#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3nwn n LYS 6 N 0.00 0.63 -4.72 -1.58 5.02 -1.26 -4.86 118.16 111.39 3nwn n LYS 6 Ca 0.00 0.27 -0.33 0.00 -2.02 0.00 0.00 58.31 56.24 3nwn n LYS 6 Cb 0.00 -1.79 -0.15 0.00 -0.02 0.00 0.00 35.03 33.08 3nwn n LYS 6 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3nwn s VAL 7 N -2.65 2.98 0.03 -0.18 1.01 -1.26 -0.97 120.40 119.36 3nwn s VAL 7 Ca -0.04 -0.68 0.07 0.00 0.00 0.00 0.00 61.98 61.33 3nwn s VAL 7 Cb 0.08 -2.25 -0.02 0.00 0.00 0.00 0.00 36.38 34.18 3nwn s VAL 7 CO 0.82 0.52 -0.21 -1.00 0.00 0.00 0.00 175.10 175.23 3nwn s HIS 8 N 0.46 1.87 -0.15 5.22 3.76 -0.24 -4.93 115.29 121.28 3nwn s HIS 8 Ca -0.10 -0.37 0.00 0.00 -0.15 0.00 0.00 55.06 54.44 3nwn s HIS 8 Cb -0.16 -1.13 0.03 0.00 1.11 0.00 0.00 32.58 32.43 3nwn s HIS 8 CO 0.05 0.07 -0.11 0.00 -0.85 0.00 0.00 174.74 173.89 3nwn s ALA 9 N -0.74 1.74 0.29 -1.40 0.00 -1.26 -0.96 121.76 119.43 3nwn s ALA 9 Ca 0.08 -0.88 0.09 0.00 0.00 0.00 0.00 51.96 51.24 3nwn s ALA 9 Cb -0.09 -1.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.92 3nwn s ALA 9 CO 0.01 -0.51 0.08 -0.06 0.00 0.00 0.00 175.76 175.29 3nwn s PHE 10 N 1.53 2.78 -0.08 0.00 0.08 0.86 -0.34 117.98 122.81 3nwn s PHE 10 Ca 0.03 -0.25 0.04 0.00 0.12 0.00 0.00 56.93 56.87 3nwn s PHE 10 Cb -0.14 -1.38 0.00 0.00 -0.57 0.00 0.00 43.02 40.94 3nwn s PHE 10 CO -0.09 0.51 -0.20 0.08 -0.10 0.00 0.00 175.22 175.41 3nwn s VAL 11 N -2.32 1.75 -0.19 -0.44 1.01 -0.49 -0.81 120.40 118.90 3nwn s VAL 11 Ca 0.34 -0.85 -0.01 0.00 0.00 0.00 0.00 61.98 61.46 3nwn s VAL 11 Cb -0.05 -1.52 0.01 0.00 0.00 0.00 0.00 36.38 34.81 3nwn s VAL 11 CO 0.22 0.49 -0.13 -0.60 0.00 0.00 0.00 175.10 175.07 3nwn s ARG 12 N 0.36 3.17 0.08 2.72 3.52 -0.11 -0.08 118.95 128.61 3nwn s ARG 12 Ca -0.15 -0.74 -0.23 0.00 -0.13 0.00 0.00 55.73 54.48 3nwn s ARG 12 Cb -0.16 -2.74 -0.06 0.00 -1.56 0.00 0.00 34.95 30.42 3nwn s ARG 12 CO 0.06 -0.17 0.70 0.08 -0.81 0.00 0.00 175.30 175.16 3nwn s VAL 13 N 1.29 4.66 0.02 7.11 1.01 0.31 -1.87 120.40 132.93 3nwn s VAL 13 Ca 0.04 1.50 -0.30 0.00 0.00 0.00 0.00 61.98 63.22 3nwn s VAL 13 Cb -0.14 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 3nwn s VAL 13 CO -0.07 0.46 0.98 -0.75 0.00 0.00 0.00 175.10 175.71 3nwn s LYS 14 N -0.59 4.58 0.58 2.72 2.20 0.79 -4.22 119.74 125.80 3nwn s LYS 14 Ca 0.35 1.44 -0.19 0.00 -0.36 0.00 0.00 55.97 57.20 3nwn s LYS 14 Cb -0.21 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.63 3nwn s LYS 14 CO 0.22 -0.00 1.20 -2.14 -0.36 0.00 0.00 175.35 174.26 3nwn s PRO 15 N 0.81 3.08 -0.18 4.03 0.02 -1.26 -3.33 135.00 138.17 3nwn s PRO 15 Ca 0.51 1.80 -0.24 0.00 0.02 0.00 0.00 61.00 63.09 3nwn s PRO 15 Cb -0.22 -1.97 0.06 0.00 0.02 0.00 0.00 34.50 32.39 3nwn s PRO 15 CO 0.28 -1.12 0.63 -0.08 -0.33 0.00 0.00 177.00 176.39 3nwn s THR 16 N -1.61 0.00 0.13 0.99 -1.32 -1.26 -4.91 115.64 107.66 3nwn s THR 16 Ca 0.76 -0.03 0.19 0.00 -1.21 0.00 0.00 61.69 61.40 3nwn s THR 16 Cb -0.29 -0.90 0.15 0.00 -1.51 0.00 0.00 72.50 69.94 3nwn s THR 16 CO 0.32 -0.02 1.72 0.44 -2.21 0.00 0.00 174.62 174.88 3nwn h ASP 17 N 4.51 0.00 -2.15 8.08 3.32 -2.00 -3.34 116.42 124.83 3nwn h ASP 17 Ca -0.28 0.00 -0.69 