#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c9d n ALA 15 N 0.00 4.76 0.52 -1.67 0.00 -1.25 -4.74 120.51 118.14 2c9d n ALA 15 Ca 0.00 -3.07 0.08 0.00 0.00 0.00 0.00 53.44 50.45 2c9d n ALA 15 Cb 0.00 -0.97 0.36 0.00 0.00 0.00 0.00 19.45 18.84 2c9d n ALA 15 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2c9d n SER 16 N -1.13 0.11 -0.00 0.00 3.41 -1.25 -2.72 113.62 112.04 2c9d n SER 16 Ca 0.42 0.53 0.10 0.00 -0.26 0.00 0.00 58.87 59.66 2c9d n SER 16 Cb 1.25 -0.55 -0.12 0.00 -0.26 0.00 0.00 64.21 64.53 2c9d n SER 16 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2c9d n GLY 17 N 0.13 -1.01 3.77 5.00 0.00 -1.26 -4.91 105.19 106.90 2c9d n GLY 17 Ca 0.04 -0.58 -0.38 0.00 0.00 0.00 0.00 46.02 45.10 2c9d n GLY 17 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2c9d s VAL 18 N -3.09 4.03 -0.42 1.61 -7.23 -1.10 -5.03 120.40 109.17 2c9d s VAL 18 Ca 0.05 1.79 -0.14 0.00 -1.81 0.00 0.00 61.98 61.88 2c9d s VAL 18 Cb 0.16 -4.05 0.04 0.00 0.56 0.00 0.00 36.38 33.09 2c9d s VAL 18 CO 0.87 0.24 0.30 -0.13 -0.31 0.00 0.00 175.10 176.08 2c9d s ARG 19 N -1.81 2.90 -0.04 4.82 0.52 -1.26 -5.00 118.95 119.08 2c9d s ARG 19 Ca 0.48 -1.18 -0.04 0.00 -0.52 0.00 0.00 55.73 54.48 2c9d s ARG 19 Cb -0.23 -3.95 -0.04 0.00 0.52 0.00 0.00 34.95 31.25 2c9d s ARG 19 CO 0.28 -0.84 0.16 -1.17 0.02 0.00 0.00 175.30 173.75 2c9d s LEU 20 N 1.62 4.31 0.02 2.53 2.96 -1.26 -0.89 118.68 127.96 2c9d s LEU 20 Ca 0.04 0.35 0.04 0.00 -0.22 0.00 0.00 54.13 54.34 2c9d s LEU 20 Cb -0.21 -2.42 -0.02 0.00 0.50 0.00 0.00 46.19 44.04 2c9d s LEU 20 CO 0.08 0.30 -0.12 0.00 -1.32 0.00 0.00 176.35 175.29 2c9d s ALA 21 N -1.23 0.97 -0.09 5.97 0.00 -0.69 -2.40 121.76 124.30 2c9d s ALA 21 Ca 0.23 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.53 2c9d s ALA 21 Cb -0.12 -0.17 0.02 0.00 0.00 0.00 0.00 23.12 22.85 2c9d s ALA 21 CO 0.14 0.19 -0.07 0.42 0.00 0.00 0.00 175.76 176.44 2c9d s ILE 22 N -0.66 0.91 -0.15 0.00 1.01 0.20 -1.18 121.20 121.32 2c9d s ILE 22 Ca 0.01 -0.25 0.02 0.00 0.00 0.00 0.00 60.65 60.43 2c9d s ILE 22 Cb -0.06 -0.93 0.01 0.00 0.01 0.00 0.00 42.46 41.49 2c9d s ILE 22 CO 0.01 0.34 -0.21 0.54 0.00 0.00 0.00 174.94 175.61 2c9d s VAL 23 N 1.49 2.06 -0.03 2.92 0.11 -0.36 -0.75 120.40 125.84 2c9d s VAL 23 Ca 0.00 -0.96 0.02 0.00 -2.93 0.00 0.00 61.98 58.11 2c9d s VAL 23 Cb -0.13 -1.83 0.00 0.00 -1.53 0.00 0.00 36.38 32.89 2c9d s VAL 23 CO -0.05 0.55 -0.08 0.00 -3.33 0.00 0.00 175.10 172.19 2c9d s ALA 24 N 0.98 0.79 0.57 1.54 0.00 -0.77 -1.35 121.76 123.52 2c9d s ALA 24 Ca -0.03 -0.28 -0.11 0.00 0.00 0.00 0.00 51.96 51.53 2c9d s ALA 24 Cb -0.15 -0.31 -0.05 0.00 0.00 0.00 0.00 23.12 22.61 2c9d s ALA 24 CO -0.06 0.12 0.98 -1.54 0.00 0.00 0.00 175.76 175.26 2c9d s SER 25 N 0.26 6.34 -0.02 0.00 1.04 -0.66 -1.95 113.70 118.70 2c9d s SER 25 Ca -0.04 1.38 0.15 0.00 0.48 0.00 0.00 55.95 57.91 2c9d s SER 25 Cb -0.09 -2.44 -0.22 0.00 0.10 0.00 0.00 66.02 63.37 2c9d s SER 25 CO 0.00 -0.74 0.32 -1.20 0.98 0.00 0.00 173.24 172.60 2c9d n SER 26 N -2.35 1.67 -4.60 7.02 7.64 -0.63 -4.82 113.62 117.55 2c9d n SER 26 Ca 0.05 -0.02 -0.54 0.00 1.01 0.00 0.00 58.87 59.38 2c9d n SER 26 Cb 0.54 1.65 -0.06 0.00 -1.01 0.00 0.00 64.21 65.32 2c9d n SER 26 CO 0.00 0.00 0.00 1.87 -3.01 0.00 0.00 175.04 173.90 2c9d n TRP 27 N -1.99 1.51 -2.94 1.43 -0.00 -1.22 -1.84 117.44 112.39 2c9d n TRP 27 Ca -0.03 0.68 -0.07 0.00 -0.00 0.00 0.00 57.50 58.08 2c9d n TRP 27 Cb 0.37 -2.32 0.01 0.00 -0.00 0.00 0.00 31.31 29.37 2c9d n TRP 27 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 177.69 178.41 2c9d n HIS 28 N 2.88 -3.32 -0.18 5.87 8.25 -1.26 -4.66 115.22 122.81 2c9d n HIS 28 Ca 0.20 1.32 -0.09 0.00 -0.26 0.00 0.00 57.72 58.89 2c9d n HIS 28 Cb 0.16 -4.03 0.01 0.00 1.12 0.00 0.00 29.99 27.25 2c9d n HIS 28 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2c9d h GLY 29 N 1.54 0.89 0.88 -1.41 0.00 -1.73 -3.02 103.07 100.21 2c9d h GLY 29 Ca -0.02 -0.58 0.01 0.00 0.00 0.00 0.00 47.33 46.74 2c9d h GLY 29 CO 0.23 0.54 -0.03 1.70 0.00 0.00 0.00 176.54 178.98 2c9d h LYS 30 N 0.72 -0.04 -0.84 4.80 3.64 -1.93 -1.96 116.57 120.97 2c9d h LYS 30 Ca 0.16 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 2c9d h LYS 30 Cb 0.37 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.16 2c9d h LYS 30 CO 0.01 -0.02 0.45 0.82 -2.27 0.00 0.00 179.45 178.44 2c9d h ILE 31 N -0.04 1.25 -0.56 2.00 2.04 -1.95 -2.52 117.51 117.73 2c9d h ILE 31 Ca 0.02 -0.62 0.07 0.00 1.00 0.00 0.00 64.86 65.34 2c9d h ILE 31 Cb 0.07 0.13 -0.06 0.00 -0.74 0.00 0.00 36.82 36.22 2c9d h ILE 31 CO -0.06 0.28 0.23 0.00 0.00 0.00 0.00 178.15 178.60 2c9d h ASP 33 N 0.43 0.92 0.53 0.00 3.45 -0.94 0.16 116.42 120.96 2c9d h ASP 33 Ca 0.27 -0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.70 2c9d h ASP 33 Cb 0.27 -0.20 0.01 0.00 -0.56 0.00 0.00 39.33 38.85 2c9d h ASP 33 CO -0.25 0.62 -0.25 0.00 -1.57 0.00 0.00 179.24 177.79 2c9d h ALA 34 N 1.37 -0.71 -0.61 3.45 