0.00 0.00 57.50 59.46 2ab4 n TRP 228 Cb 1.56 0.00 -0.06 0.00 -0.81 0.00 0.00 31.31 32.00 2ab4 n TRP 228 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2ab4 s LEU 229 N -1.78 4.39 0.45 5.67 1.43 -0.44 -5.06 118.68 123.34 2ab4 s LEU 229 Ca 0.37 0.49 -0.23 0.00 -1.03 0.00 0.00 54.13 53.73 2ab4 s LEU 229 Cb 0.18 -2.12 -0.10 0.00 0.03 0.00 0.00 46.19 44.18 2ab4 s LEU 229 CO 0.29 0.40 0.87 -2.65 0.23 0.00 0.00 176.35 175.49 2ab4 n PRO 230 N 1.93 1.06 -4.43 1.29 -0.02 -1.26 -4.65 135.00 128.92 2ab4 n PRO 230 Ca -0.19 0.39 -0.24 0.00 -2.02 0.00 0.00 63.50 61.43 2ab4 n PRO 230 Cb 0.55 -1.91 -0.09 0.00 -0.02 0.00 0.00 33.50 32.02 2ab4 n PRO 230 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 2ab4 s ARG 231 N -2.00 1.84 -0.05 -0.52 1.70 -1.26 -1.35 118.95 117.31 2ab4 s ARG 231 Ca 0.65 -1.71 -0.08 0.00 -0.47 0.00 0.00 55.73 54.12 2ab4 s ARG 231 Cb -0.55 -1.85 0.01 0.00 -0.57 0.00 0.00 34.95 32.00 2ab4 s ARG 231 CO 0.56 0.31 0.19 0.14 -1.08 0.00 0.00 175.30 175.42 2ab4 s VAL 232 N -2.48 0.03 -0.09 4.99 -7.23 -0.00 -4.38 120.40 111.23 2ab4 s VAL 232 Ca 0.31 -0.23 0.03 0.00 -1.81 0.00 0.00 61.98 60.28 2ab4 s VAL 232 Cb -0.04 -0.35 0.01 0.00 0.56 0.00 0.00 36.38 36.55 2ab4 s VAL 232 CO 0.16 -0.13 -0.20 0.54 -0.31 0.00 0.00 175.10 175.17 2ab4 s VAL 233 N -0.41 1.74 0.28 1.32 0.11 -1.26 -0.15 120.40 122.03 2ab4 s VAL 233 Ca -0.05 -0.83 0.08 0.00 -2.93 0.00 0.00 61.98 58.25 2ab4 s VAL 233 Cb -0.03 -1.53 -0.04 0.00 -1.53 0.00 0.00 36.38 33.25 2ab4 s VAL 233 CO 0.01 0.49 0.14 0.68 -3.33 0.00 0.00 175.10 173.09 2ab4 s VAL 234 N 0.51 3.83 0.43 2.04 -7.23 -1.01 -1.11 120.40 117.85 2ab4 s VAL 234 Ca -0.16 -1.60 -0.26 0.00 -1.81 0.00 0.00 61.98 58.15 2ab4 s VAL 234 Cb -0.17 -3.15 -0.09 0.00 0.56 0.00 0.00 36.38 33.53 2ab4 s VAL 234 CO 0.06 -0.31 1.37 1.41 -0.31 0.00 0.00 175.10 177.32 2ab4 n HIS 235 N -1.11 2.48 0.21 2.82 8.25 -0.75 -3.07 115.22 124.04 2ab4 n HIS 235 Ca -0.06 0.47 0.13 0.00 -0.26 0.00 0.00 57.72 58.00 2ab4 n HIS 235 Cb 0.59 -2.43 0.68 0.00 1.12 0.00 0.00 29.99 29.95 2ab4 n HIS 235 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 2ab4 h GLN 236 N 2.29 0.00 0.05 -0.41 -0.00 -1.93 0.21 115.11 115.31 2ab4 h GLN 236 Ca -0.49 0.00 -0.24 0.00 -0.00 0.00 0.00 58.65 57.91 2ab4 h GLN 236 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.76 2ab4 h GLN 236 CO 0.61 0.00 -1.05 0.93 0.00 0.00 0.00 178.83 179.32 2ab4 h GLU 237 N 0.00 0.36 0.00 1.69 5.08 -1.98 -3.10 114.58 116.62 2ab4 h GLU 237 Ca 