0.00 0.02 0.00 0.00 57.03 56.08 3nwn h ASP 17 Cb 1.16 0.00 -0.35 0.00 0.22 0.00 0.00 39.33 40.36 3nwn h ASP 17 CO 0.19 0.35 0.11 -0.67 -1.72 0.00 0.00 179.24 177.51 3nwn n ASP 18 N -3.47 5.84 -4.76 6.45 2.03 -1.26 -5.07 116.55 116.31 3nwn n ASP 18 Ca 0.00 -3.71 -0.39 0.00 0.52 0.00 0.00 54.79 51.22 3nwn n ASP 18 Cb 0.51 -0.81 0.02 0.00 -0.72 0.00 0.00 41.12 40.12 3nwn n ASP 18 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 3nwn s PHE 19 N -3.85 2.54 -1.33 -0.67 5.36 -1.26 -4.55 117.98 114.22 3nwn s PHE 19 Ca 0.46 1.39 -0.10 0.00 -0.96 0.00 0.00 56.93 57.72 3nwn s PHE 19 Cb 0.28 -3.72 0.13 0.00 -0.34 0.00 0.00 43.02 39.37 3nwn s PHE 19 CO -0.17 -2.48 2.03 0.00 -1.46 0.00 0.00 175.22 173.14 3nwn n ALA 20 N -0.54 5.63 -0.26 11.12 0.00 0.00 -4.81 120.51 131.66 3nwn n ALA 20 Ca 0.07 -4.19 0.05 0.00 0.00 0.00 0.00 53.44 49.38 3nwn n ALA 20 Cb 0.45 -3.08 0.28 0.00 0.00 0.00 0.00 19.45 17.10 3nwn n ALA 20 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 3nwn h HIS 21 N 5.65 0.94 0.00 0.00 2.07 -1.87 0.34 115.15 122.27 3nwn h HIS 21 Ca 0.47 0.02 -0.08 0.00 -2.85 0.00 0.00 60.37 57.94 3nwn h HIS 21 Cb 0.59 -0.31 -0.01 0.00 2.57 0.00 0.00 27.41 30.25 3nwn h HIS 21 CO 1.35 0.50 -0.39 0.93 -3.07 0.00 0.00 177.93 177.24 3nwn h GLU 22 N 0.93 0.00 0.00 5.12 3.07 -1.96 -3.35 114.58 118.39 3nwn h GLU 22 Ca 0.36 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.21 3nwn h GLU 22 Cb 0.21 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.12 3nwn h GLU 22 CO -0.13 0.39 -1.68 -1.33 -1.40 0.00 0.00 179.01 174.87 3nwn n MET 23 N -3.53 0.48 -4.09 2.33 2.81 -0.44 -4.72 117.12 109.96 3nwn n MET 23 Ca -0.00 -0.13 -0.32 0.00 -1.81 0.00 0.00 57.70 55.44 3nwn n MET 23 Cb 0.53 -1.35 -0.16 0.00 -0.71 0.00 0.00 33.22 31.53 3nwn n MET 23 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3nwn s ILE 24 N -3.00 1.98 -0.10 2.02 1.01 -0.02 -0.46 121.20 122.63 3nwn s ILE 24 Ca -0.05 -1.03 0.01 0.00 0.00 0.00 0.00 60.65 59.57 3nwn s ILE 24 Cb 0.09 -1.87 0.02 0.00 0.01 0.00 0.00 42.46 40.71 3nwn s ILE 24 CO 0.61 0.40 -0.10 -0.13 0.00 0.00 0.00 174.94 175.72 3nwn s ARG 25 N 1.29 1.71 -0.06 2.79 1.81 -0.27 -4.69 118.95 121.53 3nwn s ARG 25 Ca 0.02 -0.35 -0.23 0.00 -1.72 0.00 0.00 55.73 53.45 3nwn s ARG 25 Cb -0.14 -1.62 -0.04 0.00 -0.45 0.00 0.00 34.95 32.70 3nwn s ARG 25 CO -0.11 -0.17 0.68 0.71 -0.68 0.00 0.00 175.30 175.73 3nwn s TYR 26 N 1.35 3.59 0.70 -0.53 2.02 -1.26 -0.80 117.35 122.42 3nwn s TYR 26 Ca -0.01 1.23 -0.14 0.00 -0.37 0.00 0.00 57.07 57.78 3nwn s TYR 26 Cb -0.14 -2.77 0.02 0.00 -0.40 0.00 0.00 41.96 38.67 3nwn s TYR 26 CO -0.05 0.13 1.12 0.20 -1.57 0.00 0.00 175.55 175.38 3nwn s GLY 27 N 0.64 2.07 0.34 0.71 0.00 -0.41 -4.93 107.32 105.74 3nwn s GLY 27 Ca 0.36 0.54 0.04 0.00 0.00 0.00 0.00 44.72 45.66 3nwn s GLY 27 CO 0.18 0.90 1.91 -0.55 0.00 0.00 0.00 173.10 175.53 3nwn h ASP 28 N -0.28 0.52 0.18 1.64 3.32 -1.97 -2.87 116.42 116.97 3nwn h ASP 28 Ca -0.46 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.51 3nwn h ASP 28 Cb 1.25 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.66 3nwn h ASP 28 CO 0.53 0.54 0.00 -0.90 -1.72 0.00 0.00 179.24 177.69 3nwn n ASP 29 N -4.32 0.00 -1.43 