0.00 -1.09 0.55 119.26 122.24 2c9d h ALA 34 Ca 0.36 -0.17 0.11 0.00 0.00 0.00 0.00 54.91 55.20 2c9d h ALA 34 Cb 0.04 0.27 -0.08 0.00 0.00 0.00 0.00 17.79 18.03 2c9d h ALA 34 CO -0.13 -0.86 0.17 -0.07 0.00 0.00 0.00 179.25 178.36 2c9d h LEU 35 N -0.78 0.09 -1.07 0.00 3.38 -0.87 -1.02 115.31 115.04 2c9d h LEU 35 Ca -0.07 0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 2c9d h LEU 35 Cb 0.58 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 2c9d h LEU 35 CO 0.12 0.06 0.04 0.25 0.09 0.00 0.00 178.44 179.00 2c9d h LEU 36 N 0.32 0.66 -0.69 1.67 5.85 -0.62 -2.87 115.31 119.64 2c9d h LEU 36 Ca 0.32 -0.13 -0.09 0.00 0.84 0.00 0.00 57.88 58.82 2c9d h LEU 36 Cb 0.44 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 2c9d h LEU 36 CO -0.37 0.71 0.04 -0.78 -0.34 0.00 0.00 178.44 177.70 2c9d h ASP 37 N 0.67 1.02 -0.48 1.25 -0.00 0.35 -2.64 116.42 116.60 2c9d h ASP 37 Ca 0.14 -0.27 -0.04 0.00 -0.00 0.00 0.00 57.03 56.87 2c9d h ASP 37 Cb 0.35 -0.27 -0.02 0.00 -0.00 0.00 0.00 39.33 39.39 2c9d h ASP 37 CO 0.01 1.05 0.15 1.23 -0.00 0.00 0.00 179.24 181.68 2c9d h GLY 38 N 1.01 0.79 1.00 -0.78 0.00 -1.15 -2.80 103.07 101.15 2c9d h GLY 38 Ca 0.18 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2c9d h GLY 38 CO 0.02 0.44 0.15 0.00 0.00 0.00 0.00 176.54 177.15 2c9d h ALA 39 N 1.01 0.30 -0.26 3.60 0.00 -1.41 -2.61 119.26 119.88 2c9d h ALA 39 Ca 0.15 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 2c9d h ALA 39 Cb 0.26 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2c9d h ALA 39 CO -0.01 -0.23 -0.17 0.00 0.00 0.00 0.00 179.25 178.85 2c9d h ARG 40 N 0.32 0.46 -0.02 0.00 3.08 -1.47 -0.94 114.38 115.80 2c9d h ARG 40 Ca 0.09 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 2c9d h ARG 40 Cb -0.03 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 2c9d h ARG 40 CO -0.02 0.62 0.00 0.87 -1.07 0.00 0.00 179.97 180.37 2c9d h LYS 41 N 0.42 0.03 -0.71 0.04 1.57 -1.36 -0.60 116.57 115.96 2c9d h LYS 41 Ca 0.07 -0.01 0.10 0.00 -1.87 0.00 0.00 60.65 58.95 2c9d h LYS 41 Cb 0.54 -0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.77 2c9d h LYS 41 CO 0.04 0.27 0.33 0.28 -0.57 0.00 0.00 179.45 179.79 2c9d h VAL 42 N -0.22 0.80 -0.16 0.50 2.07 -1.34 -0.59 116.25 117.29 2c9d h VAL 42 Ca 0.00 -0.19 0.03 0.00 0.82 0.00 0.00 66.70 67.37 2c9d h VAL 42 Cb 0.26 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 2c9d h VAL 42 CO 0.00 0.10 -0.05 0.00 0.02 0.00 0.00 177.57 177.64 2c9d h ALA 43 N 1.45 0.10 -0.53 1.67 0.00 -0.93 -2.09 119.26 118.94 2c9d h ALA 43 Ca 0.36 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.23 2c9d h ALA 43 Cb 0.43 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2c9d h ALA 43 CO -0.30 -0.48 -0.09 0.00 0.00 0.00 0.00 179.25 178.37 2c9d h ALA 44 N 1.15 0.85 -0.93 0.00 0.00 -0.63 -1.49 119.26 118.22 2c9d h ALA 44 Ca 0.08 -0.34 0.06 0.00 0.00 0.00 0.00 54.91 54.71 2c9d h ALA 44 Cb 0.13 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 2c9d h ALA 44 CO -0.17 0.65 0.60 0.78 0.00 0.00 0.00 179.25 181.11 2c9d h GLY 45 N 0.96 1.36 0.02 0.00 0.00 -0.93 -2.23 103.07 102.25 2c9d h GLY 45 Ca 0.14 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2c9d h GLY 45 CO 0.04 0.33 0.00 0.00 0.00 0.00 0.00 176.54 176.91 2c9d n GLY 47 N 0.86 0.75 3.30 0.00 0.00 -0.84 -3.77 105.19 105.51 2c9d n GLY 47 Ca 0.13 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 2c9d n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c9d s LEU 48 N 0.00 5.84 0.35 0.99 1.43 -0.58 -4.79 118.68 121.92 2c9d s LEU 48 Ca 0.00 -1.68 0.19 0.00 -1.03 0.00 0.00 54.13 51.61 2c9d s LEU 48 Cb 0.00 -2.14 0.18 0.00 0.03 0.00 0.00 46.19 44.27 2c9d s LEU 48 CO 0.00 -0.74 1.49 0.44 0.23 0.00 0.00 176.35 177.77 2c9d h ASP 49 N 8.71 0.00 -2.14 2.29 3.32 -1.87 -3.11 116.42 123.62 2c9d h ASP 49 Ca -0.27 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.28 2c9d h ASP 49 Cb 1.09 0.00 -0.34 0.00 0.22 0.00 0.00 39.33 40.30 2c9d h ASP 49 CO 0.93 0.25 -0.87 -0.62 -1.72 0.00 0.00 179.24 177.21 2c9d s ASP 50 N -6.28 1.09 0.66 6.45 -1.08 -1.26 -4.94 116.67 111.32 2c9d s ASP 50 Ca 0.05 -2.65 -0.11 0.00 -0.52 0.00 0.00 52.55 49.32 2c9d s ASP 50 Cb 0.06 0.02 -0.01 0.00 -1.46 0.00 0.00 42.92 41.53 2c9d s ASP 50 CO 0.71 -0.17 1.05 -2.84 0.52 0.00 0.00 175.17 174.44 2c9d s PRO 51 N 0.40 3.24 -0.22 4.34 0.02 -1.26 -5.01 135.00 136.51 2c9d s PRO 51 Ca 0.30 0.74 -0.29 0.00 0.02 0.00 0.00 61.00 61.76 2c9d s PRO 51 Cb -0.01 -2.04 0.00 0.00 0.02 0.00 0.00 34.50 32.47 2c9d s PRO 51 CO -0.14 -0.83 1.10 0.99 -0.33 0.00 0.00 177.00 177.80 2c9d s THR 52 N -3.18 4.56 -0.16 0.99 2.01 -1.01 -4.95 115.64 113.91 2c9d s THR 52 Ca 0.57 1.88 -0.01 0.00 0.31 0.00 0.00 61.69 64.44 2c9d s THR 52 Cb -0.12 -4.23 -0.01 0.00 0.01 0.00 0.00 72.50 68.15 2c9d s THR 52 CO 0.54 -0.19 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.48 2c9d s VAL 53 N 3.32 3.02 -0.03 3.82 1.01 -1.26 0.58 120.40 130.85 2c9d s VAL 53 Ca 0.47 