0.00 -0.45 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 2ab4 h GLU 237 Cb 0.15 0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.55 2ab4 h GLU 237 CO 0.00 1.14 0.00 0.43 -1.00 0.00 0.00 179.01 179.58 2ab4 n SER 238 N -3.68 0.00 0.00 1.42 7.64 0.71 -4.45 113.62 115.27 2ab4 n SER 238 Ca -0.07 0.21 0.00 0.00 1.01 0.00 0.00 58.87 60.02 2ab4 n SER 238 Cb 0.90 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 2ab4 n SER 238 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2ab4 n THR 239 N -1.40 0.00 0.19 0.44 -1.04 -1.13 -2.23 114.28 109.12 2ab4 n THR 239 Ca 0.09 0.77 0.06 0.00 -2.04 0.00 0.00 64.05 62.94 2ab4 n THR 239 Cb 0.26 -1.44 0.33 0.00 -1.82 0.00 0.00 70.33 67.66 2ab4 n THR 239 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 2ab4 h LYS 240 N 0.00 0.00 0.05 -2.82 3.11 -1.81 0.43 116.57 115.52 2ab4 h LYS 240 Ca 0.00 0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2ab4 h LYS 240 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.23 2ab4 h LYS 240 CO 0.00 0.00 -0.02 1.98 -2.81 0.00 0.00 179.45 178.60 2ab4 h MET 241 N 0.00 -0.06 -0.21 1.90 4.05 -1.75 -3.33 114.93 115.54 2ab4 h MET 241 Ca 0.00 0.00 -0.21 0.00 -0.28 0.00 0.00 59.70 59.22 2ab4 h MET 241 Cb 0.85 0.01 0.01 0.00 -0.80 0.00 0.00 31.60 31.67 2ab4 h MET 241 CO 0.00 0.56 -0.69 0.82 0.23 0.00 0.00 176.91 177.84 2ab4 h ILE 242 N -0.90 1.28 0.00 1.77 2.04 -0.62 -1.79 117.51 119.29 2ab4 h ILE 242 Ca -0.01 -1.87 -0.29 0.00 1.00 0.00 0.00 64.86 63.69 2ab4 h ILE 242 Cb 0.65 1.85 -0.02 0.00 -0.74 0.00 0.00 36.82 38.56 2ab4 h ILE 242 CO 0.01 0.60 1.26 -0.11 0.00 0.00 0.00 178.15 179.91 2ab4 n LEU 243 N -3.97 4.90 0.00 1.44 7.94 0.13 -2.65 117.00 124.79 2ab4 n LEU 243 Ca -0.06 -2.87 0.00 0.00 -1.11 0.00 0.00 56.01 51.97 2ab4 n LEU 243 Cb 0.70 -1.13 0.00 0.00 0.53 0.00 0.00 43.42 43.52 2ab4 n LEU 243 CO 0.52 1.12 0.00 -3.20 -1.11 0.00 0.00 177.39 174.72 2ab4 n ASN 244 N 3.22 0.00 0.00 1.96 2.85 -1.22 -4.71 115.26 117.36 2ab4 n ASN 244 Ca 0.42 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.89 2ab4 n ASN 244 Cb 0.45 0.03 0.00 0.00 1.24 0.00 0.00 39.78 41.50 2ab4 n ASN 244 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2ab4 n GLY 245 N -0.95 1.64 7.00 8.20 0.00 -0.68 -5.11 105.19 115.29 2ab4 n GLY 245 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2ab4 n GLY 245 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ab4 n SER 246 N 0.00 -2.45 0.00 1.61 3.41 -1.26 -4.12 113.62 110.80 2ab4 n SER 246 