#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uan s LEU 2 N 0.00 2.24 0.18 3.17 1.43 -1.12 -4.96 118.68 119.63 1uan s LEU 2 Ca 0.00 -0.60 0.08 0.00 -1.03 0.00 0.00 54.13 52.58 1uan s LEU 2 Cb 0.00 -0.81 0.03 0.00 0.03 0.00 0.00 46.19 45.44 1uan s LEU 2 CO 0.00 0.06 1.42 0.44 0.23 0.00 0.00 176.35 178.50 1uan h ASP 3 N 4.45 0.03 -3.03 2.29 5.19 -1.48 -2.01 116.42 121.85 1uan h ASP 3 Ca -0.43 -0.03 -0.15 0.00 -0.62 0.00 0.00 57.03 55.80 1uan h ASP 3 Cb 1.18 -0.01 -0.29 0.00 0.18 0.00 0.00 39.33 40.39 1uan h ASP 3 CO 0.41 0.86 -0.41 -0.22 -3.12 0.00 0.00 179.24 176.76 1uan s LEU 4 N -7.14 -0.12 -0.05 1.55 2.96 -1.18 -2.30 118.68 112.40 1uan s LEU 4 Ca -0.00 0.75 0.04 0.00 -0.22 0.00 0.00 54.13 54.69 1uan s LEU 4 Cb 0.11 1.05 0.00 0.00 0.50 0.00 0.00 46.19 47.85 1uan s LEU 4 CO 0.80 -0.20 -0.15 -0.22 -1.32 0.00 0.00 176.35 175.26 1uan s LEU 5 N 1.84 1.84 -0.21 -0.68 2.96 -0.20 -1.50 118.68 122.73 1uan s LEU 5 Ca -0.06 -0.32 -0.07 0.00 -0.22 0.00 0.00 54.13 53.47 1uan s LEU 5 Cb -0.10 -0.88 -0.04 0.00 0.50 0.00 0.00 46.19 45.67 1uan s LEU 5 CO -0.11 0.11 0.06 -0.69 -1.32 0.00 0.00 176.35 174.41 1uan s VAL 6 N 0.21 4.58 -0.27 1.68 1.01 -0.53 -0.90 120.40 126.17 1uan s VAL 6 Ca -0.06 -0.10 -0.12 0.00 0.00 0.00 0.00 61.98 61.69 1uan s VAL 6 Cb -0.12 -3.09 -0.05 0.00 0.00 0.00 0.00 36.38 33.12 1uan s VAL 6 CO 0.02 0.41 0.25 -0.69 0.00 0.00 0.00 175.10 175.10 1uan s VAL 7 N 0.88 5.27 0.11 2.92 1.01 -0.01 -0.53 120.40 130.06 1uan s VAL 7 Ca 0.04 0.33 0.09 0.00 0.00 0.00 0.00 61.98 62.43 1uan s VAL 7 Cb -0.14 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 1uan s VAL 7 CO 0.02 0.23 -0.22 0.00 0.00 0.00 0.00 175.10 175.14 1uan s ALA 8 N 1.74 1.94 0.19 5.51 0.00 -0.33 -4.08 121.76 126.73 1uan s ALA 8 Ca 0.10 -1.31 -0.04 0.00 0.00 0.00 0.00 51.96 50.71 1uan s ALA 8 Cb -0.16 -0.27 0.10 0.00 0.00 0.00 0.00 23.12 22.80 1uan s ALA 8 CO 0.10 0.39 1.51 -1.00 0.00 0.00 0.00 175.76 176.75 1uan h PRO 9 N 3.96 0.61 -3.58 0.00 0.13 -1.90 0.21 132.00 131.45 1uan h PRO 9 Ca -0.47 -0.37 -0.06 0.00 -0.87 0.00 0.00 66.00 64.23 1uan h PRO 9 Cb 1.18 0.04 -0.12 0.00 0.13 0.00 0.00 31.00 32.23 1uan h PRO 9 CO 0.40 0.98 -0.15 -3.38 -0.23 0.00 0.00 178.00 175.63 1uan s HIS 10 N -4.08 0.09 0.35 1.56 -3.43 -1.26 -1.70 115.29 106.81 1uan s HIS 10 Ca -0.08 -0.44 -0.29 0.00 -0.80 0.00 0.00 55.06 53.45 1uan s HIS 10 Cb 0.11 0.17 -0.11 0.00 -1.43 0.00 0.00 32.58 31.32 1uan s HIS 10 CO 0.85 -0.79 1.49 -2.14 -2.00 0.00 0.00 174.74 172.15 1uan s PRO 11 N -3.90 4.14 0.00 -0.38 0.02 -1.26 -2.02 135.00 131.61 1uan s PRO 11 Ca 0.11 2.53 0.00 0.00 0.02 0.00 0.00 61.00 63.66 1uan s PRO 11 Cb 0.01 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.54 1uan s PRO 11 CO -0.04 -0.52 0.00 -0.40 -0.33 0.00 0.00 177.00 175.72 1uan n ASP 12 N 1.00 0.00 0.12 2.53 3.85 -1.26 -4.93 116.55 117.86 1uan n ASP 12 Ca 0.03 0.00 -0.23 0.00 -0.71 0.00 0.00 54.79 53.88 1uan n ASP 12 Cb 0.39 0.00 -0.15 0.00 -1.35 0.00 0.00 41.12 40.01 1uan n ASP 12 CO 0.00 0.00 0.00 -0.78 -1.01 0.00 0.00 177.20 175.41 1uan h ASP 13 N 0.00 0.70 -0.73 -1.12 1.82 -1.83 0.05 116.42 115.32 1uan h ASP 13 Ca 0.00 -0.83 -0.02 0.00 -0.39 0.00 0.00 57.03 55.79 1uan h ASP 13 Cb 0.00 -0.23 -0.03 0.00 0.68 0.00 0.00 39.33 39.75 1uan h ASP 13 CO 0.00 1.67 0.37 1.23 -1.61 0.00 0.00 179.24 180.90 1uan h GLY 14 N 0.60 1.12 0.96 -0.78 0.00 -1.92 -1.61 103.07 101.45 1uan h GLY 14 Ca -0.26 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 46.52 1uan h GLY 14 CO 0.23 0.51 0.22 0.83 0.00 0.00 0.00 176.54 178.33 1uan h GLU 15 N 1.02 0.61 -0.58 4.80 3.07 -1.90 -0.45 114.58 121.15 1uan h GLU 15 Ca 0.25 -0.08 0.01 0.00 -0.50 0.00 0.00 59.36 59.04 1uan h GLU 15 Cb 0.08 -0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 27.85 1uan h GLU 15 CO -0.04 0.51 0.38 1.25 -1.40 0.00 0.00 179.01 179.71 1uan h LEU 16 N 0.55 0.65 0.09 1.33 5.85 -0.71 -1.19 115.31 121.89 1uan h LEU 16 Ca 0.15 -0.01 -0.27 0.00 0.84 0.00 0.00 57.88 58.59 1uan h LEU 16 Cb 0.09 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1uan h LEU 16 CO -0.02 0.47 -1.29 1.23 -0.34 0.00 0.00 178.44 178.49 1uan h GLY 17 N 0.77 0.23 0.00 3.75 0.00 -1.25 -3.42 103.07 103.14 1uan h GLY 17 Ca 0.22 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1uan h GLY 17 CO -0.06 0.50 0.00 0.00 0.00 0.00 0.00 176.54 176.99 1uan h GLY 19 N 0.00 1.41 0.92 0.00 0.00 -1.24 -1.17 103.07 102.99 1uan h GLY 19 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 1uan h GLY 19 CO 0.00 -0.13 0.11 -1.33 0.00 0.00 0.00 176.54 175.19 1uan h GLY 20 N 0.51 0.35 1.09 4.60 0.00 -1.84 -0.97 103.07 106.82 1uan h GLY 20 Ca 0.49 -0.17 -0.12 0.00 0.00 0.00 0.00 47.33 47.53 1uan h GLY 20 CO -0.43 0.17 -0.12 -0.84 0.00 0.00 0.00 176.54 175.31 1uan h THR 21 N 0.24 1.27 -0.44 4.70 2.02 -1.76 -0.20 112.91 118.73 1uan h THR 21 Ca 0.08 -1.28 0.01 0.00 0.77 0.00 0.00 66.41 65.98 1uan h THR 21 Cb 0.12 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 67.50 1uan h THR 21 CO -0.01 0.45 0.29 -0.07 0.37 0.00 0.00 175.52 176.56 1uan h LEU 22 N 0.90 0.50 -0.87 2.58 3.38 -1.09 -0.47 115.31 120.24 1uan h LEU 22 Ca 0.14 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 1uan h LEU 22 Cb 0.70 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 1uan h LEU 22 CO 0.05 0.37 0.04 0.00 0.09 0.00 0.00 178.44 178.99 1uan h ALA 23 N 1.16 1.06 -0.16 1.53 0.00 -0.92 -1.63 119.26 120.30 1uan h ALA 23 Ca 0.16 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1uan h ALA 23 Cb -0.07 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1uan h ALA 23 CO -0.04 0.59 0.05 -0.09 0.00 0.00 0.00 179.25 179.77 1uan h ARG 24 N 0.82 0.25 -0.44 0.00 2.43 -0.84 -1.59 114.38 115.01 1uan h ARG 24 Ca 0.16 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 59.31 1uan h ARG 24 Cb 0.44 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.91 1uan h ARG 24 CO 0.02 0.38 0.23 0.00 -1.51 0.00 0.00 179.97 179.08 1uan h ALA 25 N 0.86 0.56 -0.05 2.80 0.00 -0.85 -0.48 119.26 122.10 1uan h ALA 25 Ca 0.05 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1uan h ALA 25 Cb 0.23 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1uan h ALA 25 CO -0.00 -0.12 -0.21 -0.22 0.00 0.00 0.00 179.25 178.70 1uan h LYS 26 N 0.46 -0.30 -1.00 0.00 3.11 -1.26 -0.19 116.57 117.40 1uan h LYS 26 Ca 0.19 0.02 0.25 0.00 -2.81 0.00 0.00 60.65 58.30 1uan h LYS 26 Cb 0.08 0.07 -0.08 0.00 -1.00 0.00 0.00 32.23 31.30 1uan h LYS 26 CO -0.12 -0.20 0.66 0.00 -2.81 0.00 0.00 179.45 176.98 1uan h ALA 27 N 0.61 2.30 -0.13 5.00 0.00 -0.92 0.29 119.26 126.41 1uan h ALA 27 Ca 0.07 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1uan h ALA 27 Cb 0.42 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1uan h ALA 27 CO -0.23 -0.66 0.00 0.39 0.00 0.00 0.00 179.25 178.75 1uan n GLU 28 N -4.55 1.43 -0.51 0.00 1.02 -0.22 -4.90 120.64 112.91 1uan n GLU 28 Ca 0.23 -0.66 0.00 0.00 -0.02 0.00 0.00 57.16 56.71 1uan n GLU 28 Cb 0.85 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.98 1uan n GLU 28 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1uan n GLY 29 N 0.93 0.74 3.86 0.62 0.00 0.10 -5.05 105.19 106.39 1uan n GLY 29 Ca 0.12 -0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 1uan n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uan s LEU 30 N 0.00 3.66 -0.25 0.99 1.43 -0.16 -4.99 118.68 119.37 1uan s LEU 30 Ca 0.00 1.36 -0.16 0.00 -1.03 0.00 0.00 54.13 54.29 1uan s LEU 30 Cb 0.00 -4.29 -0.03 0.00 0.03 0.00 0.00 46.19 41.90 1uan s LEU 