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.82 2c9d s VAL 53 Cb -0.17 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 33.92 2c9d s VAL 53 CO 0.09 0.50 -0.09 -0.69 0.00 0.00 0.00 175.10 174.91 2c9d s VAL 54 N 0.73 0.80 -0.04 2.92 1.01 0.07 -4.99 120.40 120.90 2c9d s VAL 54 Ca -0.05 -0.36 -0.02 0.00 0.00 0.00 0.00 61.98 61.54 2c9d s VAL 54 Cb -0.15 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.48 2c9d s VAL 54 CO 0.02 0.25 0.10 -0.13 0.00 0.00 0.00 175.10 175.34 2c9d s ARG 55 N 0.22 3.19 0.33 2.72 1.81 -1.26 -1.85 118.95 124.12 2c9d s ARG 55 Ca -0.04 -0.38 0.04 0.00 -1.72 0.00 0.00 55.73 53.63 2c9d s ARG 55 Cb -0.09 -2.95 -0.07 0.00 -0.45 0.00 0.00 34.95 31.39 2c9d s ARG 55 CO 0.01 0.68 0.05 0.14 -0.68 0.00 0.00 175.30 175.50 2c9d s VAL 56 N -1.15 1.27 0.02 3.52 -7.23 -0.82 -4.95 120.40 111.06 2c9d s VAL 56 Ca 0.21 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.31 2c9d s VAL 56 Cb -0.12 -2.82 -0.30 0.00 0.56 0.00 0.00 36.38 33.70 2c9d s VAL 56 CO 0.11 0.00 0.93 0.25 -0.31 0.00 0.00 175.10 176.08 2c9d h LEU 57 N 2.08 0.52 -8.45 1.32 5.85 -1.95 -1.67 115.31 113.01 2c9d h LEU 57 Ca -0.41 -0.64 -0.19 0.00 0.84 0.00 0.00 57.88 57.47 2c9d h LEU 57 Cb 1.24 -0.17 -0.15 0.00 0.37 0.00 0.00 40.66 41.96 2c9d h LEU 57 CO 0.71 1.52 -0.62 -0.83 -0.34 0.00 0.00 178.44 178.88 2c9d s GLY 58 N -4.84 1.09 0.28 3.75 0.00 -1.26 -3.41 107.32 102.93 2c9d s GLY 58 Ca -0.09 -1.50 0.01 0.00 0.00 0.00 0.00 44.72 43.14 2c9d s GLY 58 CO 0.88 -1.34 1.76 0.00 0.00 0.00 0.00 173.10 174.40 2c9d h ALA 59 N 2.77 1.14 0.00 3.20 0.00 -1.94 -2.74 119.26 121.69 2c9d h ALA 59 Ca -0.35 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.26 2c9d h ALA 59 Cb 1.22 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 2c9d h ALA 59 CO 0.56 0.54 -0.04 0.82 0.00 0.00 0.00 179.25 181.14 2c9d h ILE 60 N 0.55 0.75 0.00 0.00 1.08 -1.97 -1.85 117.51 116.07 2c9d h ILE 60 Ca 0.10 -0.15 0.00 0.00 -0.39 0.00 0.00 64.86 64.42 2c9d h ILE 60 Cb 0.54 1.09 0.00 0.00 -3.07 0.00 0.00 36.82 35.38 2c9d h ILE 60 CO 0.03 0.04 0.00 -0.62 -0.69 0.00 0.00 178.15 176.91 2c9d n GLU 61 N -4.08 0.16 0.06 2.37 4.71 -1.03 -4.23 120.64 118.60 2c9d n GLU 61 Ca -0.03 0.01 -0.13 0.00 -0.01 0.00 0.00 57.16 57.00 2c9d n GLU 61 Cb 0.12 -1.50 -0.09 0.00 -1.01 0.00 0.00 31.44 28.97 2c9d n GLU 61 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 2c9d h ILE 62 N 0.00 1.04 -0.57 -3.67 2.04 -1.41 -3.29 117.51 111.65 2c9d h ILE 62 Ca 0.00 -0.68 0.11 0.00 1.00 0.00 0.00 64.86 65.30 2c9d h ILE 62 Cb 0.41 1.47 -0.09 0.00 -0.74 0.00 0.00 36.82 37.87 2c9d h ILE 62 CO 0.00 0.16 0.04 -0.65 0.00 0.00 0.00 178.15 177.70 2c9d h PRO 63 N -0.48 0.16 0.00 2.37 0.11 -1.77 -1.60 132.00 130.79 2c9d h PRO 63 Ca -0.02 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.04 2c9d h PRO 63 Cb 0.39 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 2c9d h PRO 63 CO 0.03 0.10 -0.19 -0.24 -0.21 0.00 0.00 178.00 177.49 2c9d h VAL 64 N 0.16 0.96 0.00 3.15 3.04 -1.84 -1.98 116.25 119.74 2c9d h VAL 64 Ca 0.30 -0.70 -0.24 0.00 -1.01 0.00 0.00 66.70 65.05 2c9d h VAL 64 Cb 0.46 1.40 -0.04 0.00 -2.01 0.00 0.00 31.29 31.10 2c9d h VAL 64 CO -0.45 0.19 -1.30 0.58 -1.01 0.00 0.00 177.57 175.58 2c9d h VAL 65 N 0.00 1.27 -0.13 1.51 2.07 -1.43 -3.26 116.25 116.28 2c9d h VAL 65 Ca -0.00 -3.02 -0.14 0.00 0.82 0.00 0.00 66.70 64.36 2c9d h VAL 65 Cb 0.38 2.62 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 2c9d h VAL 65 CO 0.02 0.72 -0.52 0.00 0.02 0.00 0.00 177.57 177.82 2c9d h ALA 66 N 1.03 0.87 -0.52 1.67 0.00 -0.90 -2.14 119.26 119.28 2c9d h ALA 66 Ca -0.13 -0.49 0.02 0.00 0.00 0.00 0.00 54.91 54.31 2c9d h ALA 66 Cb 1.85 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.52 2c9d h ALA 66 CO 0.10 0.67 0.32 0.37 0.00 0.00 0.00 179.25 180.72 2c9d h GLN 67 N 0.28 0.62 -0.43 0.00 4.15 -1.45 -0.18 115.11 118.10 2c9d h GLN 67 Ca 0.01 -0.04 -0.12 0.00 0.77 0.00 0.00 58.65 59.27 2c9d h GLN 67 Cb 1.01 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.55 2c9d h GLN 67 CO 0.09 0.41 -0.19 1.49 -1.93 0.00 0.00 178.83 178.70 2c9d h GLU 68 N 0.64 0.89 0.00 1.69 4.57 -1.58 -3.03 114.58 117.76 2c9d h GLU 68 Ca 0.20 -0.38 -0.05 0.00 -1.18 0.00 0.00 59.36 57.95 2c9d h GLU 68 Cb -0.01 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.54 2c9d h GLU 68 CO -0.08 1.03 -0.26 -0.07 -1.18 0.00 0.00 179.01 178.46 2c9d h LEU 69 N 0.72 0.00 -0.69 1.64 3.38 -1.16 -2.93 115.31 116.27 2c9d h LEU 69 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2c9d h LEU 69 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2c9d h LEU 69 CO 0.06 0.26 0.00 0.00 0.09 0.00 0.00 178.44 178.84 2c9d h ALA 70 N 1.74 1.00 0.00 1.53 0.00 -0.90 -2.98 119.26 119.66 2c9d h ALA 70 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2c9d h ALA 70 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2c9d h ALA 70 CO 0.03 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.82 2c9d n ARG 