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2ab4 n SER 246 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2ab4 n SER 246 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ab4 n GLN 247 N -0.58 2.69 -3.97 4.33 1.13 -1.26 -4.79 117.38 114.92 2ab4 n GLN 247 Ca 0.00 0.00 -0.29 0.00 -1.94 0.00 0.00 57.00 54.77 2ab4 n GLN 247 Cb 0.00 0.00 -0.16 0.00 0.11 0.00 0.00 30.24 30.19 2ab4 n GLN 247 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2ab4 s ILE 248 N 0.42 1.40 0.08 5.09 1.01 -1.18 -4.77 121.20 123.24 2ab4 s ILE 248 Ca 0.00 -0.62 0.09 0.00 0.00 0.00 0.00 60.65 60.11 2ab4 s ILE 248 Cb 0.00 -1.40 -0.04 0.00 0.01 0.00 0.00 42.46 41.04 2ab4 s ILE 248 CO 0.00 0.34 -0.21 -1.00 0.00 0.00 0.00 174.94 174.07 2ab4 s HIS 249 N 1.54 2.47 0.14 3.97 3.76 -1.26 -3.15 115.29 122.75 2ab4 s HIS 249 Ca 0.03 -0.30 0.10 0.00 -0.15 0.00 0.00 55.06 54.74 2ab4 s HIS 249 Cb -0.14 -1.38 0.46 0.00 1.11 0.00 0.00 32.58 32.63 2ab4 s HIS 249 CO -0.09 0.29 0.49 -0.11 -0.85 0.00 0.00 174.74 174.46 2ab4 n LEU 250 N 1.26 0.07 -3.10 0.89 0.00 -1.26 -0.78 117.00 114.08 2ab4 n LEU 250 Ca -0.16 0.45 -0.32 0.00 0.00 0.00 0.00 56.01 55.97 2ab4 n LEU 250 Cb 0.52 -0.22 -0.01 0.00 0.00 0.00 0.00 43.42 43.71 2ab4 n LEU 250 CO 0.26 -0.49 0.66 1.21 0.00 0.00 0.00 177.39 179.03 2ab4 n GLU 251 N -3.34 3.92 0.00 1.96 2.13 -1.26 -3.97 120.64 120.08 2ab4 n GLU 251 Ca 0.13 -4.66 0.00 0.00 0.66 0.00 0.00 57.16 53.28 2ab4 n GLU 251 Cb 0.48 -2.32 0.00 0.00 0.27 0.00 0.00 31.44 29.88 2ab4 n GLU 251 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 2ab4 n MET 252 N -0.24 0.06 -0.53 5.31 2.81 0.04 -5.06 117.12 119.50 2ab4 n MET 252 Ca 0.39 0.00 -0.30 0.00 -1.81 0.00 0.00 57.70 55.98 2ab4 n MET 252 Cb 0.37 -0.40 0.27 0.00 -0.71 0.00 0.00 33.22 32.76 2ab4 n MET 252 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2ab4 s LEU 253 N -0.99 -0.53 0.00 4.03 1.43 -1.23 -1.81 118.68 119.58 2ab4 s LEU 253 Ca 0.00 0.90 0.00 0.00 -1.03 0.00 0.00 54.13 54.00 2ab4 s LEU 253 Cb 0.00 -2.44 0.00 0.00 0.03 0.00 0.00 46.19 43.78 2ab4 s LEU 253 CO 0.00 -4.99 0.00 1.17 0.23 0.00 0.00 176.35 172.76 2ab4 n LYS 254 N -5.39 0.00 -4.31 1.70 4.81 -0.27 -4.57 118.16 110.14 2ab4 n LYS 254 Ca 0.11 0.00 -0.18 0.00 -0.87 0.00 0.00 58.31 57.37 2ab4 n LYS 254 Cb 0.59 -0.01 -0.14 0.00 0.02 0.00 0.00 35.03 35.50 2ab4 n LYS 254 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2ab4 s GLU 255 N -1.00 0.79 0.00 1.64 2.02 -1.20 -4.99 118.70 115.96 2ab4 s GLU 255 Ca 