30 CO 0.00 -0.55 0.44 -0.55 0.23 0.00 0.00 176.35 175.92 1uan s SER 31 N -3.28 6.39 0.28 2.29 0.15 -1.26 -4.24 113.70 114.03 1uan s SER 31 Ca 0.55 0.46 0.11 0.00 0.70 0.00 0.00 55.95 57.77 1uan s SER 31 Cb -0.10 -2.25 -0.05 0.00 -1.71 0.00 0.00 66.02 61.91 1uan s SER 31 CO 0.34 -0.20 -0.18 0.42 1.20 0.00 0.00 173.24 174.83 1uan s THR 32 N 1.95 2.34 0.18 6.45 -4.23 -1.26 -1.19 115.64 119.88 1uan s THR 32 Ca 0.19 -2.35 -0.18 0.00 -1.18 0.00 0.00 61.69 58.17 1uan s THR 32 Cb -0.15 -2.33 0.03 0.00 1.34 0.00 0.00 72.50 71.39 1uan s THR 32 CO 0.09 -0.39 0.52 -0.83 -0.54 0.00 0.00 174.62 173.47 1uan s GLY 33 N -3.50 -0.19 -0.09 3.99 0.00 -0.56 -0.58 107.32 106.39 1uan s GLY 33 Ca 0.30 -0.11 0.02 0.00 0.00 0.00 0.00 44.72 44.93 1uan s GLY 33 CO 0.14 -0.21 -0.16 -0.42 0.00 0.00 0.00 173.10 172.45 1uan s ILE 34 N -3.85 1.47 -0.36 0.90 1.01 -0.82 -1.46 121.20 118.10 1uan s ILE 34 Ca 0.07 -0.65 -0.12 0.00 0.00 0.00 0.00 60.65 59.96 1uan s ILE 34 Cb -0.01 -1.33 0.01 0.00 0.01 0.00 0.00 42.46 41.14 1uan s ILE 34 CO -0.05 0.43 0.21 -0.22 0.00 0.00 0.00 174.94 175.31 1uan s LEU 35 N 0.80 4.59 -0.00 2.97 2.96 0.31 -1.87 118.68 128.44 1uan s LEU 35 Ca -0.11 -0.77 -0.21 0.00 -0.22 0.00 0.00 54.13 52.82 1uan s LEU 35 Cb -0.16 -2.06 -0.05 0.00 0.50 0.00 0.00 46.19 44.43 1uan s LEU 35 CO 0.02 -0.32 0.62 -1.81 -1.32 0.00 0.00 176.35 173.53 1uan s ASP 36 N 1.61 7.00 0.12 3.68 -0.00 -0.04 -1.18 116.67 127.86 1uan s ASP 36 Ca 0.04 1.19 0.04 0.00 -0.00 0.00 0.00 52.55 53.82 1uan s ASP 36 Cb -0.18 -2.38 -0.20 0.00 -0.00 0.00 0.00 42.92 40.16 1uan s ASP 36 CO 0.08 0.08 1.26 -0.07 -0.00 0.00 0.00 175.17 176.52 1uan h LEU 37 N 5.72 0.12 -8.94 1.23 3.38 -0.62 -1.28 115.31 114.92 1uan h LEU 37 Ca -0.45 -0.13 -0.37 0.00 0.09 0.00 0.00 57.88 57.03 1uan h LEU 37 Cb 1.20 -0.04 -0.14 0.00 0.09 0.00 0.00 40.66 41.77 1uan h LEU 37 CO 0.70 1.08 -0.62 0.42 0.09 0.00 0.00 178.44 180.11 1uan s THR 38 N -2.76 0.71 -2.20 0.22 -4.23 -0.69 -0.15 115.64 106.55 1uan s THR 38 Ca -0.01 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 58.69 1uan s THR 38 Cb 0.09 -2.62 0.44 0.00 1.34 0.00 0.00 72.50 71.75 1uan s THR 38 CO 0.83 -0.05 1.43 0.54 -0.54 0.00 0.00 174.62 176.84 1uan n ARG 39 N -0.49 2.12 -1.87 3.99 1.74 -1.26 -4.18 116.66 116.71 1uan n ARG 39 Ca -0.01 -1.72 -0.11 0.00 -0.77 0.00 0.00 57.85 55.24 1uan n ARG 39 Cb 0.66 -1.42 -0.02 0.00 -1.02 0.00 0.00 32.46 30.66 1uan n ARG 39 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uan n GLY 40 N 1.30 0.40 0.26 -0.13 0.00 -1.26 -4.76 105.19 101.01 1uan n GLY 40 Ca 0.17 -0.47 0.18 0.00 0.00 0.00 0.00 46.02 45.90 1uan n GLY 40 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1uan h GLU 41 N 0.00 0.00 -0.01 1.61 9.09 -1.93 0.10 114.58 123.44 1uan h GLU 41 Ca -0.24 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.17 1uan h GLU 41 Cb 1.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.11 1uan h GLU 41 CO 0.31 0.00 -0.28 -0.12 0.05 0.00 0.00 179.01 178.97 1uan n MET 42 N -2.91 0.79 0.00 1.06 1.56 -1.26 -4.05 117.12 112.31 1uan n MET 42 Ca -0.00 -0.47 0.00 0.00 -0.27 0.00 0.00 57.70 56.96 1uan n MET 42 Cb 0.22 -1.49 0.00 0.00 2.15 0.00 0.00 33.22 34.10 1uan n MET 42 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1uan n GLY 43 N 1.35 0.70 3.76 -5.12 0.00 -0.92 -5.07 105.19 99.89 1uan n GLY 43 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1uan n GLY 43 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uan s SER 44 N -0.60 7.54 0.03 1.61 1.04 -0.03 -5.05 113.70 118.24 1uan s SER 44 Ca 0.00 1.94 0.04 0.00 0.48 0.00 0.00 55.95 58.41 1uan s SER 44 Cb 0.00 -2.60 -0.03 0.00 0.10 0.00 0.00 66.02 63.48 1uan s SER 44 CO 0.00 0.08 -0.07 -1.59 0.98 0.00 0.00 173.24 172.63 1uan s LYS 45 N -1.44 2.47 0.00 4.02 0.00 -1.26 -4.98 119.74 118.54 1uan s LYS 45 Ca 0.44 -0.79 0.00 0.00 0.00 0.00 0.00 55.97 55.62 1uan s LYS 45 Cb -0.24 -2.46 0.00 0.00 0.00 0.00 0.00 37.83 35.13 1uan s LYS 45 CO 0.30 0.58 0.00 0.41 0.00 0.00 0.00 175.35 176.64 1uan n GLY 46 N 1.36 2.29 3.74 0.59 0.00 -1.26 -4.78 105.19 107.14 1uan n GLY 46 Ca -0.15 -2.00 -0.29 0.00 0.00 0.00 0.00 46.02 43.57 1uan n GLY 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uan s THR 47 N -2.49 2.52 0.26 2.61 -4.23 -1.26 -4.79 115.64 108.25 1uan s THR 47 Ca 0.00 0.17 -0.02 0.00 -1.18 0.00 0.00 61.69 60.66 1uan s THR 47 Cb 0.00 -2.77 0.23 0.00 1.34 0.00 0.00 72.50 71.30 1uan s THR 47 CO 0.00 -0.22 1.75 -0.65 -0.54 0.00 0.00 174.62 174.96 1uan h PRO 48 N -1.50 0.55 -0.75 3.99 0.11 -2.00 -2.17 132.00 130.23 1uan h PRO 48 Ca -0.50 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.53 1uan h PRO 48 Cb 1.30 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 1uan h PRO 48 CO 0.58 0.36 0.29 1.49 -0.21 0.00 0.00 178.00 180.51 1uan h GLU 49 N 0.56 1.13 -0.29 1.05 4.81 -1.98 -1.35 114.58 118.50 1uan h GLU 49 Ca 0.44 -0.20 -0.09 0.00 -0.13 0.00 0.00 59.36 59.38 1uan h GLU 49 Cb 0.63 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1uan h GLU 49 CO -0.37 0.92 -0.18 0.93 -0.73 0.00 0.00 179.01 179.58 1uan h GLU 50 N 1.10 0.64 -0.38 1.92 5.08 -1.78 0.20 114.58 121.35 1uan h GLU 50 Ca 0.25 -0.29 -0.10 0.00 -1.00 0.00 0.00 59.36 58.22 1uan h GLU 50 Cb 0.22 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1uan h GLU 50 CO -0.02 0.88 -0.16 -0.09 -1.00 0.00 0.00 179.01 178.63 1uan h ARG 51 N 0.38 0.78 -0.90 2.33 1.12 -1.39 -2.18 114.38 114.51 1uan h ARG 51 Ca 0.06 -0.33 0.05 0.00 -1.11 0.00 0.00 59.98 58.65 1uan h ARG 51 Cb 0.71 -0.03 -0.06 0.00 -0.01 0.00 0.00 29.97 30.59 1uan h ARG 51 CO 0.05 0.95 0.58 1.49 -3.11 0.00 0.00 179.97 179.93 1uan h GLU 52 N 0.58 1.06 -0.54 0.20 4.81 -1.16 -2.09 114.58 117.44 1uan h GLU 52 Ca 0.09 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.16 1uan h GLU 52 Cb 0.70 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 1uan h GLU 52 CO 0.05 0.70 -0.04 0.87 -0.73 0.00 0.00 179.01 179.86 1uan h LYS 53 N 1.09 0.96 -0.27 1.92 1.57 -0.63 -1.51 116.57 119.70 1uan h LYS 53 Ca 0.37 -0.31 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1uan h LYS 53 Cb 0.07 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1uan h LYS 53 CO -0.14 0.97 0.16 0.93 -0.57 0.00 0.00 179.45 180.80 1uan h GLU 54 N 0.87 0.37 -0.77 3.15 5.08 -1.12 -0.14 114.58 122.02 1uan h GLU 54 Ca 0.15 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.52 1uan h GLU 54 Cb 0.57 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.69 1uan h GLU 54 CO 0.03 0.29 0.48 0.28 -1.00 0.00 0.00 179.01 179.09 1uan h VAL 55 N 0.34 1.06 -0.47 3.13 2.07 -1.20 0.10 116.25 121.28 1uan h VAL 55 Ca 0.10 -0.31 -0.11 0.00 0.82 0.00 0.00 66.70 67.20 1uan h VAL 55 Cb 0.02 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.86 1uan h VAL 55 CO -0.02 0.16 -0.13 0.00 0.02 0.00 0.00 177.57 177.61 1uan h ALA 56 N 1.35 0.89 -0.31 1.67 0.00 -0.91 -1.06 119.26 120.89 1uan h ALA 56 Ca 0.33 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 1uan h ALA 56 Cb 0.10 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1uan h ALA 56 CO -0.14 0.64 -0.31 1.49 0.00 0.00 0.00 179.25 180.93 1uan h GLU 57 N 0.79 0.75 -0.66 0.00 4.57 -0.58 -0.48 114.58 118.96 1uan h GLU 57 Ca 0.12 -0.40 -0.00 0.00 -1.18 0.00 0.00 59.36 57.91 1uan h GLU 57 Cb 0.65 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.22 1uan h GLU 57 CO 0.05 1.02 0.41 0.00 -1.18 0.00 0.00 179.01 179.30 1uan h ALA 58 N 0.72 0.84 -0.68 2.92 0.00 -0.71 -0.06 119.26 122.29 1uan h ALA 58 Ca 0.05 