6.45 3.85 -1.26 -4.84 116.55 115.00 3nwn n ASP 29 Ca 0.02 0.33 -0.19 0.00 -0.71 0.00 0.00 54.79 54.24 3nwn n ASP 29 Cb 0.20 -0.38 -0.08 0.00 -1.35 0.00 0.00 41.12 39.51 3nwn n ASP 29 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 3nwn n LYS 30 N -1.38 -1.43 0.00 0.11 5.02 -1.08 -4.77 118.16 114.62 3nwn n LYS 30 Ca 0.03 1.16 0.00 0.00 -2.02 0.00 0.00 58.31 57.47 3nwn n LYS 30 Cb 0.07 -5.51 0.00 0.00 -0.02 0.00 0.00 35.03 29.56 3nwn n LYS 30 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3nwn n ARG 31 N -2.19 2.83 -4.08 1.97 1.74 -1.26 -1.42 116.66 114.25 3nwn n ARG 31 Ca -0.19 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.61 3nwn n ARG 31 Cb 0.65 -0.68 -0.06 0.00 -1.02 0.00 0.00 32.46 31.34 3nwn n ARG 31 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3nwn s SER 32 N -1.16 5.43 -0.13 0.55 0.01 -1.26 -0.39 113.70 116.75 3nwn s SER 32 Ca 0.00 -0.09 -0.08 0.00 1.31 0.00 0.00 55.95 57.08 3nwn s SER 32 Cb 0.00 -1.41 0.04 0.00 0.21 0.00 0.00 66.02 64.86 3nwn s SER 32 CO 0.00 0.13 0.31 -0.51 0.41 0.00 0.00 173.24 173.58 3nwn s ILE 33 N -1.54 -0.02 -0.03 1.44 2.07 -0.20 -1.29 121.20 121.63 3nwn s ILE 33 Ca 0.29 0.08 0.07 0.00 -1.41 0.00 0.00 60.65 59.69 3nwn s ILE 33 Cb -0.11 -0.46 -0.02 0.00 0.13 0.00 0.00 42.46 42.00 3nwn s ILE 33 CO 0.22 0.03 -0.25 -1.81 -1.91 0.00 0.00 174.94 171.23 3nwn s ASP 34 N 0.91 2.94 -0.11 4.50 1.11 0.02 -0.60 116.67 125.44 3nwn s ASP 34 Ca -0.06 -0.47 0.02 0.00 0.18 0.00 0.00 52.55 52.22 3nwn s ASP 34 Cb -0.07 -0.52 -0.01 0.00 1.07 0.00 0.00 42.92 43.39 3nwn s ASP 34 CO -0.06 0.28 -0.19 -0.63 1.18 0.00 0.00 175.17 175.74 3nwn s ILE 35 N -0.41 2.47 -0.35 0.77 -1.09 0.10 -1.12 121.20 121.57 3nwn s ILE 35 Ca 0.04 -0.87 0.02 0.00 -2.23 0.00 0.00 60.65 57.61 3nwn s ILE 35 Cb -0.11 -1.99 0.11 0.00 -1.58 0.00 0.00 42.46 38.89 3nwn s ILE 35 CO 0.01 0.55 0.10 -1.00 -1.23 0.00 0.00 174.94 173.37 3nwn s HIS 36 N 0.33 2.67 0.74 3.97 3.76 0.39 -0.96 115.29 126.20 3nwn s HIS 36 Ca -0.15 -2.42 -0.11 0.00 -0.15 0.00 0.00 55.06 52.23 3nwn s HIS 36 Cb -0.17 -2.30 0.04 0.00 1.11 0.00 0.00 32.58 31.26 3nwn s HIS 36 CO 0.08 -0.89 1.08 -0.51 -0.85 0.00 0.00 174.74 173.65 3nwn s LEU 37 N 1.07 3.07 0.11 0.89 1.02 0.41 -4.36 118.68 120.90 3nwn s LEU 37 Ca 0.12 1.74 -0.30 0.00 0.02 0.00 0.00 54.13 55.70 3nwn s LEU 37 Cb -0.19 -4.51 -0.06 0.00 0.02 0.00 0.00 46.19 41.45 3nwn s LEU 37 CO -0.14 -1.80 1.08 -1.59 0.02 0.00 0.00 176.35 173.93 3nwn s LYS 38 N -4.96 4.57 0.27 1.70 -2.85 -1.26 -4.89 119.74 112.31 3nwn s LYS 38 Ca 0.60 1.64 -0.30 0.00 -1.00 0.00 0.00 55.97 56.91 3nwn s LYS 38 Cb -0.16 -3.34 -0.13 0.00 -2.06 0.00 0.00 37.83 32.14 3nwn s LYS 38 CO 0.56 -0.00 1.27 1.63 0.10 0.00 0.00 175.35 178.90 3nwn n LYS 39 N 3.08 1.82 -2.07 1.78 4.76 -1.26 -4.96 118.16 121.31 3nwn n LYS 39 Ca 0.05 0.64 -0.38 0.00 -2.87 0.00 0.00 58.31 55.75 3nwn n LYS 39 Cb 0.47 -2.20 0.01 0.00 -1.84 0.00 0.00 35.03 31.47 3nwn n LYS 39 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 3nwn s ASP 40 N -0.08 5.84 0.36 4.39 -1.08 -1.26 -4.96 116.67 119.88 3nwn s ASP 40 Ca 0.63 2.49 0.19 0.00 -0.52 0.00 0.00 52.55 55.35 3nwn s ASP 40 Cb -0.66 -2.62 0.29 0.00 -1.46 0.00 0.00 42.92 