0.00 -0.59 0.00 0.00 0.02 0.00 0.00 54.97 54.40 2ab4 s GLU 255 Cb 0.00 -0.75 0.00 0.00 0.10 0.00 0.00 34.13 33.48 2ab4 s GLU 255 CO 0.00 0.19 0.00 0.91 0.02 0.00 0.00 175.26 176.38 2ab4 n TRP 256 N 2.20 0.00 -1.03 1.61 7.02 -1.26 -4.18 117.44 121.80 2ab4 n TRP 256 Ca -0.17 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.31 2ab4 n TRP 256 Cb 0.56 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.45 2ab4 n TRP 256 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 2ab4 n ASP 257 N 0.00 -5.09 -4.78 -0.99 9.92 -1.26 -4.64 116.55 109.70 2ab4 n ASP 257 Ca 0.00 0.59 -0.38 0.00 -0.53 0.00 0.00 54.79 54.47 2ab4 n ASP 257 Cb 0.00 -2.30 -0.06 0.00 -0.64 0.00 0.00 41.12 38.12 2ab4 n ASP 257 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 2ab4 s GLY 258 N -0.70 2.47 0.00 0.44 0.00 -1.26 -4.86 107.32 103.41 2ab4 s GLY 258 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 44.72 44.55 2ab4 s GLY 258 CO 0.00 0.46 0.00 1.97 0.00 0.00 0.00 173.10 175.53 2ab4 n PHE 259 N 2.58 -0.29 -1.97 1.90 -1.74 -1.26 -4.82 117.46 111.86 2ab4 n PHE 259 Ca -0.11 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.78 2ab4 n PHE 259 Cb 0.52 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.52 2ab4 n PHE 259 CO 0.00 0.00 0.00 1.63 -0.56 0.00 0.00 176.76 177.83 2ab4 n LYS 260 N -0.10 4.00 0.00 3.97 4.76 -1.26 -3.69 118.16 125.84 2ab4 n LYS 260 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2ab4 n LYS 260 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2ab4 n LYS 260 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2ab4 n LYS 261 N 0.00 0.00 -0.86 1.97 3.00 -1.26 -3.45 118.16 117.57 2ab4 n LYS 261 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 58.31 58.15 2ab4 n LYS 261 Cb 0.00 -0.19 0.05 0.00 0.00 0.00 0.00 35.03 34.89 2ab4 n LYS 261 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2ab4 n GLY 262 N 1.69 4.00 3.82 3.14 0.00 -1.26 -3.61 105.19 112.97 2ab4 n GLY 262 Ca 0.00 -1.03 -0.33 0.00 0.00 0.00 0.00 46.02 44.66 2ab4 n GLY 262 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ab4 s GLU 263 N -1.86 3.92 -0.04 1.61 2.12 -1.26 -4.70 118.70 118.48 2ab4 s GLU 263 Ca 0.32 1.17 -0.13 0.00 0.36 0.00 0.00 54.97 56.69 2ab4 s GLU 263 Cb 0.25 -2.12 -0.05 0.00 0.26 0.00 0.00 34.13 32.47 2ab4 s GLU 263 CO 0.01 -0.31 0.33 0.08 -0.54 0.00 0.00 175.26 174.83 2ab4 s VAL 264 N -2.25 5.17 0.09 3.70 1.01 -1.26 0.14 120.40 127.00 2ab4 s VAL 264 Ca 0.63 0.66 0.05 0.00 0.00 0.00 0.00 61.98 63.31 2ab4 