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1uan h ALA 58 Cb 0.88 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1uan h ALA 58 CO 0.08 0.31 0.40 0.77 0.00 0.00 0.00 179.25 180.80 1uan h SER 59 N 0.90 0.83 -0.04 0.00 0.02 -1.07 -1.31 113.55 112.88 1uan h SER 59 Ca 0.24 -0.07 0.01 0.00 -0.84 0.00 0.00 61.79 61.13 1uan h SER 59 Cb -0.05 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 1uan h SER 59 CO -0.05 0.66 -0.02 -0.09 -1.14 0.00 0.00 176.83 176.19 1uan h ARG 60 N 0.93 -0.02 -0.87 3.45 2.43 -0.71 -0.68 114.38 118.90 1uan h ARG 60 Ca 0.24 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.43 1uan h ARG 60 Cb -0.01 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.50 1uan h ARG 60 CO -0.04 -0.01 0.57 0.82 -1.51 0.00 0.00 179.97 179.80 1uan h ILE 61 N -0.02 1.19 -0.00 1.20 2.04 -0.55 -1.55 117.51 119.82 1uan h ILE 61 Ca 0.03 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.49 1uan h ILE 61 Cb 0.06 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1uan h ILE 61 CO -0.06 0.21 -0.05 0.18 0.00 0.00 0.00 178.15 178.43 1uan n LEU 62 N -4.50 0.06 -1.10 1.44 4.77 -0.53 -4.94 117.00 112.20 1uan n LEU 62 Ca 0.10 0.40 -0.08 0.00 -0.03 0.00 0.00 56.01 56.40 1uan n LEU 62 Cb 0.05 -0.43 0.01 0.00 -2.33 0.00 0.00 43.42 40.72 1uan n LEU 62 CO 0.35 0.01 -0.05 0.61 -1.33 0.00 0.00 177.39 176.99 1uan n GLY 63 N 1.45 0.14 3.76 -0.72 0.00 -0.33 -4.38 105.19 105.11 1uan n GLY 63 Ca 0.08 -0.50 -0.41 0.00 0.00 0.00 0.00 46.02 45.20 1uan n GLY 63 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uan s LEU 64 N -2.55 4.41 0.05 0.99 1.43 -0.78 -4.74 118.68 117.50 1uan s LEU 64 Ca 0.06 2.66 -0.06 0.00 -1.03 0.00 0.00 54.13 55.76 1uan s LEU 64 Cb -0.03 -3.64 -0.30 0.00 0.03 0.00 0.00 46.19 42.26 1uan s LEU 64 CO 0.07 -0.59 1.06 0.44 0.23 0.00 0.00 176.35 177.57 1uan h ASP 65 N 4.01 0.51 -4.10 2.29 3.45 -1.20 -3.47 116.42 117.91 1uan h ASP 65 Ca -0.48 -0.56 -0.68 0.00 0.43 0.00 0.00 57.03 55.74 1uan h ASP 65 Cb 1.22 -0.16 -0.31 0.00 -0.56 0.00 0.00 39.33 39.52 1uan h ASP 65 CO 0.70 1.45 -0.88 0.12 -1.57 0.00 0.00 179.24 179.05 1uan s PHE 66 N -2.64 2.33 -0.03 4.55 5.36 -0.69 -5.03 117.98 121.83 1uan s PHE 66 Ca -0.06 -0.65 -0.01 0.00 -0.96 0.00 0.00 56.93 55.25 1uan s PHE 66 Cb 0.06 -1.53 0.03 0.00 -0.34 0.00 0.00 43.02 41.24 1uan s PHE 66 CO 0.89 -0.18 0.04 0.50 -1.46 0.00 0.00 175.22 175.01 1uan s ARG 67 N -0.22 0.04 0.19 10.12 6.06 -1.26 -1.94 118.95 131.95 1uan s ARG 67 Ca -0.01 0.25 -0.05 0.00 -2.50 0.00 0.00 55.73 53.42 1uan s ARG 67 Cb -0.13 -0.46 -0.03 0.00 0.06 0.00 0.00 34.95 34.40 1uan s ARG 67 CO 0.03 -0.25 0.22 0.20 -2.50 0.00 0.00 175.30 173.00 1uan s GLY 68 N 1.62 0.97 -0.01 8.12 0.00 -0.78 -5.02 107.32 112.22 1uan s GLY 68 Ca -0.02 -1.32 0.01 0.00 0.00 0.00 0.00 44.72 43.39 1uan s GLY 68 CO -0.03 -1.12 -0.02 0.21 0.00 0.00 0.00 173.10 172.14 1uan s ASN 69 N -3.07 0.40 0.01 1.64 3.84 -1.26 -0.86 114.94 115.64 1uan s ASN 69 Ca 0.28 -0.05 0.25 0.00 0.21 0.00 0.00 52.86 53.56 1uan s ASN 69 Cb 0.05 -0.13 0.53 0.00 -0.55 0.00 0.00 41.25 41.15 1uan s ASN 69 CO 0.07 -0.02 1.43 0.18 -2.79 0.00 0.00 177.10 175.97 1uan n LEU 70 N 3.48 0.49 -1.43 3.21 4.77 -0.48 -4.98 117.00 122.07 1uan n LEU 70 Ca -0.19 0.03 -0.16 0.00 -0.03 0.00 0.00 56.01 55.67 1uan n LEU 70 Cb 0.55 -0.26 -0.05 0.00 -2.33 0.00 0.00 43.42 41.34 1uan n LEU 70 CO 0.24 0.11 -0.17 0.61 -1.33 0.00 0.00 177.39 176.85 1uan n GLY 71 N 1.49 0.96 3.75 -0.72 0.00 -1.05 -4.96 105.19 104.67 1uan n GLY 71 Ca 0.05 -0.25 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 1uan n GLY 71 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1uan s PHE 72 N -2.66 2.42 0.11 1.61 2.99 0.78 -4.90 117.98 118.33 1uan s PHE 72 Ca 0.00 1.58 -0.31 0.00 0.00 0.00 0.00 56.93 58.20 1uan s PHE 72 Cb 0.00 -3.22 -0.09 0.00 0.00 0.00 0.00 43.02 39.71 1uan s PHE 72 CO 0.00 -1.98 1.61 -1.25 -0.00 0.00 0.00 175.22 173.59 1uan s PRO 73 N -4.25 4.21 0.16 0.24 0.04 -1.26 -4.20 135.00 129.94 1uan s PRO 73 Ca 0.67 2.34 -0.31 0.00 0.04 0.00 0.00 61.00 63.74 1uan s PRO 73 Cb -0.22 -3.39 -0.10 0.00 0.04 0.00 0.00 34.50 30.84 1uan s PRO 73 CO 0.46 -0.67 1.52 0.34 0.04 0.00 0.00 177.00 178.70 1uan s ASP 74 N 1.80 6.64 0.00 6.66 3.68 -1.26 -0.77 116.67 133.42 1uan s ASP 74 Ca 0.72 2.57 0.00 0.00 2.13 0.00 0.00 52.55 57.97 1uan s ASP 74 Cb -0.41 -2.60 0.00 0.00 -1.45 0.00 0.00 42.92 38.46 1uan s ASP 74 CO 0.32 -0.78 0.00 0.61 0.13 0.00 0.00 175.17 175.45 1uan n GLY 75 N 3.54 0.90 0.06 2.66 0.00 -1.26 -4.76 105.19 106.33 1uan n GLY 75 Ca 0.13 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.20 1uan n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uan n GLY 76 N -2.01 3.77 3.75 -0.02 0.00 0.05 -4.97 105.19 105.75 1uan n GLY 76 Ca 0.00 -0.61 -0.41 0.00 0.00 0.00 0.00 46.02 44.99 1uan n GLY 76 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uan s LEU 77 N -1.95 4.35 -0.16 0.99 1.43 -1.19 -4.77 118.68 117.38 1uan s LEU 77 Ca 0.17 2.92 -0.24 0.00 -1.03 0.00 0.00 54.13 55.95 1uan s LEU 77 Cb 0.15 -3.63 0.06 0.00 0.03 0.00 0.00 46.19 42.80 1uan s LEU 77 CO 0.02 -0.89 0.62 0.00 0.23 0.00 0.00 176.35 176.32 1uan s ALA 78 N 0.03 -1.56 -0.93 4.21 0.00 -1.26 -4.81 121.76 117.43 1uan s ALA 78 Ca 0.63 1.50 -0.13 0.00 0.00 0.00 0.00 51.96 53.96 1uan s ALA 78 Cb -0.47 -0.60 -0.09 0.00 0.00 0.00 0.00 23.12 21.96 1uan s ALA 78 CO 0.47 -0.32 2.09 -3.47 0.00 0.00 0.00 175.76 174.53 1uan n ASP 79 N 2.01 4.10 -4.68 0.00 4.64 -1.26 -4.68 116.55 116.67 1uan n ASP 79 Ca -0.16 -2.51 -0.24 0.00 -1.38 0.00 0.00 54.79 50.50 1uan n ASP 79 Cb 0.56 -1.16 -0.07 0.00 -1.04 0.00 0.00 41.12 39.41 1uan n ASP 79 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 1uan s VAL 80 N 3.95 3.71 0.24 5.18 -7.23 -1.26 -4.97 120.40 120.03 1uan s VAL 80 Ca 0.48 -1.70 -0.05 0.00 -1.81 0.00 0.00 61.98 58.91 1uan s VAL 80 Cb 0.12 -2.96 0.23 0.00 0.56 0.00 0.00 36.38 34.33 1uan s VAL 80 CO 0.02 -0.31 1.69 -0.65 -0.31 0.00 0.00 175.10 175.55 1uan h PRO 81 N 2.00 0.30 -0.37 4.82 0.11 -1.99 -0.07 132.00 136.80 1uan h PRO 81 Ca -0.46 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.59 1uan h PRO 81 Cb 1.24 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1uan h PRO 81 CO 0.60 0.20 0.07 1.49 -0.21 0.00 0.00 178.00 180.15 1uan h GLU 82 N 0.31 0.61 -0.34 1.05 4.81 -1.97 0.41 114.58 119.45 1uan h GLU 82 Ca 0.42 -0.16 -0.17 0.00 -0.13 0.00 0.00 59.36 59.32 1uan h GLU 82 Cb 0.70 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.00 1uan h GLU 82 CO -0.48 0.66 -0.43 1.96 -0.73 0.00 0.00 179.01 179.98 1uan h GLN 83 N 0.46 0.89 -0.15 1.92 4.20 -1.70 -2.12 115.11 118.62 1uan h GLN 83 Ca 0.11 -0.51 0.02 0.00 0.06 0.00 0.00 58.65 58.34 1uan h GLN 83 Cb 0.34 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 1uan h GLN 83 CO 0.00 1.15 0.00 -0.09 -0.67 0.00 0.00 178.83 179.23 1uan h ARG 84 N 0.69 0.05 -0.42 1.46 2.43 -0.74 -1.40 114.38 116.45 1uan h ARG 84 Ca 0.04 -0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 1uan h ARG 84 Cb 1.03 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.56 1uan h ARG 84 CO 0.10 0.03 -0.15 -0.07 -1.51 0.00 0.00 179.97 178.38 1uan h LEU 85 N 0.05 0.86 -0.59 3.80 3.38 -0.89 0.94 115.31 122.86 1uan h LEU 85 Ca 0.07 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 57.58 1uan h LEU 85 Cb 0.08 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1uan h LEU 85 CO -0.12 1.05 0.08 0.11 0.09 0.00 0.00 178.44 179.65 1uan h LYS 86 N 0.67 0.99 -0.63 1.13 1.57 -1.24 0.42 116.57 119.49 1uan h LYS 86 Ca 0.10 -0.28 -0.05 0.00 -1.87 0.00 0.00 60.65 58.56 1uan h LYS 86 Cb 0.69 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.87 1uan h LYS 86 CO 0.05 0.95 0.20 1.25 -0.57 0.00 0.00 179.45 181.33 1uan h LEU 87 N 0.89 0.91 -0.98 2.94 5.85 -1.14 -2.26 115.31 121.53 1uan h LEU 87 Ca 0.18 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1uan h LEU 87 Cb 0.45 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 1uan h LEU 87 CO 0.02 0.87 0.40 0.00 -0.34 0.00 0.00 178.44 179.39 1uan h ALA 88 N 1.07 1.21 -0.73 1.25 0.00 -0.49 -0.86 119.26 120.71 1uan h ALA 88 Ca 0.20 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1uan h ALA 88 Cb 0.28 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1uan h ALA 88 CO -0.01 0.61 0.28 0.37 0.00 0.00 0.00 179.25 180.51 1uan h GLN 89 N 1.12 1.11 -0.92 0.00 5.75 -0.74 -2.05 115.11 119.38 1uan h GLN 89 Ca 0.28 -0.21 0.00 0.00 -0.15 0.00 0.00 58.65 58.57 1uan h GLN 89 Cb 0.08 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 28.41 1uan h GLN 89 CO -0.04 0.91 0.57 0.00 -2.65 0.00 0.00 178.83 177.63 1uan h ALA 90 N 1.14 1.16 -0.78 3.38 0.00 -0.91 -2.41 119.26 120.84 1uan h ALA 90 Ca 0.24 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1uan h ALA 90 Cb 0.23 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1uan h ALA 90 CO -0.02 0.60 0.32 -0.07 0.00 0.00 0.00 179.25 180.08 1uan h LEU 91 N 1.25 1.06 -1.20 0.00 3.38 -0.81 0.78 115.31 119.77 1uan h LEU 91 Ca 0.33 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 1uan h LEU 91 Cb -0.09 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.37 1uan h LEU 91 CO -0.07 0.93 0.05 0.03 0.09 0.00 0.00 178.44 179.48 1uan h ARG 92 N 1.13 0.61 0.26 1.13 3.08 -1.20 0.45 114.38 119.83 1uan h ARG 92 Ca 0.26 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 1uan h ARG 92 Cb 0.20 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.16 1uan h ARG 92 CO -0.02 0.59 -0.13 0.00 -1.07 0.00 0.00 179.97 179.34 1uan h ARG 93 N 0.58 -0.34 0.00 0.04 3.08 -1.04 -3.32 114.38 113.39 1uan h ARG 93 Ca 0.13 0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.16 1uan h ARG 93 Cb 0.29 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 1uan h ARG 93 CO 0.00 0.02 -0.21 -0.07 -1.07 0.00 0.00 179.97 178.64 1uan h LEU 94 N -0.82 0.00 -2.59 3.04 3.38 -0.78 -3.42 115.31 114.12 1uan h LEU 94 Ca -0.04 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.37 1uan h LEU 94 Cb 0.51 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.17 1uan h LEU 94 CO 0.06 0.21 -0.96 0.54 0.09 0.00 0.00 178.44 178.38 1uan n ARG 95 N -3.67 -1.43 -2.31 1.13 1.74 0.14 -2.77 116.66 109.49 1uan n ARG 95 Ca -0.01 0.21 -0.42 0.00 -0.77 0.00 0.00 57.85 56.85 1uan n ARG 95 Cb 0.33 -3.64 -0.03 0.00 -1.02 0.00 0.00 32.46 28.10 1uan n ARG 95 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1uan s PRO 96 N -7.04 4.37 0.10 5.56 0.04 -1.26 -3.32 135.00 133.46 1uan s PRO 96 Ca 0.17 1.90 -0.15 0.00 0.04 0.00 0.00 61.00 62.96 1uan s PRO 96 Cb -0.08 -3.35 -0.08 0.00 0.04 0.00 0.00 34.50 31.03 1uan s PRO 96 CO 0.95 -0.37 1.44 0.00 0.04 0.00 0.00 177.00 179.05 1uan h ARG 97 N 6.97 0.71 -5.33 4.56 3.08 -1.47 -3.39 114.38 119.52 1uan h ARG 97 Ca -0.41 -0.36 -0.60 0.00 0.07 0.00 0.00 59.98 58.68 1uan h ARG 97 Cb 1.20 0.01 -0.32 0.00 0.08 0.00 0.00 29.97 30.94 1uan h ARG 97 CO 0.85 0.97 -0.85 0.08 -1.07 0.00 0.00 179.97 179.95 1uan s VAL 98 N -4.42 1.62 -0.02 2.04 1.01 -0.97 -2.42 120.40 117.24 1uan s VAL 98 Ca -0.12 -0.80 0.07 0.00 0.00 0.00 0.00 61.98 61.12 1uan s VAL 98 Cb 0.09 -1.40 -0.02 0.00 0.00 0.00 0.00 36.38 35.06 1uan s VAL 98 CO 0.83 0.46 -0.22 -0.69 0.00 0.00 0.00 175.10 175.48 1uan s VAL 99 N 0.15 1.76 -0.10 2.92 1.01 0.31 -1.04 120.40 125.41 1uan s VAL 99 Ca -0.08 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 60.95 1uan s VAL 99 Cb -0.14 -1.46 -0.02 0.00 0.00 0.00 0.00 36.38 34.76 1uan s VAL 99 CO 0.04 0.50 -0.09 -0.36 0.00 0.00 0.00 175.10 175.18 1uan s PHE 100 N -0.50 2.88 0.10 5.22 0.08 -0.08 -0.92 117.98 124.76 1uan s PHE 100 Ca 0.08 -0.27 0.01 0.00 0.12 0.00 0.00 56.93 56.86 1uan s PHE 100 Cb -0.09 -1.79 -0.04 0.00 -0.57 0.00 0.00 43.02 40.53 1uan s PHE 100 CO -0.01 0.07 -0.04 0.00 -0.10 0.00 0.00 175.22 175.14 1uan s ALA 101 N -0.20 0.93 0.56 5.36 0.00 -0.28 -0.83 121.76 127.30 1uan s ALA 101 Ca 0.02 -1.36 -0.21 0.00 0.00 0.00 0.00 51.96 50.41 1uan s ALA 101 Cb -0.13 0.27 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 1uan s ALA 101 CO 0.03 -0.28 1.34 -2.14 0.00 0.00 0.00 175.76 174.70 1uan s PRO 102 N -3.87 3.08 0.40 0.00 0.02 -1.26 -1.02 135.00 132.35 1uan s PRO 102 Ca 0.13 2.19 -0.25 0.00 0.02 0.00 0.00 61.00 63.08 1uan s PRO 102 Cb 0.06 -2.20 -0.09 0.00 0.02 0.00 0.00 34.50 32.30 1uan s PRO 102 CO -0.04 -1.22 1.18 -1.17 -0.33 0.00 0.00 177.00 175.41 1uan s LEU 103 N -3.63 4.21 0.27 -5.54 2.96 0.04 -4.32 118.68 112.66 1uan s LEU 103 Ca 0.73 2.36 -0.04 0.00 -0.22 0.00 0.00 54.13 56.96 1uan s LEU 103 Cb -0.39 -4.00 0.33 0.00 0.50 0.00 0.00 46.19 42.63 1uan s LEU 103 CO 0.46 -0.67 1.94 -0.08 -1.32 0.00 0.00 176.35 176.68 1uan h GLU 104 N 2.68 1.24 -6.34 1.98 4.81 -1.87 -3.41 114.58 113.66 1uan h GLU 104 Ca -0.49 -0.07 -0.57 0.00 -0.13 0.00 0.00 59.36 58.10 1uan h GLU 104 Cb 1.23 -0.28 -0.03 0.00 0.63 0.00 0.00 28.75 30.30 1uan h GLU 104 CO 0.63 0.82 1.15 0.00 -0.73 0.00 0.00 179.01 180.87 1uan s ALA 105 N -6.05 3.12 -0.09 2.92 0.00 -1.26 -4.15 121.76 116.24 1uan s ALA 105 Ca -0.12 0.24 -0.30 0.00 0.00 0.00 0.00 51.96 51.78 1uan s ALA 105 Cb 0.18 -3.91 0.11 0.00 0.00 0.00 0.00 23.12 19.50 1uan s ALA 105 CO 0.81 -2.23 0.88 0.34 0.00 0.00 0.00 175.76 175.57 1uan s ASP 106 N 4.58 -0.45 0.43 0.00 2.15 -1.26 -4.28 116.67 117.84 1uan s ASP 106 Ca 0.70 0.40 0.28 0.00 0.43 0.00 0.00 52.55 54.36 1uan s ASP 106 Cb -0.21 0.39 0.92 0.00 -0.30 0.00 0.00 42.92 43.72 1uan s ASP 106 CO 0.31 -0.48 1.80 0.08 -0.17 0.00 0.00 175.17 176.71 1uan h ARG 107 N 2.55 0.00 -4.64 4.34 0.11 -1.91 -3.43 114.38 111.40 1uan h ARG 107 Ca -0.22 0.00 -0.69 0.00 0.10 0.00 0.00 59.98 59.17 1uan h ARG 107 Cb 1.18 0.00 -0.20 0.00 1.11 0.00 0.00 29.97 32.06 1uan h ARG 107 CO 0.33 0.00 -0.47 -1.58 0.10 0.00 0.00 179.97 178.36 1uan s HIS 108 N -3.40 3.23 0.58 4.08 2.46 -1.26 -4.96 115.29 116.02 1uan s HIS 108 Ca 0.05 -0.37 0.29 0.00 0.47 0.00 0.00 55.06 55.50 1uan s HIS 108 Cb 0.08 -2.51 1.79 0.00 -0.13 0.00 0.00 32.58 31.81 1uan s HIS 108 CO 0.57 -0.45 2.24 -1.00 -2.47 0.00 0.00 174.74 173.63 1uan h PRO 109 N 8.53 0.00 -0.09 2.88 0.13 -1.98 -1.51 132.00 139.96 1uan h PRO 109 Ca -0.30 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.75 1uan h PRO 109 Cb 1.14 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 1uan h PRO 109 CO 0.67 0.01 -0.32 -0.44 -0.23 0.00 0.00 178.00 177.69 1uan h ASP 110 N 0.00 0.18 -0.29 1.44 3.45 -1.93 -1.08 116.42 118.19 1uan h ASP 110 Ca -0.00 -0.06 -0.09 0.00 0.43 0.00 0.00 57.03 57.31 1uan h ASP 110 Cb 0.03 -0.05 -0.01 0.00 -0.56 0.00 0.00 39.33 38.75 1uan h ASP 110 CO 0.00 0.50 -0.17 0.45 -1.57 0.00 0.00 179.24 178.45 1uan h HIS 111 N 0.16 0.72 -0.60 4.55 3.86 -1.64 0.01 115.15 122.20 1uan h HIS 111 Ca 0.02 -0.19 -0.03 0.00 -1.16 0.00 0.00 60.37 59.02 1uan h HIS 111 Cb 0.65 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 28.93 1uan h HIS 111 CO 0.01 0.87 0.27 1.15 0.86 0.00 0.00 177.93 181.09 1uan h THR 112 N 0.36 1.22 -0.43 2.45 2.02 -1.46 -0.84 112.91 116.22 1uan h THR 112 Ca 0.06 -0.64 -0.15 0.00 0.77 0.00 0.00 66.41 66.45 1uan h THR 112 Cb 0.70 