38.47 3nwn s ASP 40 CO 0.56 -1.16 1.56 0.16 0.52 0.00 0.00 175.17 176.81 3nwn h ILE 41 N 1.75 0.50 -2.97 4.11 3.07 -2.00 -3.39 117.51 118.57 3nwn h ILE 41 Ca -0.50 -1.63 -0.54 0.00 1.55 0.00 0.00 64.86 63.75 3nwn h ILE 41 Cb 1.27 2.18 0.01 0.00 -0.27 0.00 0.00 36.82 40.01 3nwn h ILE 41 CO 0.59 0.28 0.76 -0.13 -1.05 0.00 0.00 178.15 178.60 3nwn s ARG 42 N -3.14 4.31 0.22 0.16 0.52 -1.26 -4.94 118.95 114.83 3nwn s ARG 42 Ca 0.05 2.00 -0.08 0.00 -0.52 0.00 0.00 55.73 57.18 3nwn s ARG 42 Cb 0.07 -3.40 0.25 0.00 0.52 0.00 0.00 34.95 32.39 3nwn s ARG 42 CO 0.70 -0.48 1.84 0.00 0.02 0.00 0.00 175.30 177.38 3nwn h ARG 43 N 7.28 0.85 0.00 3.54 3.08 -2.01 -1.50 114.38 125.61 3nwn h ARG 43 Ca -0.40 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 59.55 3nwn h ARG 43 Cb 1.20 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 31.05 3nwn h ARG 43 CO 0.88 0.56 -0.20 0.78 -1.07 0.00 0.00 179.97 180.92 3nwn h GLY 44 N 0.88 0.00 0.00 0.04 0.00 -1.98 -3.32 103.07 98.69 3nwn h GLY 44 Ca 0.32 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.54 3nwn h GLY 44 CO -0.15 0.00 -0.69 -2.08 0.00 0.00 0.00 176.54 173.62 3nwn h VAL 45 N 0.00 0.95 -0.89 4.60 2.07 -1.77 -3.39 116.25 117.82 3nwn h VAL 45 Ca -0.00 -1.95 0.21 0.00 0.82 0.00 0.00 66.70 65.78 3nwn h VAL 45 Cb 0.42 2.03 -0.06 0.00 -1.52 0.00 0.00 31.29 32.17 3nwn h VAL 45 CO 0.03 0.32 0.60 1.62 0.02 0.00 0.00 177.57 180.16 3nwn h VAL 46 N -1.00 0.65 -0.60 2.57 3.04 -1.39 0.30 116.25 119.81 3nwn h VAL 46 Ca -0.17 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.41 3nwn h VAL 46 Cb 0.99 0.31 0.00 0.00 -2.01 0.00 0.00 31.29 30.58 3nwn h VAL 46 CO -0.10 0.06 0.00 0.59 -1.01 0.00 0.00 177.57 177.10 3nwn n ASN 47 N -4.47 3.67 0.00 3.17 3.02 -1.26 -4.22 115.26 115.18 3nwn n ASN 47 Ca 0.19 -1.99 0.00 0.00 -0.03 0.00 0.00 54.58 52.75 3nwn n ASN 47 Cb 0.75 -0.40 0.00 0.00 -0.61 0.00 0.00 39.78 39.52 3nwn n ASN 47 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3nwn n ASN 48 N 1.41 1.02 -4.38 6.41 3.02 0.06 -5.06 115.26 117.74 3nwn n ASN 48 Ca 0.21 -1.05 -0.32 0.00 -0.03 0.00 0.00 54.58 53.38 3nwn n ASN 48 Cb 0.58 0.00 -0.15 0.00 -0.61 0.00 0.00 39.78 39.60 3nwn n ASN 48 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3nwn s GLN 49 N -0.05 2.67 -0.04 3.52 0.74 -0.98 -5.08 119.66 120.43 3nwn s GLN 49 Ca 0.00 -0.77 -0.30 0.00 0.05 0.00 0.00 55.36 54.34 3nwn s GLN 49 Cb 0.00 -2.35 -0.04 0.00 1.10 0.00 0.00 33.01 31.73 3nwn s GLN 49 CO 0.00 0.47 1.21 -1.14 -0.55 0.00 0.00 175.29 175.28 3nwn s GLN 50 N -0.34 4.36 -0.00 1.67 0.74 -1.26 -4.91 119.66 119.91 3nwn s GLN 50 Ca 0.02 1.70 0.08 0.00 0.05 0.00 0.00 55.36 57.21 3nwn s GLN 50 Cb -0.13 -3.54 -0.10 0.00 1.10 0.00 0.00 33.01 30.35 3nwn s GLN 50 CO 0.02 -0.43 0.29 0.25 -0.55 0.00 0.00 175.29 174.88 3nwn n THR 51 N 4.54 0.00 -5.03 -0.34 -2.24 -1.26 -4.99 114.28 104.96 3nwn n THR 51 Ca 0.11 -0.27 -0.32 0.00 -2.27 0.00 0.00 64.05 61.29 3nwn n THR 51 Cb 0.46 0.79 -0.16 0.00 -2.10 0.00 0.00 70.33 69.33 3nwn n THR 51 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3nwn s ASP 52 N -2.12 3.52 0.01 3.42 1.01 -1.26 -0.44 116.67 120.81 3nwn s ASP 52 Ca 0.01 -0.43 0.02 0.00 0.71 0.00 0.00 52.55 