s VAL 264 Cb -0.12 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 2ab4 s VAL 264 CO 0.22 0.58 -0.12 0.68 0.00 0.00 0.00 175.10 176.46 2ab4 s VAL 265 N -1.01 1.06 -0.12 2.92 -7.23 0.30 -4.28 120.40 112.03 2ab4 s VAL 265 Ca 0.21 -1.50 -0.18 0.00 -1.81 0.00 0.00 61.98 58.70 2ab4 s VAL 265 Cb -0.15 -1.24 -0.04 0.00 0.56 0.00 0.00 36.38 35.51 2ab4 s VAL 265 CO 0.10 -0.40 0.47 -0.13 -0.31 0.00 0.00 175.10 174.83 2ab4 s ARG 266 N -2.31 4.33 -0.42 4.82 0.52 -0.46 -1.57 118.95 123.86 2ab4 s ARG 266 Ca 0.02 0.43 -0.12 0.00 -0.52 0.00 0.00 55.73 55.55 2ab4 s ARG 266 Cb -0.06 -3.43 0.06 0.00 0.52 0.00 0.00 34.95 32.04 2ab4 s ARG 266 CO 0.01 0.17 0.29 0.08 0.02 0.00 0.00 175.30 175.87 2ab4 s VAL 267 N 0.58 4.63 0.00 3.52 1.01 0.13 -0.82 120.40 129.45 2ab4 s VAL 267 Ca 0.25 -1.15 0.00 0.00 0.00 0.00 0.00 61.98 61.09 2ab4 s VAL 267 Cb -0.15 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.49 2ab4 s VAL 267 CO 0.10 -0.45 0.00 0.49 0.00 0.00 0.00 175.10 175.24 2ab4 n PHE 268 N 5.03 -1.80 -3.66 5.22 3.01 0.79 0.02 117.46 126.06 2ab4 n PHE 268 Ca -0.11 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.33 2ab4 n PHE 268 Cb 0.44 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.90 2ab4 n PHE 268 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 2ab4 n ASN 269 N -1.94 -0.21 -0.08 4.37 6.94 -1.10 -2.42 115.26 120.83 2ab4 n ASN 269 Ca 0.00 -1.30 -0.06 0.00 -0.02 0.00 0.00 54.58 53.20 2ab4 n ASN 269 Cb 0.00 0.39 -0.00 0.00 -2.36 0.00 0.00 39.78 37.81 2ab4 n ASN 269 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 2ab4 h GLU 270 N 0.00 0.02 -0.69 -3.83 4.57 -1.83 -1.85 114.58 110.97 2ab4 h GLU 270 Ca -0.04 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2ab4 h GLU 270 Cb 0.19 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 2ab4 h GLU 270 CO 0.06 0.01 0.00 0.39 -1.18 0.00 0.00 179.01 178.29 2ab4 n GLU 271 N -5.24 0.93 -0.06 1.92 1.02 -1.26 -4.84 120.64 113.11 2ab4 n GLU 271 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2ab4 n GLU 271 Cb 0.17 -1.35 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 2ab4 n GLU 271 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ab4 n GLY 272 N 0.14 1.47 3.74 0.62 0.00 -0.69 -4.96 105.19 105.51 2ab4 n GLY 272 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2ab4 n GLY 272 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ab4 s ARG 273 N -0.04 4.11 -0.71 1.61 3.52 -1.26 -4.64 118.95 121.54 2ab4 s ARG 273 Ca 0.00 2.60 -0.27 0.00 -0.13 0.00 0.00 55.73 57.93 2ab4 s ARG 273 Cb 0.00 -3.03 0.03 0.00 -1.56 0.00 0.00 34.95 30.39 2ab4 s ARG 273 CO 0.00 -0.67 1.25 -1.17 -0.81 0.00 0.00 175.30 173.90 2ab4 s LEU 274 N -0.18 3.25 -0.03 -0.88 2.96 -1.26 -2.70 118.68 119.85 2ab4 s LEU 274 Ca 0.66 -0.39 -0.25 0.00 -0.22 0.00 0.00 54.13 53.93 2ab4 s LEU 274 Cb -0.49 -2.65 -0.19 0.00 0.50 0.00 0.00 46.19 43.37 2ab4 s LEU 274 CO 0.45 -1.77 1.18 -0.07 -1.32 0.00 0.00 176.35 174.82 2ab4 h LEU 275 N 12.79 -0.08 0.00 -0.68 4.07 -0.69 -3.45 115.31 127.27 2ab4 h LEU 275 Ca -0.28 -0.43 0.18 0.00 0.08 0.00 0.00 57.88 57.43 2ab4 h LEU 275 Cb 1.05 0.02 -0.03 0.00 1.08 0.00 0.00 40.66 42.78 2ab4 h LEU 275 CO 1.26 0.41 0.62 0.00 -1.08 0.00 0.00 178.44 179.65 2ab4 n ALA 276 N -2.41 -2.78 -3.71 1.53 0.00 -0.91 -2.56 120.51 109.67 2ab4 n ALA 276 Ca -0.09 -1.01 -0.34 0.00 0.00 0.00 0.00 53.44 52.00 2ab4 n ALA 276 Cb 0.26 0.54 -0.15 0.00 0.00 0.00 0.00 19.45 20.10 2ab4 n ALA 276 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ab4 s LEU 277 N 0.00 2.61 0.14 0.00 1.43 0.36 0.20 118.68 123.42 2ab4 s LEU 277 Ca 0.24 -0.48 0.10 0.00 -1.03 0.00 0.00 54.13 52.95 2ab4 s LEU 277 Cb -0.03 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 2ab4 s LEU 277 CO 0.05 -0.01 -0.19 0.00 0.23 0.00 0.00 176.35 176.43 2ab4 s ALA 278 N 1.37 2.65 -0.27 4.21 0.00 -0.61 -0.66 121.76 128.46 2ab4 s ALA 278 Ca 0.05 -1.43 -0.10 0.00 0.00 0.00 0.00 51.96 50.48 2ab4 s ALA 278 Cb -0.14 -0.57 -0.05 0.00 0.00 0.00 0.00 23.12 22.36 2ab4 s ALA 278 CO -0.07 0.54 0.17 -2.00 0.00 0.00 0.00 175.76 174.41 2ab4 s GLU 279 N -2.30 3.92 0.42 0.00 2.12 -0.07 -0.54 118.70 122.25 2ab4 s GLU 279 Ca 0.19 -0.34 -0.24 0.00 0.36 0.00 0.00 54.97 54.93 2ab4 s GLU 279 Cb -0.10 -3.59 -0.10 0.00 0.26 0.00 0.00 34.13 30.60 2ab4 s GLU 279 CO 0.10 -0.15 1.06 0.00 -0.54 0.00 0.00 175.26 175.74 2ab4 n ALA 280 N 4.93 0.39 -0.10 6.30 0.00 0.12 -1.82 120.51 130.34 2ab4 n ALA 280 Ca -0.14 0.23 -0.10 0.00 0.00 0.00 0.00 53.44 53.42 2ab4 n ALA 280 Cb 0.52 -2.12 -0.14 0.00 0.00 0.00 0.00 19.45 17.71 2ab4 n ALA 280 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2ab4 n GLU 281 N 0.10 0.91 -3.94 0.00 4.07 -0.90 -3.98 120.64 116.88 2ab4 n GLU 281 Ca 0.09 0.01 -0.09 0.00 -0.06 0.00 0.00 57.16 57.12 2ab4 n GLU 281 Cb 0.39 -1.48 -0.09 0.00 -0.06 0.00 0.00 31.44 30.21 2ab4 n GLU 281 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 2ab4 s ARG 282 N -2.45 0.68 0.46 5.31 0.52 -1.26 -4.80 118.95 117.41 2ab4 s ARG 282 