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.62 1uan h THR 112 CO 0.05 0.26 -0.31 0.00 0.37 0.00 0.00 175.52 175.88 1uan h ALA 113 N 1.11 0.62 -0.92 6.16 0.00 -1.08 -1.96 119.26 123.19 1uan h ALA 113 Ca 0.21 -0.43 0.02 0.00 0.00 0.00 0.00 54.91 54.71 1uan h ALA 113 Cb 0.15 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1uan h ALA 113 CO -0.02 0.68 0.61 0.00 0.00 0.00 0.00 179.25 180.52 1uan h ALA 114 N 0.82 1.37 0.37 0.00 0.00 -0.66 0.23 119.26 121.39 1uan h ALA 114 Ca 0.08 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1uan h ALA 114 Cb 0.91 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1uan h ALA 114 CO 0.08 0.56 -0.19 1.03 0.00 0.00 0.00 179.25 180.74 1uan h SER 115 N 1.21 -0.45 -0.76 0.00 0.87 -0.86 -0.76 113.55 112.81 1uan h SER 115 Ca 0.35 0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.89 1uan h SER 115 Cb -0.08 0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 61.97 1uan h SER 115 CO -0.09 -0.31 0.34 0.03 -0.53 0.00 0.00 176.83 176.26 1uan h ARG 116 N -0.51 1.12 -0.92 2.24 3.08 -0.95 -2.41 114.38 116.03 1uan h ARG 116 Ca -0.05 -0.18 0.05 0.00 0.07 0.00 0.00 59.98 59.87 1uan h ARG 116 Cb 0.40 -0.20 -0.06 0.00 0.08 0.00 0.00 29.97 30.19 1uan h ARG 116 CO 0.08 0.89 0.59 -0.07 -1.07 0.00 0.00 179.97 180.38 1uan h LEU 117 N 1.11 0.95 -0.43 3.04 3.38 -0.28 -1.84 115.31 121.24 1uan h LEU 117 Ca 0.26 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.13 1uan h LEU 117 Cb 0.16 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1uan h LEU 117 CO -0.03 0.62 -0.14 0.00 0.09 0.00 0.00 178.44 178.99 1uan h ALA 118 N 1.41 0.59 0.16 1.53 0.00 -0.83 0.15 119.26 122.28 1uan h ALA 118 Ca 0.39 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1uan h ALA 118 Cb 0.11 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1uan h ALA 118 CO -0.15 0.51 -0.08 0.28 0.00 0.00 0.00 179.25 179.80 1uan h VAL 119 N 0.68 0.83 -0.60 0.00 2.07 -1.20 -0.62 116.25 117.41 1uan h VAL 119 Ca 0.10 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.56 1uan h VAL 119 Cb 0.69 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 1uan h VAL 119 CO 0.05 0.00 0.10 0.00 0.02 0.00 0.00 177.57 177.74 1uan h ALA 120 N 0.62 1.05 -0.32 1.67 0.00 -1.17 -2.20 119.26 118.91 1uan h ALA 120 Ca -0.02 -0.25 -0.16 0.00 0.00 0.00 0.00 54.91 54.48 1uan h ALA 120 Cb 0.17 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1uan h ALA 120 CO 0.03 0.61 -0.43 0.00 0.00 0.00 0.00 179.25 179.47 1uan h ALA 121 N 1.20 0.64 -0.60 0.00 0.00 -0.55 -1.13 119.26 118.81 1uan h ALA 121 Ca 0.19 -0.47 0.04 0.00 0.00 0.00 0.00 54.91 54.67 1uan h ALA 121 Cb 0.39 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1uan h ALA 121 CO 0.01 0.67 0.34 0.28 0.00 0.00 0.00 179.25 180.55 1uan h VAL 122 N 0.65 1.01 -0.10 0.00 2.07 -0.99 0.96 116.25 119.86 1uan h VAL 122 Ca 0.05 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 1uan h VAL 122 Cb 1.00 0.30 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1uan h VAL 122 CO 0.10 0.12 0.04 -0.74 0.02 0.00 0.00 177.57 177.11 1uan h HIS 123 N 0.66 0.14 -0.87 1.57 -0.00 -1.13 -3.04 115.15 112.49 1uan h HIS 123 Ca 0.25 -0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.59 1uan h HIS 123 Cb 0.10 -0.04 -0.04 0.00 -0.00 0.00 0.00 27.41 27.42 1uan h HIS 123 CO -0.07 0.24 0.46 1.25 -0.00 0.00 0.00 177.93 179.81 1uan h LEU 124 N 0.00 1.09 -1.69 0.26 5.85 -1.00 -2.49 115.31 117.33 1uan h LEU 124 Ca 0.03 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.62 1uan h LEU 124 Cb 0.16 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1uan h LEU 124 CO -0.00 0.88 -0.09 0.00 -0.34 0.00 0.00 178.44 178.88 1uan h ALA 125 N 1.29 1.75 -0.00 1.25 0.00 -0.81 -2.16 119.26 120.58 1uan h ALA 125 Ca 0.30 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1uan h ALA 125 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1uan h ALA 125 CO -0.05 0.19 -0.02 0.41 0.00 0.00 0.00 179.25 179.79 1uan n GLY 126 N -1.16 -1.42 3.63 0.00 0.00 -0.94 -1.38 105.19 103.92 1uan n GLY 126 Ca -0.02 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 1uan n GLY 126 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uan s LEU 127 N -2.86 4.07 0.27 0.99 1.43 -0.81 -4.65 118.68 117.12 1uan s LEU 127 Ca 0.18 0.83 -0.06 0.00 -1.03 0.00 0.00 54.13 54.05 1uan s LEU 127 Cb 0.19 -2.97 0.49 0.00 0.03 0.00 0.00 46.19 43.93 1uan s LEU 127 CO 0.51 -0.42 1.58 -0.09 0.23 0.00 0.00 176.35 178.17 1uan h ARG 128 N 7.81 0.02 -0.42 1.70 2.43 -1.89 -2.13 114.38 121.89 1uan h ARG 128 Ca -0.26 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.91 1uan h ARG 128 Cb 1.11 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 1uan h ARG 128 CO 0.81 0.01 0.00 1.63 -1.51 0.00 0.00 179.97 180.91 1uan n LYS 129 N -5.52 2.27 -1.74 0.20 5.02 -1.26 -4.94 118.16 112.19 1uan n LYS 129 Ca 0.16 -1.94 -0.41 0.00 -2.02 0.00 0.00 58.31 54.09 1uan n LYS 129 Cb 0.53 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 34.08 1uan n LYS 129 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1uan n ALA 130 N 1.12 1.81 -1.33 7.82 0.00 -0.80 -4.82 120.51 124.30 1uan n ALA 130 Ca 0.19 0.33 -0.39 0.00 0.00 0.00 0.00 53.44 53.56 1uan n ALA 130 Cb 0.50 -2.34 -0.02 0.00 0.00 0.00 0.00 19.45 17.58 1uan n ALA 130 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1uan n PRO 131 N 0.34 2.47 -4.19 0.00 -0.04 -1.26 -4.82 135.00 127.50 1uan n PRO 131 Ca 0.04 -2.13 -0.13 0.00 -0.04 0.00 0.00 63.50 61.24 1uan n PRO 131 Cb 0.38 -2.97 -0.10 0.00 -0.04 0.00 0.00 33.50 30.77 1uan n PRO 131 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1uan s LEU 132 N 1.23 2.47 0.08 1.53 1.43 -1.26 -5.10 118.68 119.06 1uan s LEU 132 Ca 0.53 -0.93 -0.18 0.00 -1.03 0.00 0.00 54.13 52.53 1uan s LEU 132 Cb 0.14 -0.23 -0.07 0.00 0.03 0.00 0.00 46.19 46.07 1uan s LEU 132 CO -0.01 -0.35 0.54 -1.61 0.23 0.00 0.00 176.35 175.15 1uan s GLU 133 N -3.37 4.12 0.00 1.70 2.02 -1.26 -4.99 118.70 116.91 1uan s GLU 133 Ca 0.10 0.64 0.00 0.00 0.02 0.00 0.00 54.97 55.74 1uan s GLU 133 Cb 0.01 -3.17 0.00 0.00 0.10 0.00 0.00 34.13 31.07 1uan s GLU 133 CO -0.01 0.61 0.00 0.41 0.02 0.00 0.00 175.26 176.29 1uan n GLY 134 N 1.54 0.41 3.74 -1.39 0.00 -1.26 -4.91 105.19 103.32 1uan n GLY 134 Ca -0.10 -2.05 -0.41 0.00 0.00 0.00 0.00 46.02 43.47 1uan n GLY 134 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uan s GLU 135 N -1.19 4.48 0.31 1.61 0.41 -1.26 -4.98 118.70 118.08 1uan s GLU 135 Ca 0.00 1.93 -0.28 0.00 -0.41 0.00 0.00 54.97 56.21 1uan s GLU 135 Cb 0.00 -3.21 -0.13 0.00 -1.78 0.00 0.00 34.13 29.00 1uan s GLU 135 CO 0.00 -0.09 1.10 -2.30 -0.49 0.00 0.00 175.26 173.48 1uan n PRO 136 N 2.26 1.60 -3.95 0.39 -0.02 -1.26 -4.92 135.00 129.10 1uan n PRO 136 Ca 0.04 0.56 -0.17 0.00 -2.02 0.00 0.00 63.50 61.91 1uan n PRO 136 Cb 0.44 -2.01 -0.16 0.00 -0.02 0.00 0.00 33.50 31.75 1uan n PRO 136 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1uan s PHE 137 N -1.08 0.34 -0.38 6.00 5.36 -0.48 -4.97 117.98 122.77 1uan s PHE 137 Ca 0.58 -0.02 -0.07 0.00 -0.96 0.00 0.00 56.93 56.46 1uan s PHE 137 Cb -0.65 -0.41 0.06 0.00 -0.34 0.00 0.00 43.02 41.68 1uan s PHE 137 CO 0.61 -0.12 0.18 1.03 -1.46 0.00 0.00 175.22 175.45 1uan s ARG 138 N 0.93 2.57 0.15 10.12 0.52 -1.26 -2.55 118.95 129.43 1uan s ARG 138 Ca -0.10 -1.34 -0.33 0.00 -0.52 0.00 0.00 55.73 53.45 1uan s ARG 138 Cb -0.13 -3.61 -0.12 0.00 0.52 0.00 0.00 34.95 31.61 1uan s ARG 138 CO -0.01 -0.81 1.72 0.28 0.02 0.00 0.00 175.30 176.49 1uan n VAL 139 N 4.84 0.13 -0.01 3.52 