52.86 3nwn s ASP 52 Cb 0.06 -1.37 -0.01 0.00 1.01 0.00 0.00 42.92 42.61 3nwn s ASP 52 CO 0.33 0.19 -0.07 0.26 0.21 0.00 0.00 175.17 176.09 3nwn s TRP 53 N 0.19 0.60 -0.01 4.23 0.52 -0.13 -5.01 118.94 119.32 3nwn s TRP 53 Ca -0.11 -0.18 0.06 0.00 0.02 0.00 0.00 56.10 55.88 3nwn s TRP 53 Cb -0.16 -0.38 -0.02 0.00 -1.15 0.00 0.00 33.47 31.77 3nwn s TRP 53 CO 0.06 -0.02 -0.20 -1.54 0.02 0.00 0.00 176.95 175.27 3nwn s SER 54 N -0.44 2.32 -0.03 2.95 1.04 -1.26 -0.72 113.70 117.55 3nwn s SER 54 Ca 0.00 -0.37 0.02 0.00 0.48 0.00 0.00 55.95 56.08 3nwn s SER 54 Cb -0.04 -0.25 0.01 0.00 0.10 0.00 0.00 66.02 65.84 3nwn s SER 54 CO -0.00 0.24 -0.07 -0.36 0.98 0.00 0.00 173.24 174.03 3nwn s PHE 55 N -0.49 0.83 -0.21 5.02 0.08 0.23 -5.01 117.98 118.43 3nwn s PHE 55 Ca 0.08 -0.22 0.01 0.00 0.12 0.00 0.00 56.93 56.91 3nwn s PHE 55 Cb -0.08 -0.65 0.03 0.00 -0.57 0.00 0.00 43.02 41.75 3nwn s PHE 55 CO -0.01 -0.14 -0.14 0.21 -0.10 0.00 0.00 175.22 175.04 3nwn s LYS 56 N 0.54 2.81 0.25 0.44 2.20 -1.26 -1.03 119.74 123.68 3nwn s LYS 56 Ca -0.08 -0.97 0.00 0.00 -0.36 0.00 0.00 55.97 54.57 3nwn s LYS 56 Cb -0.11 -2.75 -0.00 0.00 -1.51 0.00 0.00 37.83 33.46 3nwn s LYS 56 CO 0.01 -0.33 0.01 1.28 -0.36 0.00 0.00 175.35 175.96 3nwn n LEU 57 N 4.59 0.00 0.21 5.43 4.77 0.48 -4.97 117.00 127.51 3nwn n LEU 57 Ca -0.18 -1.61 0.13 0.00 -0.03 0.00 0.00 56.01 54.32 3nwn n LEU 57 Cb 0.48 0.24 0.34 0.00 -2.33 0.00 0.00 43.42 42.14 3nwn n LEU 57 CO 0.25 -0.23 0.87 0.44 -1.33 0.00 0.00 177.39 177.39 3nwn h ASP 58 N 0.65 0.00 -2.48 -1.43 5.19 -0.92 -3.43 116.42 113.99 3nwn h ASP 58 Ca -0.20 0.00 0.20 0.00 -0.62 0.00 0.00 57.03 56.40 3nwn h ASP 58 Cb 0.64 0.00 -0.31 0.00 0.18 0.00 0.00 39.33 39.84 3nwn h ASP 58 CO 0.34 0.00 0.88 -0.83 -3.12 0.00 0.00 179.24 176.51 3nwn s GLY 59 N -4.07 0.26 -0.16 2.75 0.00 -1.24 -4.82 107.32 100.05 3nwn s GLY 59 Ca 0.06 3.29 0.01 0.00 0.00 0.00 0.00 44.72 48.08 3nwn s GLY 59 CO 0.61 1.69 -0.18 0.14 0.00 0.00 0.00 173.10 175.37 3nwn s VAL 60 N -0.27 1.83 -0.22 1.40 1.01 -0.51 -1.40 120.40 122.24 3nwn s VAL 60 Ca 0.07 -0.81 -0.02 0.00 0.00 0.00 0.00 61.98 61.23 3nwn s VAL 60 Cb -0.04 -1.67 0.01 0.00 0.00 0.00 0.00 36.38 34.69 3nwn s VAL 60 CO -0.13 0.50 -0.09 -0.76 0.00 0.00 0.00 175.10 174.62 3nwn s LEU 61 N 1.26 2.81 0.03 3.92 1.43 0.89 -4.81 118.68 124.20 3nwn s LEU 61 Ca 0.02 -0.63 0.06 0.00 -1.03 0.00 0.00 54.13 52.55 3nwn s LEU 61 Cb -0.13 -1.65 -0.02 0.00 0.03 0.00 0.00 46.19 44.42 3nwn s LEU 61 CO -0.09 -0.05 -0.17 -1.38 0.23 0.00 0.00 176.35 174.88 3nwn s HIS 62 N 1.38 1.50 -1.43 0.29 -3.43 -1.26 -0.53 115.29 111.81 3nwn s HIS 62 Ca 0.04 -0.34 -0.12 0.00 -0.80 0.00 0.00 55.06 53.83 3nwn s HIS 62 Cb -0.15 -0.91 0.10 0.00 -1.43 0.00 0.00 32.58 30.19 3nwn s HIS 62 CO -0.06 0.04 0.64 -0.25 -2.00 0.00 0.00 174.74 173.11 3nwn n ASP 63 N 2.07 -3.78 -4.78 7.38 8.00 -1.26 -4.93 116.55 119.25 3nwn n ASP 63 Ca -0.17 -0.60 -0.38 0.00 0.71 0.00 0.00 54.79 54.35 3nwn n ASP 63 Cb 0.54 -3.10 -0.06 0.00 -0.02 0.00 0.00 41.12 38.48 3nwn n ASP 63 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3nwn s ALA 64 N -3.07 3.58 0.79 2.24 0.00 -1.26 -5.07 121.76 118.96 3nwn s ALA 64 Ca 0.53 -0.14 -0.11 0.00 