Ca -0.13 -0.93 -0.25 0.00 -0.52 0.00 0.00 55.73 53.90 2ab4 s ARG 282 Cb 0.06 0.26 -0.08 0.00 0.52 0.00 0.00 34.95 35.71 2ab4 s ARG 282 CO 0.73 -0.18 1.44 -1.71 0.02 0.00 0.00 175.30 175.60 2ab4 n ASN 283 N 0.34 3.32 -4.59 0.23 5.15 -1.22 -4.70 115.26 113.79 2ab4 n ASN 283 Ca -0.16 1.11 -0.42 0.00 -0.60 0.00 0.00 54.58 54.50 2ab4 n ASN 283 Cb 0.60 -1.61 -0.03 0.00 -0.53 0.00 0.00 39.78 38.22 2ab4 n ASN 283 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2ab4 s SER 284 N -0.50 5.99 -0.44 1.20 0.15 -1.24 -4.87 113.70 113.98 2ab4 s SER 284 Ca 0.62 1.00 0.06 0.00 0.70 0.00 0.00 55.95 58.32 2ab4 s SER 284 Cb -0.44 -2.53 0.19 0.00 -1.71 0.00 0.00 66.02 61.52 2ab4 s SER 284 CO 0.57 -1.69 0.72 -0.94 1.20 0.00 0.00 173.24 173.11 2ab4 s SER 285 N 5.49 -1.35 0.61 5.45 1.04 -1.26 -4.82 113.70 118.86 2ab4 s SER 285 Ca 0.71 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 56.06 2ab4 s SER 285 Cb -0.18 1.75 0.00 0.00 0.10 0.00 0.00 66.02 67.69 2ab4 s SER 285 CO 0.32 -0.11 0.00 0.49 0.98 0.00 0.00 173.24 174.92 2ab4 n PHE 286 N 3.70 -0.53 0.00 5.02 3.01 -1.26 -5.24 117.46 122.16 2ab4 n PHE 286 Ca 0.13 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.59 2ab4 n PHE 286 Cb 0.57 0.11 0.00 0.00 -0.01 0.00 0.00 39.48 40.16 2ab4 n PHE 286 CO 0.00 0.00 0.00 2.89 1.01 0.00 0.00 176.76 180.66 2ab4 n ARG 295 N 0.00 0.00 -2.74 -1.08 -4.01 -1.26 -5.17 116.66 102.41 2ab4 n ARG 295 Ca 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.81 2ab4 n ARG 295 Cb 0.00 0.00 0.05 0.00 -3.04 0.00 0.00 32.46 29.47 2ab4 n ARG 295 CO 0.00 0.00 0.00 1.04 -3.04 0.00 0.00 177.63 175.63 2ab4 n GLN 296 N 0.00 1.59 -2.10 2.89 6.02 -1.26 -4.73 117.38 119.79 2ab4 n GLN 296 Ca 0.00 -3.31 -0.14 0.00 -0.01 0.00 0.00 57.00 53.54 2ab4 n GLN 296 Cb 0.00 -1.42 0.06 0.00 1.02 0.00 0.00 30.24 29.90 2ab4 n GLN 296 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2ab4 n GLU 297 N -0.56 0.44 -2.04 -1.09 1.02 -1.26 -4.89 120.64 112.27 2ab4 n GLU 297 Ca 0.06 -1.92 -0.26 0.00 -0.02 0.00 0.00 57.16 55.02 2ab4 n GLU 297 Cb 0.83 -0.30 -0.05 0.00 -0.02 0.00 0.00 31.44 31.90 2ab4 n GLU 297 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2ab4 s ARG 298 N -3.95 2.53 0.02 3.49 1.81 -1.26 -4.12 118.95 117.48 2ab4 s ARG 298 Ca 0.42 -0.29 -0.25 0.00 -1.72 0.00 0.00 55.73 53.89 2ab4 s ARG 298 Cb -0.03 -5.06 -0.18 0.00 -0.45 0.00 0.00 34.95 29.24 2ab4 s ARG 298 CO 0.27 -3.41 1.41 0.28 -0.68 0.00 0.00 175.30 173.17 2ab4 h VAL 299 N 7.26 1.05 -3.81 