0.31 -1.26 -4.90 118.33 120.97 1uan n VAL 139 Ca -0.11 -0.02 -0.17 0.00 -0.01 0.00 0.00 64.34 64.03 1uan n VAL 139 Cb 0.44 -1.88 -0.07 0.00 -0.91 0.00 0.00 33.84 31.42 1uan n VAL 139 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1uan h GLU 140 N 7.14 0.75 -3.36 5.55 4.81 -1.66 -3.45 114.58 124.35 1uan h GLU 140 Ca -0.45 -0.65 -0.27 0.00 -0.13 0.00 0.00 59.36 57.86 1uan h GLU 140 Cb 1.23 0.14 -0.33 0.00 0.63 0.00 0.00 28.75 30.42 1uan h GLU 140 CO 0.93 1.25 -0.66 1.03 -0.73 0.00 0.00 179.01 180.84 1uan s ARG 141 N -3.67 0.03 -0.15 1.92 0.52 -1.02 -5.05 118.95 111.53 1uan s ARG 141 Ca -0.10 0.30 0.00 0.00 -0.52 0.00 0.00 55.73 55.42 1uan s ARG 141 Cb 0.08 -0.22 0.03 0.00 0.52 0.00 0.00 34.95 35.36 1uan s ARG 141 CO 0.90 -0.18 -0.12 -1.17 0.02 0.00 0.00 175.30 174.75 1uan s LEU 142 N 1.21 1.64 0.30 2.53 0.20 -1.26 -0.53 118.68 122.77 1uan s LEU 142 Ca -0.08 -0.50 0.07 0.00 0.69 0.00 0.00 54.13 54.31 1uan s LEU 142 Cb -0.12 -1.11 -0.06 0.00 -0.43 0.00 0.00 46.19 44.47 1uan s LEU 142 CO -0.05 -0.08 -0.05 -0.36 -0.29 0.00 0.00 176.35 175.52 1uan s PHE 143 N 1.53 2.06 -0.01 5.38 0.08 -0.10 -4.82 117.98 122.10 1uan s PHE 143 Ca 0.04 -0.68 0.06 0.00 0.12 0.00 0.00 56.93 56.47 1uan s PHE 143 Cb -0.13 -1.21 -0.02 0.00 -0.57 0.00 0.00 43.02 41.10 1uan s PHE 143 CO -0.10 0.33 -0.19 -0.06 -0.10 0.00 0.00 175.22 175.10 1uan s PHE 144 N -2.94 1.67 -0.11 0.36 0.40 0.34 -1.13 117.98 116.58 1uan s PHE 144 Ca 0.31 -0.32 -0.02 0.00 -0.60 0.00 0.00 56.93 56.30 1uan s PHE 144 Cb 0.04 -1.07 -0.03 0.00 0.51 0.00 0.00 43.02 42.47 1uan s PHE 144 CO 0.13 -0.01 -0.02 1.52 0.70 0.00 0.00 175.22 177.54 1uan s TYR 145 N -0.48 3.08 0.57 0.36 -0.85 -0.18 -0.82 117.35 119.03 1uan s TYR 145 Ca 0.07 0.02 -0.19 0.00 -0.52 0.00 0.00 57.07 56.45 1uan s TYR 145 Cb -0.07 -1.83 -0.05 0.00 0.38 0.00 0.00 41.96 40.39 1uan s TYR 145 CO -0.00 0.29 1.16 -1.25 -1.52 0.00 0.00 175.55 174.23 1uan s PRO 146 N -0.48 3.16 0.00 -3.49 0.04 -1.26 -0.78 135.00 132.19 1uan s PRO 146 Ca 0.08 1.70 0.00 0.00 0.04 0.00 0.00 61.00 62.82 1uan s PRO 146 Cb -0.12 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.45 1uan s PRO 146 CO 0.02 -1.02 0.00 0.41 0.04 0.00 0.00 177.00 176.45 1uan n GLY 147 N 0.29 1.15 0.93 0.56 0.00 -1.26 -4.82 105.19 102.05 1uan n GLY 147 Ca 0.12 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.23 1uan n GLY 147 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1uan n ASN 148 N 0.00 3.23 -4.75 1.61 0.23 -1.26 -4.91 115.26 109.40 1uan n ASN 148 Ca 0.00 -1.94 -0.32 0.00 -0.53 0.00 0.00 54.58 51.79 1uan n ASN 148 Cb 0.00 -0.28 -0.07 0.00 -2.08 0.00 0.00 39.78 37.34 1uan n ASN 148 CO 0.00 0.00 0.00 -1.00 -0.93 0.00 0.00 177.26 175.33 1uan s HIS 149 N -1.10 3.18 0.91 -2.53 3.76 -1.26 -4.84 115.29 113.41 1uan s HIS 149 Ca 0.33 0.11 -0.11 0.00 -0.15 0.00 0.00 55.06 55.24 1uan s HIS 149 Cb 0.18 -1.66 0.12 0.00 1.11 0.00 0.00 32.58 32.32 1uan s HIS 149 CO 0.24 0.51 1.01 -2.30 -0.85 0.00 0.00 174.74 173.35 1uan n PRO 150 N 0.90 -0.33 -3.70 8.40 -0.02 -1.26 -4.98 135.00 134.01 1uan n PRO 150 Ca -0.11 -0.03 -0.10 0.00 -2.02 0.00 0.00 63.50 61.23 1uan n PRO 150 Cb 0.52 -2.28 -0.04 0.00 -0.02 0.00 0.00 33.50 31.68 1uan n PRO 150 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1uan s PHE 151 N -2.51 -0.14 -0.34 6.00 -0.12 -1.26 -5.04 117.98 114.57 1uan s PHE 151 Ca 0.66 -0.19 -0.04 0.00 -0.05 0.00 0.00 56.93 57.31 1uan s PHE 151 Cb -0.24 0.33 0.05 0.00 -0.63 0.00 0.00 43.02 42.54 1uan s PHE 151 CO 0.59 -0.83 0.09 0.00 -0.05 0.00 0.00 175.22 175.02 1uan s ALA 152 N -3.85 2.99 0.45 1.99 0.00 -1.26 -5.09 121.76 116.99 1uan s ALA 152 Ca 0.07 -1.88 -0.24 0.00 0.00 0.00 0.00 51.96 49.91 1uan s ALA 152 Cb 0.00 -2.19 -0.07 0.00 0.00 0.00 0.00 23.12 20.85 1uan s ALA 152 CO -0.06 -1.39 1.23 -1.25 0.00 0.00 0.00 175.76 174.28 1uan s PRO 153 N 1.32 3.76 0.01 0.00 0.04 -1.26 -4.86 135.00 134.01 1uan s PRO 153 Ca -0.01 1.94 0.02 0.00 0.04 0.00 0.00 61.00 62.99 1uan s PRO 153 Cb -0.20 -2.51 -0.25 0.00 0.04 0.00 0.00 34.50 31.57 1uan s PRO 153 CO 0.00 -0.59 0.86 0.77 0.04 0.00 0.00 177.00 178.08 1uan h SER 154 N 2.21 0.24 -5.09 6.66 0.02 -0.83 -3.49 113.55 113.27 1uan h SER 154 Ca -0.50 -0.35 0.00 0.00 -0.84 0.00 0.00 61.79 60.11 1uan h SER 154 Cb 1.25 -0.08 -0.08 0.00 0.14 0.00 0.00 62.40 63.64 1uan h SER 154 CO 0.61 1.30 0.07 0.72 -1.14 0.00 0.00 176.83 178.39 1uan s PHE 155 N -2.63 -0.03 0.19 3.45 -0.71 -1.00 -4.97 117.98 112.29 1uan s PHE 155 Ca -0.07 -0.36 0.08 0.00 -1.04 0.00 0.00 56.93 55.54 1uan s PHE 155 Cb 0.08 0.46 -0.04 0.00 -1.21 0.00 0.00 43.02 42.31 1uan s PHE 155 CO 0.84 -1.06 -0.17 -0.51 -1.34 0.00 0.00 175.22 172.98 1uan s LEU 156 N -2.93 2.49 -0.20 -1.99 1.43 -1.26 -1.34 118.68 114.88 1uan s LEU 156 Ca 0.13 -0.93 -0.02 0.00 -1.03 0.00 0.00 54.13 52.28 1uan s LEU 156 Cb -0.03 -0.77 -0.00 0.00 0.03 0.00 0.00 46.19 45.42 1uan s LEU 156 CO 0.04 -0.09 -0.09 -0.69 0.23 0.00 0.00 176.35 175.76 1uan s VAL 157 N -2.44 3.04 0.09 -1.59 1.01 0.59 -4.90 120.40 116.20 1uan s VAL 157 Ca 0.19 -0.61 -0.31 0.00 0.00 0.00 0.00 61.98 61.25 1uan s VAL 157 Cb -0.04 -2.35 -0.09 0.00 0.00 0.00 0.00 36.38 33.90 1uan s VAL 157 CO 0.07 0.46 1.76 -0.75 0.00 0.00 0.00 175.10 176.64 1uan s LYS 158 N 1.33 4.16 -0.04 2.72 2.20 -1.26 -0.81 119.74 128.04 1uan s LYS 158 Ca 0.04 2.47 0.10 0.00 -0.36 0.00 0.00 55.97 58.23 1uan s LYS 158 Cb -0.14 -3.65 0.18 0.00 -1.51 0.00 0.00 37.83 32.71 1uan s LYS 158 CO -0.05 -0.81 1.08 0.44 -0.36 0.00 0.00 175.35 175.66 1uan n ILE 159 N 4.82 0.58 -0.28 5.43 -5.35 0.06 -4.92 119.36 119.70 1uan n ILE 159 Ca 0.17 -0.95 0.08 0.00 -0.27 0.00 0.00 62.75 61.78 1uan n ILE 159 Cb 0.39 0.38 0.23 0.00 -1.74 0.00 0.00 39.64 38.91 1uan n ILE 159 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 1uan h SER 160 N 0.29 0.32 0.63 7.28 0.02 -1.86 0.18 113.55 120.40 1uan h SER 160 Ca -0.05 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1uan h SER 160 Cb 1.38 0.09 0.00 0.00 0.14 0.00 0.00 62.40 64.02 1uan h SER 160 CO 0.02 0.09 0.00 0.00 -1.14 0.00 0.00 176.83 175.80 1uan n ALA 161 N -2.51 2.23 0.07 3.77 0.00 -1.26 -3.32 120.51 119.49 1uan n ALA 161 Ca 0.17 -0.11 0.03 0.00 0.00 0.00 0.00 53.44 53.53 1uan n ALA 161 Cb 0.49 -1.41 0.05 0.00 0.00 0.00 0.00 19.45 18.58 1uan n ALA 161 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1uan n PHE 162 N -1.37 0.12 -0.36 0.00 3.01 0.58 -4.73 117.46 114.71 1uan n PHE 162 Ca 0.10 -0.26 -0.02 0.00 1.01 0.00 0.00 57.45 58.29 1uan n PHE 162 Cb 0.24 -0.02 0.11 0.00 -0.01 0.00 0.00 39.48 39.80 1uan n PHE 162 CO 0.00 0.00 0.00 0.97 1.01 0.00 0.00 176.76 178.74 1uan h ILE 163 N 1.06 1.21 -0.23 4.37 6.09 -1.43 -1.03 117.51 127.55 1uan h ILE 163 Ca 0.00 -0.43 -0.10 0.00 -1.37 0.00 0.00 64.86 62.95 1uan h ILE 163 Cb 0.43 -0.16 -0.01 0.00 0.47 0.00 0.00 36.82 37.54 1uan h ILE 163 CO 0.00 0.23 -0.31 0.44 -3.07 0.00 0.00 178.15 175.44 1uan h ASP 164 N 1.26 0.47 -0.36 2.19 3.32 -1.86 -0.78 116.42 120.66 1uan h ASP 164 Ca 0.37 -0.18 -0.05 0.00 0.02 0.00 0.00 57.03 57.19 1uan h ASP 164 Cb -0.08 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 1uan h ASP 164 CO -0.10 0.76 0.02 1.56 -1.72 0.00 0.00 179.24 179.76 1uan h GLN 165 N 0.40 0.62 -0.30 3.56 4.20 -1.72 -0.57 115.11 121.30 1uan h GLN 165 Ca 0.05 -0.19 0.06 0.00 0.06 0.00 0.00 58.65 58.64 1uan h GLN 165 Cb 0.74 -0.06 -0.06 0.00 0.30 0.00 0.00 27.48 28.40 1uan h GLN 165 CO 0.06 0.72 -0.09 2.35 -0.67 0.00 0.00 178.83 181.20 1uan h TRP 166 N 0.44 -0.19 -0.25 2.96 7.01 -0.91 -0.72 115.95 124.30 1uan h TRP 166 Ca 0.10 0.03 -0.18 0.00 2.11 0.00 0.00 58.89 60.96 1uan h TRP 166 Cb 0.42 0.13 -0.00 0.00 -2.10 0.00 0.00 29.16 27.61 1uan h TRP 166 CO 0.03 -0.14 -0.55 1.49 -2.79 0.00 0.00 178.44 176.48 1uan h GLU 167 N -0.02 0.76 -0.38 2.65 4.81 -1.07 -2.56 114.58 118.77 1uan h GLU 167 Ca 0.15 -0.48 -0.07 0.00 -0.13 0.00 0.00 59.36 58.82 1uan h GLU 167 Cb 0.24 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 1uan h GLU 167 CO -0.32 1.11 -0.07 0.00 -0.73 0.00 0.00 179.01 179.00 1uan h ALA 168 N 0.80 1.17 -0.12 2.92 0.00 -0.74 -1.08 119.26 122.21 1uan h ALA 168 Ca 0.01 -0.27 -0.15 0.00 0.00 0.00 0.00 54.91 54.51 1uan h ALA 168 Cb 1.13 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1uan h ALA 168 CO 0.12 0.53 -0.56 0.00 0.00 0.00 0.00 179.25 179.34 1uan h ALA 169 N 1.33 0.83 -0.25 0.00 0.00 -0.95 -1.11 119.26 119.11 1uan h ALA 169 Ca 0.11 -0.51 -0.06 0.00 0.00 0.00 0.00 54.91 54.45 1uan h ALA 169 Cb 0.48 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1uan h ALA 169 CO 0.03 0.69 -0.08 0.28 0.00 0.00 0.00 179.25 180.17 1uan h VAL 170 N 0.27 1.29 0.00 0.00 2.07 -1.29 -3.12 116.25 115.47 1uan h VAL 170 Ca 0.00 -1.12 0.00 0.00 0.82 0.00 0.00 66.70 66.40 1uan h VAL 170 Cb 1.06 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.33 1uan h VAL 170 CO 0.09 0.35 0.00 -0.07 0.02 0.00 0.00 177.57 177.96 1uan h LEU 171 N 0.23 0.00 -2.17 2.57 3.38 -1.02 -2.14 115.31 116.16 1uan h LEU 171 Ca 0.06 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.10 1uan h LEU 171 Cb 0.57 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1uan h LEU 171 CO 0.03 0.00 0.23 0.00 0.09 0.00 0.00 178.44 178.79 1uan h ALA 172 N 2.07 1.91 -0.27 1.53 0.00 -1.13 -3.10 119.26 120.26 1uan h ALA 172 Ca 0.00 -0.01 -0.72 0.00 0.00 0.00 0.00 54.91 54.18 1uan h ALA 172 Cb 0.31 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.05 1uan h ALA 172 CO 0.00 -0.35 2.84 0.66 0.00 0.00 0.00 179.25 182.40 1uan n TYR 173 N -3.88 3.28 -0.34 0.00 4.02 -0.81 -4.67 117.16 114.76 1uan n TYR 173 Ca 0.03 -2.93 0.00 0.00 -0.01 0.00 0.00 57.90 54.99 1uan n TYR 173 Cb 0.37 -2.36 0.14 0.00 -0.02 0.00 0.00 39.34 37.46 1uan n TYR 173 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1uan h ARG 174 N 5.84 1.09 0.00 -0.72 3.08 -1.83 0.49 114.38 122.33 1uan h ARG 174 Ca 0.54 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.52 1uan h ARG 174 Cb 0.61 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1uan h ARG 174 CO 1.80 0.72 0.00 0.66 -1.07 0.00 0.00 179.97 182.08 1uan h SER 175 N 1.12 0.00 0.00 7.04 4.64 -1.89 -2.86 113.55 121.60 1uan h SER 175 Ca 0.38 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.44 1uan h SER 175 Cb 0.08 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.13 1uan h SER 175 CO -0.14 0.00 -1.89 0.00 -0.87 0.00 0.00 176.83 173.93 1uan n GLN 176 N -2.46 0.34 -0.85 4.77 1.13 -0.01 -4.72 117.38 115.58 1uan n GLN 176 Ca -0.01 0.14 -0.06 0.00 -1.94 0.00 0.00 57.00 55.13 1uan n GLN 176 Cb 0.09 -1.10 0.22 0.00 0.11 0.00 0.00 30.24 29.57 1uan n GLN 176 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1uan n PHE 177 N -3.62 1.65 -2.44 1.08 3.01 -0.20 -4.59 117.46 112.35 1uan n PHE 177 Ca -0.31 -1.45 0.01 0.00 1.01 0.00 0.00 57.45 56.71 1uan n PHE 177 Cb 0.73 -0.58 0.01 0.00 -0.01 0.00 0.00 39.48 39.63 1uan n PHE 177 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 1uan n THR 178 N -0.87 0.16 0.00 4.37 -1.04 -1.08 -3.93 114.28 111.90 1uan n THR 178 Ca 0.37 -1.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.36 1uan n THR 178 Cb 1.19 0.93 0.00 0.00 -1.82 0.00 0.00 70.33 70.63 1uan n THR 178 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1uan n VAL 186 N 0.16 0.00 -2.21 12.58 0.31 -1.26 -5.02 118.33 122.89 1uan n VAL 186 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1uan n VAL 186 Cb 1.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.93 1uan n VAL 186 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1uan n GLY 187 N 0.00 5.39 0.37 2.92 0.00 -1.26 -4.90 105.19 107.71 1uan n GLY 187 Ca 0.00 -1.21 0.16 0.00 0.00 0.00 0.00 46.02 44.97 1uan n GLY 187 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uan h PRO 188 N 0.00 0.26 -0.03 1.61 0.13 -1.87 -0.70 132.00 131.40 1uan h PRO 188 Ca 0.00 -0.02 -0.24 0.00 -0.87 0.00 0.00 66.00 64.87 1uan h PRO 188 Cb 0.00 -0.06 0.02 0.00 0.13 0.00 0.00 31.00 31.09 1uan h PRO 188 CO 0.00 0.17 -0.93 0.87 -0.23 0.00 0.00 178.00 177.88 1uan h LYS 189 N 0.27 0.69 -0.25 0.86 6.56 -1.95 -2.29 116.57 120.46 1uan h LYS 189 Ca 0.29 -0.70 0.06 0.00 -1.06 0.00 0.00 60.65 59.24 1uan h LYS 189 Cb 0.78 0.19 -0.06 0.00 -0.57 0.00 0.00 32.23 32.56 1uan h LYS 189 CO -0.06 1.28 -0.16 0.78 -2.06 0.00 0.00 179.45 179.23 1uan h GLY 190 N 0.36 0.02 0.72 3.86 0.00 -1.73 -0.33 103.07 105.98 1uan h GLY 190 Ca -0.11 0.19 0.03 0.00 0.00 0.00 0.00 47.33 47.45 1uan h GLY 190 CO 0.18 -0.16 0.07 -2.08 0.00 0.00 0.00 176.54 174.55 1uan h VAL 191 N -0.14 0.90 -0.08 4.60 2.07 -1.13 -1.67 116.25 120.79 1uan h VAL 191 Ca 0.14 -0.06 -0.07 0.00 0.82 0.00 0.00 66.70 67.52 1uan h VAL 191 Cb 0.34 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1uan h VAL 191 CO -0.33 0.03 -0.29 1.05 0.02 0.00 0.00 177.57 178.05 1uan h GLU 192 N 0.18 0.15 -0.47 1.57 4.11 -1.29 -0.25 114.58 118.58 1uan h GLU 192 Ca 0.12 -0.05 -0.06 0.00 0.07 0.00 0.00 59.36 59.45 1uan h GLU 192 Cb 0.11 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1uan h GLU 192 CO -0.15 0.43 0.07 0.00 0.07 0.00 0.00 179.01 179.42 1uan h ALA 193 N 1.58 1.23 0.00 1.06 0.00 -0.58 -0.51 119.26 122.04 1uan h ALA 193 Ca 0.02 -0.22 -0.15 0.00 0.00 0.00 0.00 54.91 54.56 1uan h ALA 193 Cb 0.58 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1uan h ALA 193 CO 0.04 0.52 -0.71 0.00 0.00 0.00 0.00 179.25 179.11 1uan h ARG 194 N 0.71 0.00 -0.25 0.00 2.47 -0.71 -0.47 114.38 116.12 1uan h ARG 194 Ca 0.15 0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 58.76 1uan h ARG 194 Cb 0.34 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.66 1uan h ARG 194 CO 0.01 0.70 -0.27 -0.22 0.56 0.00 0.00 179.97 180.75 1uan h LYS 195 N 0.00 0.63 -0.92 0.04 3.64 -0.76 -2.77 116.57 116.42 1uan h LYS 195 Ca -0.01 -0.34 0.02 0.00 -1.27 0.00 0.00 60.65 59.05 1uan h LYS 195 Cb 1.54 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 33.33 1uan h LYS 195 CO 0.09 0.94 0.61 0.00 -2.27 0.00 0.00 179.45 178.82 1uan h ALA 196 N 0.68 1.37 -0.51 5.00 0.00 -0.92 -1.50 119.26 123.38 1uan h ALA 196 Ca 0.04 -0.06 0.10 0.00 0.00 0.00 0.00 54.91 54.99 1uan h ALA 196 Cb 0.83 -0.36 -0.10 0.00 0.00 0.00 0.00 17.79 18.17 1uan h ALA 196 CO 0.07 0.57 -0.16 1.98 0.00 0.00 0.00 179.25 181.70 1uan h MET 197 N 1.21 -0.04 -0.65 0.00 1.85 -0.99 0.22 114.93 116.53 1uan h MET 197 Ca 0.35 0.00 -0.07 0.00 -0.61 0.00 0.00 59.70 59.37 1uan h MET 197 Cb -0.08 0.01 -0.03 0.00 0.43 0.00 0.00 31.60 31.93 1uan h MET 197 CO -0.09 -0.03 0.11 0.00 -0.40 0.00 0.00 176.91 176.50 1uan h ARG 198 N -0.05 1.06 -0.29 0.39 3.08 -1.17 0.06 114.38 117.46 1uan h ARG 198 Ca 0.24 -0.27 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 1uan h ARG 198 Cb 0.42 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 1uan h ARG 198 CO -0.54 0.97 -0.08 -0.09 -1.07 0.00 0.00 179.97 179.15 1uan h ARG 199 N 1.00 0.57 0.14 0.04 9.65 -0.73 -0.37 114.38 124.68 1uan h ARG 199 Ca 0.20 -0.22 -0.01 0.00 -1.10 0.00 0.00 59.98 58.85 1uan h ARG 199 Cb 0.42 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.97 