71 N -2.35 0.49 -0.08 0.00 1.74 -1.11 -3.95 116.66 111.40 2c9d n ARG 71 Ca 0.02 0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 2c9d n ARG 71 Cb 0.27 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.21 2c9d n ARG 71 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2c9d n ASN 72 N -1.19 0.00 -4.08 0.55 4.05 -1.13 -5.12 115.26 108.33 2c9d n ASN 72 Ca 0.14 -1.09 -0.08 0.00 0.45 0.00 0.00 54.58 54.00 2c9d n ASN 72 Cb 0.16 -0.02 -0.10 0.00 1.23 0.00 0.00 39.78 41.05 2c9d n ASN 72 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 177.26 173.21 2c9d s HIS 73 N 0.00 0.52 -0.73 1.20 3.76 -1.17 -5.01 115.29 113.86 2c9d s HIS 73 Ca 0.00 -0.99 0.23 0.00 -0.15 0.00 0.00 55.06 54.15 2c9d s HIS 73 Cb 0.00 -0.38 0.18 0.00 1.11 0.00 0.00 32.58 33.49 2c9d s HIS 73 CO 0.00 -0.34 1.15 -0.25 -0.85 0.00 0.00 174.74 174.45 2c9d n ASP 74 N 0.28 0.63 -3.66 1.40 8.00 -0.06 -4.85 116.55 118.29 2c9d n ASP 74 Ca -0.15 -0.22 -0.14 0.00 0.71 0.00 0.00 54.79 54.99 2c9d n ASP 74 Cb 0.60 0.59 -0.08 0.00 -0.02 0.00 0.00 41.12 42.21 2c9d n ASP 74 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2c9d s ALA 75 N -3.13 -1.59 -0.05 2.24 0.00 -1.14 -4.41 121.76 113.68 2c9d s ALA 75 Ca 0.06 1.82 0.05 0.00 0.00 0.00 0.00 51.96 53.89 2c9d s ALA 75 Cb 0.15 -1.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.21 2c9d s ALA 75 CO 0.77 -0.30 -0.20 0.08 0.00 0.00 0.00 175.76 176.11 2c9d s VAL 76 N 0.38 1.66 -0.18 0.00 1.01 -0.81 -1.70 120.40 120.76 2c9d s VAL 76 Ca -0.00 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 2c9d s VAL 76 Cb -0.04 -1.42 -0.01 0.00 0.00 0.00 0.00 36.38 34.90 2c9d s VAL 76 CO 0.00 0.47 -0.08 -0.69 0.00 0.00 0.00 175.10 174.80 2c9d s VAL 77 N -0.01 3.27 -0.18 2.92 1.01 -0.32 -0.67 120.40 126.41 2c9d s VAL 77 Ca -0.04 -0.55 -0.07 0.00 0.00 0.00 0.00 61.98 61.32 2c9d s VAL 77 Cb -0.13 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 2c9d s VAL 77 CO 0.03 0.47 0.04 0.00 0.00 0.00 0.00 175.10 175.64 2c9d s ALA 78 N 0.94 3.29 -0.02 5.51 0.00 -0.91 -1.22 121.76 129.36 2c9d s ALA 78 Ca -0.01 -0.79 0.04 0.00 0.00 0.00 0.00 51.96 51.20 2c9d s ALA 78 Cb -0.15 -1.85 -0.01 0.00 0.00 0.00 0.00 23.12 21.11 2c9d s ALA 78 CO 0.00 0.13 -0.14 -0.51 0.00 0.00 0.00 175.76 175.24 2c9d s LEU 79 N 0.47 1.98 0.00 0.00 1.43 -0.46 -0.83 118.68 121.27 2c9d s LEU 79 Ca 0.02 -0.27 0.00 0.00 -1.03 0.00 0.00 54.13 52.85 2c9d s LEU 79 Cb -0.13 -0.76 0.00 0.00 0.03 0.00 0.00 46.19 45.33 2c9d s LEU 79 CO 0.01 0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.36 2c9d n GLY 80 N 2.84 0.22 2.89 -3.19 0.00 -1.16 -1.66 105.19 105.14 2c9d n GLY 80 Ca -0.15 -0.95 -0.21 0.00 0.00 0.00 0.00 46.02 44.71 2c9d n GLY 80 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c9d s VAL 81 N -2.00 0.60 -0.19 1.61 1.01 -1.26 -0.15 120.40 120.02 2c9d s VAL 81 Ca 0.00 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 61.86 2c9d s VAL 81 Cb 0.00 -0.63 0.03 0.00 0.00 0.00 0.00 36.38 35.78 2c9d s VAL 81 CO 0.00 0.25 -0.17 -0.69 0.00 0.00 0.00 175.10 174.49 2c9d s VAL 82 N 1.08 2.00 -0.12 2.92 1.01 -0.09 -4.91 120.40 122.29 2c9d s VAL 82 Ca -0.08 -1.04 -0.01 0.00 0.00 0.00 0.00 61.98 60.84 2c9d s VAL 82 Cb -0.14 -1.89 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 2c9d s VAL 82 CO -0.01 0.40 -0.08 -0.63 0.00 0.00 0.00 175.10 174.78 2c9d s ILE 83 N 1.28 3.53 0.46 2.22 1.01 -1.26 -2.42 121.20 126.02 2c9d s ILE 83 Ca 0.02 -0.50 -0.24 0.00 0.00 0.00 0.00 60.65 59.92 2c9d s ILE 83 Cb -0.14 -2.50 -0.07 0.00 0.01 0.00 0.00 42.46 39.75 2c9d s ILE 83 CO -0.11 0.53 1.33 -0.60 0.00 0.00 0.00 174.94 176.09 2c9d s ARG 84 N 0.06 3.67 0.00 2.79 3.52 -1.11 -4.96 118.95 122.93 2c9d s ARG 84 Ca -0.02 2.20 0.00 0.00 -0.13 0.00 0.00 55.73 57.78 2c9d s ARG 84 Cb -0.14 -2.57 0.00 0.00 -1.56 0.00 0.00 34.95 30.68 2c9d s ARG 84 CO 0.03 -0.76 0.00 0.41 -0.81 0.00 0.00 175.30 174.18 2c9d n GLY 85 N 0.63 3.98 0.15 8.12 0.00 -1.26 -4.93 105.19 111.88 2c9d n GLY 85 Ca 0.06 -1.58 0.08 0.00 0.00 0.00 0.00 46.02 44.58 2c9d n GLY 85 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2c9d n GLN 86 N 0.00 1.59 -4.35 1.61 -0.06 -1.26 -4.99 117.38 109.91 2c9d n GLN 86 Ca 0.00 -0.32 -0.24 0.00 -2.00 0.00 0.00 57.00 54.44 2c9d n GLN 86 Cb 0.00 -1.29 -0.09 0.00 -4.06 0.00 0.00 30.24 24.81 2c9d n GLN 86 CO 0.00 0.00 0.00 0.95 -0.20 0.00 0.00 177.06 177.81 2c9d s THR 87 N -2.35 2.77 -1.91 1.69 -4.23 -1.26 -5.01 115.64 105.35 2c9d s THR 87 Ca 0.09 -2.04 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 2c9d s THR 87 Cb 0.13 -2.72 0.00 0.00 1.34 0.00 0.00 72.50 71.25 2c9d s THR 87 CO 0.58 -0.27 0.52 -0.81 -0.54 0.00 0.00 174.62 174.10 2c9d n PRO 88 N -0.88 0.54 -0.34 3.99 -0.04 -1.26 -3.77 135.00 133.25 2c9d n PRO 88 Ca -0.05 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.38 2c9d n PRO 88 Cb 0.61 -1.02 0.09 0.00 -0.04 0.00 0.00 33.50 33.14 2c9d n PRO 88 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2c9d h HIS 