0.00 0.00 0.00 51.96 52.24 3nwn s ALA 64 Cb -0.28 -2.56 0.07 0.00 0.00 0.00 0.00 23.12 20.35 3nwn s ALA 64 CO 0.65 0.26 1.10 -1.54 0.00 0.00 0.00 175.76 176.24 3nwn s SER 65 N -0.38 4.28 0.27 0.00 1.04 -1.26 -4.83 113.70 112.82 3nwn s SER 65 Ca 0.26 1.89 -0.01 0.00 0.48 0.00 0.00 55.95 58.57 3nwn s SER 65 Cb -0.17 -2.53 0.45 0.00 0.10 0.00 0.00 66.02 63.87 3nwn s SER 65 CO 0.14 -2.19 1.88 1.56 0.98 0.00 0.00 173.24 175.61 3nwn h GLN 66 N -1.18 1.10 -0.85 4.02 1.08 -1.90 -0.97 115.11 116.41 3nwn h GLN 66 Ca -0.44 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 56.67 3nwn h GLN 66 Cb 1.24 -0.25 -0.04 0.00 -0.05 0.00 0.00 27.48 28.38 3nwn h GLN 66 CO 0.50 0.73 0.44 -0.44 -0.95 0.00 0.00 178.83 179.11 3nwn h ASP 67 N 1.14 1.09 0.24 1.46 3.32 -1.88 -1.99 116.42 119.79 3nwn h ASP 67 Ca 0.44 -0.12 -0.22 0.00 0.02 0.00 0.00 57.03 57.15 3nwn h ASP 67 Cb 0.22 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.49 3nwn h ASP 67 CO -0.18 0.90 -0.89 0.25 -1.72 0.00 0.00 179.24 177.59 3nwn h LEU 68 N 1.20 0.60 -0.34 1.55 5.85 -1.77 -2.50 115.31 119.91 3nwn h LEU 68 Ca 0.30 -0.45 -0.00 0.00 0.84 0.00 0.00 57.88 58.56 3nwn h LEU 68 Cb 0.07 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 3nwn h LEU 68 CO -0.04 1.24 0.21 0.58 -0.34 0.00 0.00 178.44 180.08 3nwn h VAL 69 N 0.29 1.11 -0.39 1.05 2.07 -0.99 -2.07 116.25 117.31 3nwn h VAL 69 Ca -0.07 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 3nwn h VAL 69 Cb 1.52 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 3nwn h VAL 69 CO 0.16 0.11 0.21 0.22 0.02 0.00 0.00 177.57 178.29 3nwn h TYR 70 N 0.44 0.54 -0.73 1.57 3.20 -1.29 -0.34 116.97 120.36 3nwn h TYR 70 Ca 0.12 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 3nwn h TYR 70 Cb -0.00 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.06 3nwn h TYR 70 CO -0.04 0.42 0.38 1.49 -1.64 0.00 0.00 178.16 178.76 3nwn h GLU 71 N 0.50 1.03 0.01 1.82 4.57 -1.39 -0.44 114.58 120.68 3nwn h GLU 71 Ca 0.14 -0.13 -0.00 0.00 -1.18 0.00 0.00 59.36 58.19 3nwn h GLU 71 Cb 0.06 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.45 3nwn h GLU 71 CO -0.02 0.78 -0.00 1.15 -1.18 0.00 0.00 179.01 179.73 3nwn h THR 72 N 1.03 1.40 0.02 0.32 2.02 -0.91 -3.38 112.91 113.42 3nwn h THR 72 Ca 0.26 -1.98 -0.32 0.00 0.77 0.00 0.00 66.41 65.14 3nwn h THR 72 Cb 0.07 2.61 -0.05 0.00 -1.74 0.00 0.00 68.15 69.04 3nwn h THR 72 CO -0.04 0.46 -1.89 1.33 0.37 0.00 0.00 175.52 175.75 3nwn n VAL 73 N -4.67 1.61 -0.05 3.16 0.24 -0.18 -4.80 118.33 113.63 3nwn n VAL 73 Ca -0.08 -0.77 -0.07 0.00 -2.04 0.00 0.00 64.34 61.38 3nwn n VAL 73 Cb 0.37 -1.10 -0.05 0.00 -1.47 0.00 0.00 33.84 31.59 3nwn n VAL 73 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3nwn n ALA 74 N -2.69 1.77 -0.24 2.33 0.00 -0.61 -4.72 120.51 116.35 3nwn n ALA 74 Ca -0.23 -0.45 0.04 0.00 0.00 0.00 0.00 53.44 52.80 3nwn n ALA 74 Cb 1.06 0.25 0.14 0.00 0.00 0.00 0.00 19.45 20.91 3nwn n ALA 74 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3nwn h LYS 75 N 0.00 0.12 -0.29 0.00 1.63 -1.30 -1.88 116.57 114.85 3nwn h LYS 75 Ca -0.23 -0.01 -0.15 0.00 -0.85 0.00 0.00 60.65 59.41 3nwn h LYS 75 Cb 1.37 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.96 