1uan h ARG 199 CO 0.01 0.77 -0.07 -0.92 2.80 0.00 0.00 179.97 182.56 1uan h TYR 200 N 0.33 -0.17 -0.66 2.20 5.03 -0.39 -1.73 116.97 121.58 1uan h TYR 200 Ca 0.07 -0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.36 1uan h TYR 200 Cb 0.57 0.06 -0.03 0.00 1.55 0.00 0.00 36.73 38.87 1uan h TYR 200 CO 0.05 0.09 0.34 -1.49 -1.32 0.00 0.00 178.16 175.83 1uan h TRP 201 N -0.42 0.94 -0.60 -3.82 4.06 -1.05 -2.73 115.95 112.33 1uan h TRP 201 Ca -0.02 -0.04 -0.03 0.00 2.06 0.00 0.00 58.89 60.86 1uan h TRP 201 Cb 0.34 -0.29 -0.03 0.00 -1.00 0.00 0.00 29.16 28.17 1uan h TRP 201 CO 0.00 0.69 0.24 0.78 -3.56 0.00 0.00 178.44 176.59 1uan h GLY 202 N 0.92 0.94 1.75 1.49 0.00 -0.90 -2.83 103.07 104.43 1uan h GLY 202 Ca 0.23 -0.48 -0.03 0.00 0.00 0.00 0.00 47.33 47.05 1uan h GLY 202 CO -0.03 0.46 -0.02 -0.57 0.00 0.00 0.00 176.54 176.37 1uan h ASN 203 N 0.86 0.29 -0.83 0.19 -1.24 -1.00 0.72 115.58 114.58 1uan h ASN 203 Ca 0.20 -0.04 0.17 0.00 0.71 0.00 0.00 56.30 57.34 1uan h ASN 203 Cb 0.17 -0.08 -0.06 0.00 0.73 0.00 0.00 38.32 39.09 1uan h ASN 203 CO -0.02 0.37 0.55 1.88 -1.29 0.00 0.00 177.43 178.92 1uan h TYR 204 N 0.31 0.55 -0.46 0.67 0.99 -1.41 -2.24 116.97 115.39 1uan h TYR 204 Ca 0.07 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.82 1uan h TYR 204 Cb 0.24 -0.17 0.00 0.00 1.00 0.00 0.00 36.73 37.80 1uan h TYR 204 CO 0.01 0.19 0.00 1.28 -0.00 0.00 0.00 178.16 179.63 1uan n LEU 205 N -4.50 3.95 -0.61 3.88 7.99 0.09 -4.97 117.00 122.83 1uan n LEU 205 Ca 0.17 -2.44 -0.06 0.00 -0.01 0.00 0.00 56.01 53.66 1uan n LEU 205 Cb 0.58 -0.46 -0.02 0.00 -0.11 0.00 0.00 43.42 43.42 1uan n LEU 205 CO 0.32 0.76 -0.07 0.61 -1.51 0.00 0.00 177.39 177.49 1uan n GLY 206 N 0.52 0.48 3.33 -0.72 0.00 -0.76 -5.04 105.19 103.00 1uan n GLY 206 Ca 0.20 -0.69 -0.20 0.00 0.00 0.00 0.00 46.02 45.34 1uan n GLY 206 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1uan s VAL 207 N -2.28 1.73 0.09 1.61 -7.23 -0.29 -4.98 120.40 109.05 1uan s VAL 207 Ca 0.00 -2.07 -0.19 0.00 -1.81 0.00 0.00 61.98 57.91 1uan s VAL 207 Cb 0.00 -1.93 -0.08 0.00 0.56 0.00 0.00 36.38 34.93 1uan s VAL 207 CO 0.00 -0.49 1.58 0.44 -0.31 0.00 0.00 175.10 176.32 1uan h ASP 208 N 2.87 0.35 -4.12 4.85 3.32 -1.92 -2.83 116.42 118.94 1uan h ASP 208 Ca -0.40 -0.23 -0.19 0.00 0.02 0.00 0.00 57.03 56.23 1uan h ASP 208 Cb 1.21 -0.09 -0.25 0.00 0.22 0.00 0.00 39.33 40.42 1uan h ASP 208 CO 0.57 0.49 -0.60 -0.31 -1.72 0.00 0.00 179.24 177.67 1uan s TYR 209 N -5.28 -0.03 0.01 4.55 1.51 -1.26 -4.32 117.35 112.52 1uan s TYR 209 Ca -0.14 0.09 -0.15 0.00 -1.01 0.00 0.00 57.07 55.86 1uan s TYR 209 Cb 0.07 -0.01 0.02 0.00 -0.11 0.00 0.00 41.96 41.94 1uan s TYR 209 CO 0.73 -0.11 0.33 0.00 -1.11 0.00 0.00 175.55 175.39 1uan s ALA 210 N -0.38 -0.80 -0.15 3.71 0.00 -0.77 -0.76 121.76 122.61 1uan s ALA 210 Ca -0.04 0.26 -0.03 0.00 0.00 0.00 0.00 51.96 52.15 1uan s ALA 210 Cb -0.03 0.17 -0.02 0.00 0.00 0.00 0.00 23.12 23.24 1uan s ALA 210 CO 0.00 -0.33 -0.06 -1.21 0.00 0.00 0.00 175.76 174.17 1uan s GLU 211 N -1.79 3.59 0.22 0.00 2.02 0.01 -4.28 118.70 118.48 1uan s GLU 211 Ca -0.10 -0.57 -0.22 0.00 0.02 0.00 0.00 54.97 54.10 1uan s GLU 211 Cb -0.03 -2.85 -0.08 0.00 0.10 0.00 0.00 34.13 31.27 1uan s GLU 211 CO 0.02 0.22 0.77 -1.25 0.02 0.00 0.00 175.26 175.03 1uan s PRO 212 N 0.40 4.37 0.09 0.39 0.04 -1.26 -0.30 135.00 138.73 1uan s PRO 212 Ca -0.06 1.00 0.02 0.00 0.04 0.00 0.00 61.00 62.01 1uan s PRO 212 Cb -0.15 -2.96 -0.04 0.00 0.04 0.00 0.00 34.50 31.40 1uan s PRO 212 CO 0.04 0.42 -0.07 -0.06 0.04 0.00 0.00 177.00 177.36 1uan s PHE 213 N -1.45 0.89 -0.01 0.56 0.40 -0.45 -4.48 117.98 113.44 1uan s PHE 213 Ca 0.42 -0.84 0.07 0.00 -0.60 0.00 0.00 56.93 55.99 1uan s PHE 213 Cb -0.18 -0.51 -0.02 0.00 0.51 0.00 0.00 43.02 42.81 1uan s PHE 213 CO 0.22 -0.12 -0.24 0.08 0.70 0.00 0.00 175.22 175.86 1uan s VAL 214 N -3.25 2.27 -0.03 -0.44 1.01 0.00 -0.07 120.40 119.89 1uan s VAL 214 Ca 0.09 -1.10 0.03 0.00 0.00 0.00 0.00 61.98 61.00 1uan s VAL 214 Cb 0.03 -1.83 -0.00 0.00 0.00 0.00 0.00 36.38 34.58 1uan s VAL 214 CO -0.04 0.53 -0.13 -0.55 0.00 0.00 0.00 175.10 174.92 1uan s SER 215 N -0.78 1.66 0.42 3.32 0.15 -1.26 -0.50 113.70 116.72 1uan s SER 215 Ca 0.11 -0.26 0.29 0.00 0.70 0.00 0.00 55.95 56.79 1uan s SER 215 Cb -0.10 -0.42 1.20 0.00 -1.71 0.00 0.00 66.02 64.99 1uan s SER 215 CO 0.00 0.12 1.87 1.55 1.20 0.00 0.00 173.24 177.97 1uan h PRO 216 N 6.25 0.00 -6.10 5.44 0.13 -2.00 -3.43 132.00 132.28 1uan h PRO 216 Ca -0.33 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.14 1uan h PRO 216 Cb 1.17 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.19 1uan h PRO 216 CO 0.48 0.00 -0.61 -0.51 -0.23 0.00 0.00 178.00 177.14 1uan s LEU 217 N -5.44 3.73 0.38 1.56 1.43 -1.26 -5.10 118.68 114.00 1uan s LEU 217 Ca 0.03 0.05 -0.28 0.00 -1.03 0.00 0.00 54.13 52.90 1uan s LEU 217 Cb 0.09 -2.22 -0.11 0.00 0.03 0.00 0.00 46.19 43.99 1uan s LEU 217 CO 0.48 0.25 1.48 -2.16 0.23 0.00 0.00 176.35 176.63 1uan s PRO 218 N -1.82 4.07 0.50 1.29 0.04 -1.26 -4.99 135.00 132.83 1uan s PRO 218 Ca 0.23 2.55 -0.19 0.00 0.04 0.00 0.00 61.00 63.63 1uan s PRO 218 Cb -0.12 -2.94 -0.08 0.00 0.04 0.00 0.00 34.50 31.40 1uan s PRO 218 CO 0.14 -0.56 1.01 0.14 0.04 0.00 0.00 177.00 177.78 1uan s VAL 219 N -1.13 4.04 -0.56 -0.36 -7.23 -1.26 -4.99 120.40 108.91 1uan s VAL 219 Ca 0.54 1.17 -0.28 0.00 -1.81 0.00 0.00 61.98 61.60 1uan s VAL 219 Cb -0.46 -3.51 0.01 0.00 0.56 0.00 0.00 36.38 32.98 1uan s VAL 219 CO 0.62 -0.37 1.45 -0.76 -0.31 0.00 0.00 175.10 175.73 1uan s LEU 220 N -3.68 3.40 0.09 1.32 1.43 -1.26 -4.99 118.68 114.99 1uan s LEU 220 Ca 0.64 0.32 0.10 0.00 -1.03 0.00 0.00 54.13 54.17 1uan s LEU 220 Cb -0.14 -3.04 -0.03 0.00 0.03 0.00 0.00 46.19 43.01 1uan s LEU 220 CO 0.23 -1.74 -0.27 -0.47 0.23 0.00 0.00 176.35 174.33 1uan s TYR 221 N 6.24 2.32 -0.37 0.29 6.04 -1.26 -5.09 117.35 125.52 1uan s TYR 221 Ca 0.54 -0.39 -0.10 0.00 0.04 0.00 0.00 57.07 57.16 1uan s TYR 221 Cb -0.11 -1.32 0.03 0.00 -1.04 0.00 0.00 41.96 39.52 1uan s TYR 221 CO 0.25 0.24 0.18 0.08 -1.54 0.00 0.00 175.55 174.76 1uan s VAL 222 N -0.94 4.33 0.45 3.14 1.01 -1.26 -4.99 120.40 122.14 1uan s VAL 222 Ca 0.13 -0.96 0.41 0.00 0.00 0.00 0.00 61.98 61.55 1uan s VAL 222 Cb -0.10 -3.44 0.43 0.00 0.00 0.00 0.00 36.38 33.27 1uan s VAL 222 CO 0.04 -0.23 2.23 -0.65 0.00 0.00 0.00 175.10 176.49 1uan h PRO 223 N 8.37 0.00 -0.22 2.72 0.11 -2.03 -0.58 132.00 140.38 1uan h PRO 223 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1uan h PRO 223 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1uan h PRO 223 CO 0.65 0.00 0.00 -2.67 -0.21 0.00 0.00 178.00 175.77 1uan n TRP 224 N -3.06 0.27 -1.41 0.65 2.14 -1.26 -5.02 117.44 109.74 1uan n TRP 224 Ca -0.02 -0.14 -0.30 0.00 2.07 0.00 0.00 57.50 59.11 1uan n TRP 224 Cb 0.15 -0.00 0.09 0.00 -0.81 0.00 0.00 31.31 30.75 1uan n TRP 224 CO 0.00 0.00 0.00 -1.54 2.07 0.00 0.00 177.69 178.22 1uan s SER 225 N -1.62 4.41 0.47 -0.67 1.04 -0.23 -5.02 113.70 112.09 1uan s SER 225 Ca 0.32 1.52 -0.20 0.00 0.48 0.00 0.00 55.95 58.07 1uan s SER 225 Cb 0.20 -2.26 -0.09 0.00 0.10 0.00 0.00 66.02 63.97 1uan s SER 225 CO 0.29 -2.05 1.00 -0.13 0.98 0.00 0.00 173.24 173.33 1uan s ARG 226 N -5.03 3.97 0.00 4.02 0.52 -1.26 -5.06 118.95 116.11 1uan s ARG 226 Ca 0.61 1.21 0.11 0.00 -0.52 0.00 0.00 55.73 57.14 1uan s ARG 226 Cb -0.16 -2.13 0.65 0.00 0.52 0.00 0.00 34.95 33.83 1uan s ARG 226 CO 0.55 -0.27 1.09 0.00 0.02 0.00 0.00 175.30 176.69