89 N 0.04 1.16 -0.84 0.54 2.76 -1.98 -2.65 115.15 114.18 2c9d h HIS 89 Ca 0.00 0.02 0.21 0.00 -2.20 0.00 0.00 60.37 58.40 2c9d h HIS 89 Cb 0.02 -0.39 -0.13 0.00 1.55 0.00 0.00 27.41 28.47 2c9d h HIS 89 CO 0.00 0.74 0.24 0.35 -1.30 0.00 0.00 177.93 177.96 2c9d h PHE 90 N 1.24 0.37 -0.24 5.26 3.57 -1.93 -0.62 116.94 124.59 2c9d h PHE 90 Ca 0.33 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.87 2c9d h PHE 90 Cb -0.12 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 2c9d h PHE 90 CO -0.00 -0.15 0.12 -0.44 -2.23 0.00 0.00 178.31 175.60 2c9d h ASP 91 N 0.26 0.28 0.79 0.41 3.32 -1.77 -3.05 116.42 116.65 2c9d h ASP 91 Ca 0.51 -0.02 -0.16 0.00 0.02 0.00 0.00 57.03 57.39 2c9d h ASP 91 Cb 0.98 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.43 2c9d h ASP 91 CO -0.60 0.24 -1.31 1.88 -1.72 0.00 0.00 179.24 177.73 2c9d h TYR 92 N 0.33 0.00 -0.15 4.55 0.05 -1.20 -2.87 116.97 117.68 2c9d h TYR 92 Ca 0.09 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.85 2c9d h TYR 92 Cb 0.03 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.77 2c9d h TYR 92 CO 0.00 0.58 0.02 0.28 -1.05 0.00 0.00 178.16 177.99 2c9d h VAL 93 N 0.00 1.22 -0.12 -2.88 2.07 -1.40 -2.92 116.25 112.23 2c9d h VAL 93 Ca -0.14 -0.72 -0.11 0.00 0.82 0.00 0.00 66.70 66.55 2c9d h VAL 93 Cb 1.57 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 32.73 2c9d h VAL 93 CO 0.05 0.21 -0.41 0.00 0.02 0.00 0.00 177.57 177.44 2c9d h ASP 95 N 0.22 0.49 -0.06 0.00 5.19 -1.51 -2.08 116.42 118.67 2c9d h ASP 95 Ca 0.02 -0.02 0.01 0.00 -0.62 0.00 0.00 57.03 56.43 2c9d h ASP 95 Cb 0.82 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 40.20 2c9d h ASP 95 CO 0.06 0.36 -0.01 0.00 -3.12 0.00 0.00 179.24 176.53 2c9d h ALA 96 N 1.15 0.04 -0.57 3.45 0.00 -1.40 -2.11 119.26 119.82 2c9d h ALA 96 Ca 0.16 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.12 2c9d h ALA 96 Cb -0.06 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 2c9d h ALA 96 CO -0.03 -0.49 0.34 0.28 0.00 0.00 0.00 179.25 179.34 2c9d h VAL 97 N 0.01 1.03 0.13 0.00 2.07 -1.43 0.62 116.25 118.68 2c9d h VAL 97 Ca 0.03 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 67.33 2c9d h VAL 97 Cb 0.04 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 2c9d h VAL 97 CO -0.05 0.12 -0.15 0.74 0.02 0.00 0.00 177.57 178.25 2c9d h THR 98 N 0.65 0.66 -0.56 2.57 2.02 -1.25 -1.96 112.91 115.05 2c9d h THR 98 Ca 0.24 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.33 2c9d h THR 98 Cb 0.07 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 2c9d h THR 98 CO -0.12 0.00 0.01 1.56 0.37 0.00 0.00 175.52 177.34 2c9d h GLN 99 N -0.32 0.99 0.53 6.66 4.20 -1.12 -2.87 115.11 123.17 2c9d h GLN 99 Ca 0.01 -0.31 -0.03 0.00 0.06 0.00 0.00 58.65 58.38 2c9d h GLN 99 Cb 0.31 -0.09 0.01 0.00 0.30 0.00 0.00 27.48 28.00 2c9d h GLN 99 CO -0.05 0.98 -0.25 0.78 -0.67 0.00 0.00 178.83 179.62 2c9d h GLY 100 N 0.87 -0.74 0.98 3.46 0.00 -0.81 -2.30 103.07 104.53 2c9d h GLY 100 Ca 0.16 0.27 -0.02 0.00 0.00 0.00 0.00 47.33 47.75 2c9d h GLY 100 CO 0.03 -0.27 0.28 1.41 0.00 0.00 0.00 176.54 177.99 2c9d h LEU 101 N -0.82 0.69 -0.70 3.11 3.38 -1.42 -1.26 115.31 118.29 2c9d h LEU 101 Ca -0.07 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 57.80 2c9d h LEU 101 Cb 0.59 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 2c9d h LEU 101 CO 0.12 0.61 0.46 0.74 0.09 0.00 0.00 178.44 180.45 2c9d h THR 102 N 0.73 1.15 -0.62 0.22 2.02 -1.56 -1.70 112.91 113.16 2c9d h THR 102 Ca 0.19 -0.32 -0.04 0.00 0.77 0.00 0.00 66.41 67.02 2c9d h THR 102 Cb 0.08 0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 66.62 2c9d h THR 102 CO -0.03 0.17 0.24 -0.09 0.37 0.00 0.00 175.52 176.18 2c9d h ARG 103 N 0.92 0.93 -0.30 6.66 2.43 -1.05 -3.05 114.38 120.91 2c9d h ARG 103 Ca 0.26 -0.17 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 2c9d h ARG 103 Cb -0.07 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.32 2c9d h ARG 103 CO -0.07 0.79 0.07 0.28 -1.51 0.00 0.00 179.97 179.53 2c9d h VAL 104 N 0.86 1.22 -0.67 0.20 2.07 -0.87 -1.94 116.25 117.13 2c9d h VAL 104 Ca 0.20 -0.74 0.08 0.00 0.82 0.00 0.00 66.70 67.07 2c9d h VAL 104 Cb 0.21 1.13 -0.07 0.00 -1.52 0.00 0.00 31.29 31.05 2c9d h VAL 104 CO -0.02 0.24 0.33 0.77 0.02 0.00 0.00 177.57 178.92 2c9d h SER 105 N 0.33 0.43 0.98 0.57 4.64 -1.30 -2.13 113.55 117.06 2c9d h SER 105 Ca 0.09 0.06 -0.21 0.00 -0.47 0.00 0.00 61.79 61.26 2c9d h SER 105 Cb 0.30 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.34 2c9d h SER 105 CO 0.00 0.26 -0.99 -0.07 -0.87 0.00 0.00 176.83 175.16 2c9d h LEU 106 N 0.57 0.01 -0.58 5.97 3.38 -1.46 -0.20 115.31 123.00 2c9d h LEU 106 Ca 0.32 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.25 2c9d h LEU 106 Cb 0.32 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 2c9d h LEU 106 CO -0.25 0.99 0.23 0.44 0.09 0.00 0.00 178.44 179.94 2c9d h ASP 107 N 0.00 0.81 -0.02 -0.43 3.45 -1.11 -3.28 116.42 115.84 2c9d