3.52 2.07 -1.93 -3.41 116.25 121.00 2ab4 h VAL 299 Ca 0.10 -0.62 -0.23 0.00 0.82 0.00 0.00 66.70 66.77 2ab4 h VAL 299 Cb 1.00 1.45 -0.26 0.00 -1.52 0.00 0.00 31.29 31.96 2ab4 h VAL 299 CO 1.21 0.15 -0.72 -0.76 0.02 0.00 0.00 177.57 177.47 2ab4 s LEU 300 N -9.62 2.07 -0.24 2.57 1.43 -1.19 -2.12 118.68 111.58 2ab4 s LEU 300 Ca -0.15 -0.14 -0.05 0.00 -1.03 0.00 0.00 54.13 52.76 2ab4 s LEU 300 Cb 0.03 -0.01 -0.01 0.00 0.03 0.00 0.00 46.19 46.23 2ab4 s LEU 300 CO 0.63 -0.07 0.01 -0.89 0.23 0.00 0.00 176.35 176.26 2ab4 s THR 301 N -0.40 3.71 0.06 5.49 2.01 -0.76 -3.11 115.64 122.64 2ab4 s THR 301 Ca -0.04 -0.46 -0.36 0.00 0.31 0.00 0.00 61.69 61.14 2ab4 s THR 301 Cb -0.03 -2.75 -0.15 0.00 0.01 0.00 0.00 72.50 69.58 2ab4 s THR 301 CO -0.00 0.33 1.49 0.18 -0.69 0.00 0.00 174.62 175.93 2ab4 n LEU 302 N 4.84 2.28 -0.00 4.42 4.77 -1.26 -0.89 117.00 131.15 2ab4 n LEU 302 Ca -0.17 1.09 0.01 0.00 -0.03 0.00 0.00 56.01 56.92 2ab4 n LEU 302 Cb 0.50 -1.27 -0.02 0.00 -2.33 0.00 0.00 43.42 40.31 2ab4 n LEU 302 CO 0.30 -0.69 0.00 -1.14 -1.33 0.00 0.00 177.39 174.53 2ab4 n ARG 303 N 3.36 5.83 -3.64 3.23 0.63 0.17 -4.84 116.66 121.39 2ab4 n ARG 303 Ca 0.19 -0.02 -0.04 0.00 -0.92 0.00 0.00 57.85 57.06 2ab4 n ARG 303 Cb 0.22 -0.65 -0.07 0.00 0.45 0.00 0.00 32.46 32.41 2ab4 n ARG 303 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 2ab4 s LYS 304 N -1.25 0.27 -0.04 -0.14 2.47 -0.78 -4.98 119.74 115.29 2ab4 s LYS 304 Ca 0.01 0.37 0.01 0.00 -1.56 0.00 0.00 55.97 54.80 2ab4 s LYS 304 Cb 0.02 0.10 0.02 0.00 -1.46 0.00 0.00 37.83 36.51 2ab4 s LYS 304 CO 0.12 -0.04 -0.06 0.08 0.16 0.00 0.00 175.35 175.61 2ab4 s VAL 305 N 0.54 0.61 -0.21 4.02 1.01 -1.26 -0.49 120.40 124.62 2ab4 s VAL 305 Ca 0.00 -0.20 -0.08 0.00 0.00 0.00 0.00 61.98 61.70 2ab4 s VAL 305 Cb -0.04 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.70 2ab4 s VAL 305 CO -0.12 0.23 0.08 -0.36 0.00 0.00 0.00 175.10 174.93 2ab4 s PHE 306 N 0.64 3.20 -0.21 5.22 0.40 -1.06 -5.03 117.98 121.14 2ab4 s PHE 306 Ca -0.09 -0.05 -0.04 0.00 -0.60 0.00 0.00 56.93 56.15 2ab4 s PHE 306 Cb -0.12 -2.15 -0.01 0.00 0.51 0.00 0.00 43.02 41.25 2ab4 s PHE 306 CO 0.01 -0.01 -0.04 -0.65 0.70 0.00 0.00 175.22 175.22 2ab4 s GLN 307 N 0.84 3.40 0.00 0.44 -1.52 -1.26 -4.88 119.66 116.68 2ab4 s GLN 307 Ca 0.04 -0.62 0.00 0.00 -1.95 0.00 0.00 55.36 52.83 2ab4 s GLN 307 Cb -0.13 -3.00 0.00 0.00 -0.22 0.00 0.00 33.01 29.65 2ab4 s GLN 307 CO 0.02 -0.16 0.08 2.41 -0.25 0.00 0.00 175.29 177.40