h ASP 107 Ca -0.01 -0.17 0.00 0.00 0.43 0.00 0.00 57.03 57.27 2c9d h ASP 107 Cb 1.74 -0.21 0.00 0.00 -0.56 0.00 0.00 39.33 40.30 2c9d h ASP 107 CO 0.13 0.76 -0.35 -1.54 -1.57 0.00 0.00 179.24 176.67 2c9d n SER 108 N -4.47 2.09 -3.82 6.45 3.41 -0.82 -4.99 113.62 111.47 2c9d n SER 108 Ca 0.03 -1.55 -0.25 0.00 -0.26 0.00 0.00 58.87 56.85 2c9d n SER 108 Cb 0.17 0.39 0.02 0.00 -0.26 0.00 0.00 64.21 64.52 2c9d n SER 108 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2c9d n SER 109 N 0.20 -2.18 -3.95 4.04 7.64 -0.16 -5.00 113.62 114.21 2c9d n SER 109 Ca 0.09 -0.84 -0.19 0.00 1.01 0.00 0.00 58.87 58.94 2c9d n SER 109 Cb 0.45 -3.82 -0.16 0.00 -1.01 0.00 0.00 64.21 59.68 2c9d n SER 109 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2c9d s THR 110 N -3.59 0.60 -0.09 0.44 2.01 -0.75 -5.04 115.64 109.20 2c9d s THR 110 Ca 0.22 -0.24 -0.29 0.00 0.31 0.00 0.00 61.69 61.69 2c9d s THR 110 Cb -0.11 -0.56 -0.05 0.00 0.01 0.00 0.00 72.50 71.79 2c9d s THR 110 CO 0.83 0.20 1.76 -2.84 -0.69 0.00 0.00 174.62 173.88 2c9d s PRO 111 N 0.37 3.98 -0.66 4.92 0.02 -1.26 -4.41 135.00 137.95 2c9d s PRO 111 Ca -0.05 2.12 -0.06 0.00 0.02 0.00 0.00 61.00 63.03 2c9d s PRO 111 Cb -0.09 -4.07 0.17 0.00 0.02 0.00 0.00 34.50 30.53 2c9d s PRO 111 CO 0.00 -1.10 0.52 0.42 -0.33 0.00 0.00 177.00 176.51 2c9d s ILE 112 N 4.81 4.27 0.34 2.83 -1.09 -1.26 -1.93 121.20 129.17 2c9d s ILE 112 Ca 0.78 -2.70 -0.29 0.00 -2.23 0.00 0.00 60.65 56.21 2c9d s ILE 112 Cb -0.33 -3.74 -0.11 0.00 -1.58 0.00 0.00 42.46 36.70 2c9d s ILE 112 CO 0.32 -0.91 1.54 0.00 -1.23 0.00 0.00 174.94 174.67 2c9d s ALA 113 N 0.16 3.65 -0.46 9.38 0.00 0.15 -4.91 121.76 129.74 2c9d s ALA 113 Ca 0.16 1.59 -0.14 0.00 0.00 0.00 0.00 51.96 53.57 2c9d s ALA 113 Cb -0.18 -3.63 0.07 0.00 0.00 0.00 0.00 23.12 19.38 2c9d s ALA 113 CO -0.05 -1.05 0.36 1.21 0.00 0.00 0.00 175.76 176.24 2c9d s ASN 114 N 0.14 6.03 -0.32 0.00 3.84 -1.26 -2.13 114.94 121.24 2c9d s ASN 114 Ca 0.57 -1.35 0.07 0.00 0.21 0.00 0.00 52.86 52.36 2c9d s ASN 114 Cb -0.47 -2.14 0.45 0.00 -0.55 0.00 0.00 41.25 38.54 2c9d s ASN 114 CO 0.57 -0.61 1.17 0.61 -2.79 0.00 0.00 177.10 176.05 2c9d n GLY 115 N 5.14 6.14 3.45 1.21 0.00 -0.01 -4.88 105.19 116.23 2c9d n GLY 115 Ca -0.12 -2.62 -0.41 0.00 0.00 0.00 0.00 46.02 42.87 2c9d n GLY 115 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c9d s VAL 116 N -4.74 4.99 0.35 1.61 1.01 -1.24 -2.98 120.40 119.40 2c9d s VAL 116 Ca 0.49 -0.61 -0.28 0.00 0.00 0.00 0.00 61.98 61.58 2c9d s VAL 116 Cb 0.41 -3.72 -0.10 0.00 0.00 0.00 0.00 36.38 32.97 2c9d s VAL 116 CO -0.01 -0.19 1.31 -0.76 0.00 0.00 0.00 175.10 175.46 2c9d s LEU 117 N 1.64 4.38 -0.32 3.92 1.43 0.79 -4.93 118.68 125.60 2c9d s LEU 117 Ca 0.04 2.70 -0.02 0.00 -1.03 0.00 0.00 54.13 55.82 2c9d s LEU 117 Cb -0.19 -3.70 0.11 0.00 0.03 0.00 0.00 46.19 42.45 2c9d s LEU 117 CO 0.09 -0.61 0.15 0.42 0.23 0.00 0.00 176.35 176.63 2c9d s THR 118 N -1.16 0.26 0.39 5.49 -4.23 -1.26 -0.91 115.64 114.22 2c9d s THR 118 Ca 0.50 -1.20 0.07 0.00 -1.18 0.00 0.00 61.69 59.89 2c9d s THR 118 Cb -0.40 -1.21 -0.08 0.00 1.34 0.00 0.00 72.50 72.15 2c9d s THR 118 CO 0.53 -0.78 -0.00 0.42 -0.54 0.00 0.00 174.62 174.25 2c9d s THR 119 N 1.68 1.95 -0.03 3.99 -4.23 -1.01 -5.03 115.64 112.95 2c9d s THR 119 Ca 0.12 -2.03 0.04 0.00 -1.18 0.00 0.00 61.69 58.63 2c9d s THR 119 Cb -0.18 -2.92 -0.25 0.00 1.34 0.00 0.00 72.50 70.49 2c9d s THR 119 CO -0.25 -0.03 0.72 0.78 -0.54 0.00 0.00 174.62 175.30 2c9d h ASN 120 N 1.85 0.20 -4.32 3.99 2.35 -1.95 -2.93 115.58 114.77 2c9d h ASN 120 Ca -0.43 -0.35 -0.34 0.00 -0.55 0.00 0.00 56.30 54.63 2c9d h ASN 120 Cb 1.24 -0.06 -0.14 0.00 0.05 0.00 0.00 38.32 39.40 2c9d h ASN 120 CO 0.78 1.30 -0.64 0.42 -1.65 0.00 0.00 177.43 177.64 2c9d s THR 121 N -2.61 0.73 0.26 2.81 -4.23 -1.26 -4.47 115.64 106.87 2c9d s THR 121 Ca -0.09 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.49 2c9d s THR 121 Cb 0.08 -2.37 -0.03 0.00 1.34 0.00 0.00 72.50 71.51 2c9d s THR 121 CO 0.82 -0.26 1.59 -0.08 -0.54 0.00 0.00 174.62 176.15 2c9d h GLU 122 N 2.52 0.14 -0.44 3.99 4.81 -1.97 -3.14 114.58 120.49 2c9d h GLU 122 Ca -0.38 -0.09 0.01 0.00 -0.13 0.00 0.00 59.36 58.77 2c9d h GLU 122 Cb 1.22 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.59 2c9d h GLU 122 CO 0.63 0.69 0.28 1.49 -0.73 0.00 0.00 179.01 181.37 2c9d h GLU 123 N 0.10 0.56 -0.74 1.92 4.22 -1.99 -2.00 114.58 116.65 2c9d h GLU 123 Ca -0.01 -0.03 0.07 0.00 0.08 0.00 0.00 59.36 59.47 2c9d h GLU 123 Cb 1.08 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 30.14 2c9d h GLU 123 CO 0.09 0.37 0.42 1.96 -2.18 0.00 0.00 179.01 179.66 2c9d h GLN 124 N 0.58 0.72 -0.32 1.92 4.20 -1.97 -1.47 115.11 118.76 2c9d h GLN 124 Ca 0.17 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.80 2c9d h GLN 124 Cb -0.05 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.56 2c9d h GLN 124 CO -0.05 0.48 0.07 0.00 -0.67 0.00 0.00 178.83 178.67 2c9d h ALA 125 N 1.39 0.43 -0.60 3.87 0.00 -1.48 -2.96 119.26 119.91 2c9d h ALA 125 Ca 0.34 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.10 2c9d h ALA 125 Cb 0.24 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2c9d h ALA 125 CO -0.21 0.10 0.40 -0.07 0.00 0.00 0.00 179.25 179.47 2c9d h LEU 126 N 0.37 0.61 -0.39 0.00 3.38 -0.96 -2.38 115.31 115.93 2c9d h LEU 126 Ca 0.10 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2c9d h LEU 126 Cb 0.30 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2c9d h LEU 126 CO 0.00 0.42 0.00 -0.67 0.09 0.00 0.00 178.44 178.28 2c9d n ASP 127 N -4.46 0.60 -0.06 -0.43 -0.08 -0.59 -3.26 116.55 108.26 2c9d n ASP 127 Ca 0.07 0.61 0.08 0.00 -1.51 0.00 0.00 54.79 54.04 2c9d n ASP 127 Cb 0.13 -0.75 0.11 0.00 2.34 0.00 0.00 41.12 42.94 2c9d n ASP 127 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2c9d n ARG 128 N -2.12 1.65 -0.01 -0.67 1.74 -0.90 -1.71 116.66 114.64 2c9d n ARG 128 Ca 0.03 -2.30 0.08 0.00 -0.77 0.00 0.00 57.85 54.90 2c9d n ARG 128 Cb 0.28 -1.37 -0.13 0.00 -1.02 0.00 0.00 32.46 30.23 2c9d n ARG 128 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2c9d n ALA 129 N -1.20 2.61 -0.25 7.54 0.00 -1.18 -2.33 120.51 125.70 2c9d n ALA 129 Ca 0.12 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2c9d n ALA 129 Cb 0.55 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.44 2c9d n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c9d n GLY 130 N 1.57 1.60 3.89 0.00 0.00 -0.95 -3.95 105.19 107.34 2c9d n GLY 130 Ca -0.03 -0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 2c9d n GLY 130 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c9d s LEU 131 N -0.03 2.79 0.21 0.99 1.43 -1.26 -4.91 118.68 117.91 2c9d s LEU 131 Ca 0.00 1.02 -0.01 0.00 -1.03 0.00 0.00 54.13 54.11 2c9d s LEU 131 Cb 0.00 -3.73 0.47 0.00 0.03 0.00 0.00 46.19 42.96 2c9d s LEU 131 CO 0.00 -1.50 1.11 -2.65 0.23 0.00 0.00 176.35 173.54 2c9d n PRO 132 N -3.09 -0.06 -0.65 1.29 -0.02 -1.26 -0.87 135.00 130.35 2c9d n PRO 132 Ca 0.07 1.08 0.00 0.00 -2.02 0.00 0.00 63.50 62.63 2c9d n PRO 132 Cb 0.58 -1.67 0.21 0.00 -0.02 0.00 0.00 33.50 32.60 2c9d n PRO 132 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2c9d n THR 133 N -5.03 2.43 -2.76 3.45 -1.04 -1.26 -5.03 114.28 105.04 2c9d n THR 133 Ca 0.15 -2.46 -0.32 0.00 -2.04 0.00 0.00 64.05 59.38 2c9d n THR 133 Cb 0.48 -0.30 -0.05 0.00 -1.82 0.00 0.00 70.33 68.64 2c9d n THR 133 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2c9d s SER 134 N -2.38 6.78 0.19 8.00 0.01 -0.04 -4.99 113.70 121.26 2c9d s SER 134 Ca 0.43 1.53 0.09 0.00 1.31 0.00 0.00 55.95 59.31 2c9d s SER 134 Cb 0.38 -2.48 0.05 0.00 0.21 0.00 0.00 66.02 64.18 2c9d s SER 134 CO 0.03 -0.40 1.43 0.00 0.41 0.00 0.00 173.24 174.71 2c9d h ALA 135 N 1.63 0.64 -2.93 1.44 0.00 -1.67 -3.47 119.26 114.91 2c9d h ALA 135 Ca -0.48 -0.75 -0.07 0.00 0.00 0.00 0.00 54.91 53.61 2c9d h ALA 135 Cb 1.18 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 2c9d h ALA 135 CO 0.62 1.03 0.03 -1.83 0.00 0.00 0.00 179.25 179.10 2c9d s GLU 136 N -3.12 1.86 -0.31 0.00 4.04 -1.13 -5.07 118.70 114.97 2c9d s GLU 136 Ca 0.00 -1.37 -0.02 0.00 0.04 0.00 0.00 54.97 53.62 2c9d s GLU 136 Cb 0.11 0.53 0.11 0.00 0.02 0.00 0.00 34.13 34.90 2c9d s GLU 136 CO 0.79 -0.82 0.14 0.34 -1.84 0.00 0.00 175.26 173.87 2c9d s ASP 137 N -3.06 3.62 0.42 0.83 3.68 -1.26 -2.24 116.67 118.66 2c9d s ASP 137 Ca 0.20 -1.58 0.19 0.00 2.13 0.00 0.00 52.55 53.49 2c9d s ASP 137 Cb -0.03 -0.55 0.95 0.00 -1.45 0.00 0.00 42.92 41.84 2c9d s ASP 137 CO 0.12 -0.41 1.88 0.11 0.13 0.00 0.00 175.17 177.01 2c9d h LYS 138 N 8.04 0.00 -0.66 4.34 1.57 -1.71 -2.56 116.57 125.60 2c9d h LYS 138 Ca -0.14 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.62 2c9d h LYS 138 Cb 1.00 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.28 2c9d h LYS 138 CO 0.43 0.28 0.33 0.78 -0.57 0.00 0.00 179.45 180.70 2c9d h GLY 139 N 1.27 0.99 0.52 3.86 0.00 -1.84 -1.52 103.07 106.35 2c9d h GLY 139 Ca -0.00 -0.46 -0.07 0.00 0.00 0.00 0.00 47.33 46.81 2c9d h GLY 139 CO 0.04 0.44 -0.24 0.00 0.00 0.00 0.00 176.54 176.78 2c9d h ALA 140 N 1.44 0.06 -0.58 3.60 0.00 -1.68 -3.04 119.26 119.05 2c9d h ALA 140 Ca 0.23 -0.44 0.06 0.00 0.00 0.00 0.00 54.91 54.77 2c9d h ALA 140 Cb 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 2c9d h ALA 140 CO -0.03 0.08 0.28 1.96 0.00 0.00 0.00 179.25 181.54 2c9d h GLN 141 N -0.40 0.52 -0.54 0.00 4.20 -1.43 -2.07 115.11 115.38 2c9d h GLN 141 Ca -0.02 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 2c9d h GLN 141 Cb 0.94 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.58 2c9d h GLN 141 CO 0.05 0.34 0.33 0.00 -0.67 0.00 0.00 178.83 178.88 2c9d h ALA 142 N 1.34 0.69 -0.54 3.87 0.00 -1.36 -1.56 119.26 121.70 2c9d h ALA 142 Ca 0.27 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 2c9d h ALA 142 Cb 0.22 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2c9d h ALA 142 CO -0.21 0.18 -0.12 1.15 0.00 0.00 0.00 179.25 180.25 2c9d h THR 143 N 0.73 1.27 -0.56 0.00 2.02 -1.38 -1.48 112.91 113.50 2c9d h THR 143 Ca 0.19 -1.29 0.01 0.00 0.77 0.00 0.00 66.41 66.10 2c9d h THR 143 Cb -0.01 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.34 2c9d h THR 143 CO -0.04 0.45 0.37 0.58 0.37 0.00 0.00 175.52 177.26 2c9d h VAL 144 N 0.91 1.14 -0.29 3.16 2.07 -1.22 -1.65 116.25 120.38 2c9d h VAL 144 Ca 0.14 -0.26 -0.11 0.00 0.82 0.00 0.00 66.70 67.29 2c9d h VAL 144 Cb 0.70 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 2c9d h VAL 144 CO 0.05 0.14 -0.25 0.00 0.02 0.00 0.00 177.57 177.52 2c9d h ALA 145 N 1.65 0.42 0.06 1.67 0.00 -0.76 -2.82 119.26 119.48 2c9d h ALA 145 Ca 0.21 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 2c9d h ALA 145 Cb -0.07 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2c9d h ALA 145 CO -0.05 0.40 -0.03 0.00 0.00 0.00 0.00 179.25 179.58 2c9d h ALA 146 N 0.71 -0.09 -0.59 0.00 0.00 -1.01 -2.59 119.26 115.69 2c9d h ALA 146 Ca 0.05 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2c9d h ALA 146 Cb 0.81 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 2c9d h ALA 146 CO 0.06 -0.39 0.19 -0.07 0.00 0.00 0.00 179.25 179.04 2c9d h LEU 147 N -0.40 0.82 -0.31 0.00 3.38 -1.40 -1.71 115.31 115.71 2c9d h LEU 147 Ca -0.01 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 2c9d h LEU 147 Cb 0.35 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2c9d h LEU 147 CO 0.01 0.77 -0.08 0.00 0.09 0.00 0.00 178.44 179.24 2c9d h ALA 148 N 1.34 0.42 -0.40 1.53 0.00 -1.55 -2.54 119.26 118.06 2c9d h ALA 148 Ca 0.20 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 2c9d h ALA 148 Cb 0.24 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2c9d h ALA 148 CO -0.01 0.25 -0.05 1.15 0.00 0.00 0.00 179.25 180.59 2c9d h THR 149 N 0.36 1.24 -0.59 0.00 2.02 -1.23 -2.01 112.91 112.70 2c9d h THR 149 Ca 0.08 -1.01 -0.02 0.00 0.77 0.00 0.00 66.41 66.23 2c9d h THR 149 Cb 0.57 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.94 2c9d h THR 149 CO 0.03 0.35 0.30 0.00 0.37 0.00 0.00 175.52 176.57 2c9d h ALA 150 N 1.31 0.76 -0.64 6.16 0.00 -1.28 -1.88 119.26 123.69 2c9d h ALA 150 Ca 0.12 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2c9d h ALA 150 Cb 0.47 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2c9d h ALA 150 CO 0.02 0.30 0.15 -0.07 0.00 0.00 0.00 179.25 179.66 2c9d h LEU 151 N 0.80 0.97 -0.11 0.00 3.38 -1.16 -1.79 115.31 117.40 2c9d h LEU 151 Ca 0.20 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2c9d h LEU 151 Cb 0.09 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 2c9d h LEU 151 CO -0.03 0.96 0.05 0.74 0.09 0.00 0.00 178.44 180.25 2c9d h THR 152 N 0.94 1.14 -0.81 0.22 2.02 -1.27 -2.22 112.91 112.93 2c9d h THR 152 Ca 0.20 -0.41 0.04 0.00 0.77 0.00 0.00 66.41 67.01 2c9d h THR 152 Cb 0.37 1.21 -0.05 0.00 -1.74 0.00 0.00 68.15 67.94 2c9d h THR 152 CO 0.00 0.12 0.53 -0.07 0.37 0.00 0.00 175.52 176.48 2c9d h LEU 153 N 0.03 0.84 -1.09 2.58 3.38 -1.29 -0.39 115.31 119.37 2c9d h LEU 153 Ca 0.04 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 2c9d h LEU 153 Cb 0.15 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2c9d h LEU 153 CO -0.00 0.57 0.20 -0.09 0.09 0.00 0.00 178.44 179.21 2c9d h ARG 154 N 0.97 0.85 -0.07 1.13 2.43 -1.10 -1.46 114.38 117.13 2c9d h ARG 154 Ca 0.33 -0.14 -0.11 0.00 -0.81 0.00 0.00 59.98 59.24 2c9d h ARG 154 Cb 0.08 -0.14 0.01 0.00 -0.42 0.00 0.00 29.97 29.49 2c9d h ARG 154 CO -0.10 0.72 -0.38 1.49 -1.51 0.00 0.00 179.97 180.19 2c9d h GLU 155 N 0.83 0.39 -0.44 0.20 4.57 -0.69 -3.30 114.58 116.15 2c9d h GLU 155 Ca 0.19 -0.32 -0.02 0.00 -1.18 0.00 0.00 59.36 58.04 2c9d h GLU 155 Cb 0.20 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.84 2c9d h GLU 155 CO -0.01 0.96 0.20 -0.07 -1.18 0.00 0.00 179.01 178.91 2c9d h LEU 156 N -0.09 0.59-10.40 1.64 3.38 -1.04 -3.46 115.31 105.93 2c9d h LEU 156 Ca -0.03 -0.14 -0.42 0.00 0.09 0.00 0.00 57.88 57.39 2c9d h LEU 156 Cb 1.03 -0.15 0.19 0.00 0.09 0.00 0.00 40.66 41.82 2c9d h LEU 156 CO 0.08 0.56 0.14 -0.13 0.09 0.00 0.00 178.44 179.18 2c9d s ARG 157 N -5.67 -1.17 -0.18 1.13 0.52 -0.56 -4.90 118.95 108.13 2c9d s ARG 157 Ca -0.13 -0.06 -0.29 0.00 -0.52 0.00 0.00 55.73 54.73 2c9d s ARG 157 Cb 0.11 -1.60 -0.04 0.00 0.52 0.00 0.00 34.95 33.93 2c9d s ARG 157 CO 0.75 -3.68 1.82 0.00 0.02 0.00 0.00 175.30 174.22 2c9d s ALA 158 N -3.02 3.18 0.15 2.13 0.00 -1.26 -4.97 121.76 117.97 2c9d s ALA 158 Ca 0.71 0.68 -0.07 0.00 0.00 0.00 0.00 51.96 53.28 2c9d s ALA 158 Cb -0.10 -3.91 -0.02 0.00 0.00 0.00 0.00 23.12 19.10 2c9d s ALA 158 CO 0.56 -2.11 0.21 -3.38 0.00 0.00 0.00 175.76 171.04 2c9d s HIS 159 N 5.85 0.50 -2.95 0.00 -3.43 -1.26 -5.12 115.29 108.88 2c9d s HIS 159 Ca 0.81 -0.87 0.24 0.00 -0.80 0.00 0.00 55.06 54.44 2c9d s HIS 159 Cb -0.30 -0.17 0.19 0.00 -1.43 0.00 0.00 32.58 30.87 2c9d s HIS 159 CO 0.33 -0.64 1.25 -1.13 -2.00 0.00 0.00 174.74 172.54