3nwn h LYS 75 CO -0.04 0.08 -0.41 0.22 -3.45 0.00 0.00 179.45 175.86 3nwn h ASP 76 N 0.13 0.76 -0.37 4.20 3.58 -1.86 -2.32 116.42 120.54 3nwn h ASP 76 Ca 0.38 -0.34 -0.09 0.00 0.42 0.00 0.00 57.03 57.40 3nwn h ASP 76 Cb 0.66 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 41.48 3nwn h ASP 76 CO -0.60 1.07 -0.07 0.58 -2.88 0.00 0.00 179.24 177.33 3nwn h VAL 77 N 0.58 1.25 -0.05 2.25 2.07 -1.64 -0.85 116.25 119.86 3nwn h VAL 77 Ca 0.05 -1.11 -0.13 0.00 0.82 0.00 0.00 66.70 66.32 3nwn h VAL 77 Cb 0.95 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 3nwn h VAL 77 CO 0.09 0.38 -0.56 0.58 0.02 0.00 0.00 177.57 178.08 3nwn h VAL 78 N 0.72 1.38 -0.03 2.57 2.07 -1.35 -2.67 116.25 118.94 3nwn h VAL 78 Ca 0.13 -1.90 -0.01 0.00 0.82 0.00 0.00 66.70 65.74 3nwn h VAL 78 Cb 0.54 1.97 -0.00 0.00 -1.52 0.00 0.00 31.29 32.29 3nwn h VAL 78 CO 0.03 0.55 -0.01 0.28 0.02 0.00 0.00 177.57 178.45 3nwn h SER 79 N 0.11 0.06 -0.11 0.57 0.02 -0.85 -2.89 113.55 110.47 3nwn h SER 79 Ca -0.00 -0.37 0.03 0.00 -0.84 0.00 0.00 61.79 60.61 3nwn h SER 79 Cb 1.02 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.54 3nwn h SER 79 CO 0.08 0.42 0.11 1.56 -1.14 0.00 0.00 176.83 177.86 3nwn h GLN 80 N -0.30 0.00 -0.60 3.45 4.20 -1.13 -2.93 115.11 117.80 3nwn h GLN 80 Ca 0.01 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 3nwn h GLN 80 Cb 0.39 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.15 3nwn h GLN 80 CO 0.00 0.00 0.01 0.00 -0.67 0.00 0.00 178.83 178.17 3nwn h ALA 81 N 1.88 0.88 0.00 3.87 0.00 -1.25 -2.09 119.26 122.55 3nwn h ALA 81 Ca 0.05 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3nwn h ALA 81 Cb 0.27 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3nwn h ALA 81 CO -0.00 0.66 0.00 -0.07 0.00 0.00 0.00 179.25 179.84 3nwn h LEU 82 N 0.95 0.00 -0.71 0.00 4.07 -1.55 -1.35 115.31 116.72 3nwn h LEU 82 Ca 0.17 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.13 3nwn h LEU 82 Cb 0.54 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.28 3nwn h LEU 82 CO 0.03 0.00 -0.13 0.47 -1.08 0.00 0.00 178.44 177.73 3nwn n ASP 83 N -3.07 1.23 0.00 -0.43 8.00 -0.90 -4.92 116.55 116.47 3nwn n ASP 83 Ca -0.01 -1.17 0.00 0.00 0.71 0.00 0.00 54.79 54.32 3nwn n ASP 83 Cb 0.22 0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 3nwn n ASP 83 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3nwn n GLY 84 N 1.26 1.04 3.64 0.44 0.00 -0.51 -4.98 105.19 106.08 3nwn n GLY 84 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 3nwn n GLY 84 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3nwn s TYR 85 N -2.00 3.29 0.39 1.61 2.02 -0.84 -4.64 117.35 117.18 3nwn s TYR 85 Ca 0.00 0.31 -0.27 0.00 -0.37 0.00 0.00 57.07 56.74 3nwn s TYR 85 Cb 0.00 -2.40 -0.09 0.00 -0.40 0.00 0.00 41.96 39.06 3nwn s TYR 85 CO 0.00 -0.06 1.35 -0.80 -1.57 0.00 0.00 175.55 174.47 3nwn s ASN 86 N 1.33 6.37 -0.03 2.29 0.01 -1.26 -3.51 114.94 120.14 3nwn s ASN 86 Ca 0.11 2.77 0.01 0.00 -0.71 0.00 0.00 52.86 55.04 3nwn s ASN 86 Cb -0.15 -2.65 0.01 0.00 0.41 0.00 0.00 41.25 38.87 3nwn s ASN 86 CO 0.08 -0.82 -0.05 -0.83 -1.51 0.00 0.00 177.10 173.96 3nwn s GLY 87 N -0.55 0.38 -0.10 0.66 0.00 -0.55 -0.71 107.32 106.45 3nwn s GLY 87 Ca 0.55 -0.14 0.02 0.00 0.00 0.00 0.00 44.72 45.16 3nwn s GLY 87 CO 0.53 0.14 -0.17 -1.59 0.00 0.00 0.00 173.10 172.02 3nwn s THR 88 N 0.44 1.57 -0.19 0.90 2.01 0.69 -0.26 115.64 120.79 3nwn s THR 88 Ca -0.05 -0.71 -0.02 0.00 0.31 0.00 0.00 61.69 61.22 3nwn s THR 88 Cb -0.09 -1.40 -0.01 0.00 0.01 0.00 0.00 72.50 71.01 3nwn s THR 88 CO -0.00 0.45 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.66 3nwn s ILE 89 N 0.72 3.09 -0.12 1.82 1.01 0.55 -0.10 121.20 128.17 3nwn s ILE 89 Ca -0.12 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 59.94 3nwn s ILE 89 Cb -0.16 -2.36 0.02 0.00 0.01 0.00 0.00 42.46 39.96 3nwn s ILE 89 CO 0.03 0.47 -0.15 -0.32 0.00 0.00 0.00 174.94 174.96 3nwn s MET 90 N 1.08 2.31 -0.13 2.79 1.75 -0.29 -0.06 119.30 126.76 3nwn s MET 90 Ca 0.00 -0.58 -0.14 0.00 -1.25 0.00 0.00 55.69 53.72 3nwn s MET 90 Cb -0.15 -2.00 -0.05 0.00 2.84 0.00 0.00 34.83 35.47 3nwn s MET 90 CO -0.02 -0.11 0.33 0.00 -0.65 0.00 0.00 175.02 174.57 3nwn s TYR 92 N 0.20 0.60 0.00 0.00 5.04 -0.76 -2.23 117.35 120.20 3nwn s TYR 92 Ca 0.19 -0.37 0.00 0.00 -2.44 0.00 0.00 57.07 54.45 3nwn s TYR 92 Cb -0.14 -0.37 0.00 0.00 0.35 0.00 0.00 41.96 41.81 3nwn s TYR 92 CO 0.06 -0.06 0.00 0.41 -1.34 0.00 0.00 175.55 174.62 3nwn n GLY 93 N 1.94 2.78 3.80 8.97 0.00 -1.26 -0.18 105.19 121.23 3nwn n GLY 93 Ca -0.20 -1.67 -0.32 0.00 0.00 0.00 0.00 46.02 43.84 3nwn n GLY 93 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3nwn s GLN 94 N -1.90 3.11 0.08 1.61 -2.07 -1.26 -1.87 119.66 117.36 3nwn s GLN 94 Ca 0.00 1.16 -0.34 0.00 -1.82 0.00 0.00 55.36 54.36 3nwn s GLN 94 Cb 0.00 -2.01 -0.13 0.00 -1.09 0.00 0.00 33.01 29.78 3nwn s GLN 94 CO 0.00 -0.98 1.67 2.41 -1.32 0.00 0.00 175.29 177.07 3nwn n THR 95 N -2.43 0.19 0.00 3.63 -1.04 -1.26 -1.66 114.28 111.70 3nwn n THR 95 Ca 0.09 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 3nwn n THR 95 Cb 0.53 -1.63 0.00 0.00 -1.82 0.00 0.00 70.33 67.41 3nwn n THR 95 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3nwn n GLY 96 N 3.71 1.68 0.22 3.41 0.00 -1.26 -4.96 105.19 107.99 3nwn n GLY 96 Ca 0.19 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.30 3nwn n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3nwn h ALA 97 N 0.00 1.03 0.00 4.61 0.00 -1.64 -3.48 119.26 119.79 3nwn h ALA 97 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3nwn h ALA 97 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3nwn h ALA 97 CO 0.00 0.31 0.00 0.41 0.00 0.00 0.00 179.25 179.97 3nwn n GLY 98 N 0.11 1.03 0.15 0.00 0.00 -1.26 -4.31 105.19 100.92 3nwn n GLY 98 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 3nwn n GLY 98 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3nwn h LYS 99 N 0.00 -0.05 0.01 1.61 1.57 -1.90 0.92 116.57 118.73 3nwn h LYS 99 Ca 0.00 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.56 3nwn h LYS 99 Cb 0.00 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 3nwn h LYS 99 CO 0.00 -0.03 -0.95 1.15 -0.57 0.00 0.00 179.45 179.05 3nwn h THR 100 N -0.05 1.43 -0.64 -0.16 2.02 -1.97 -1.09 112.91 112.45 3nwn h THR 100 Ca 0.13 -2.52 -0.07 0.00 0.77 0.00 0.00 66.41 64.71 3nwn h THR 100 Cb 0.25 2.46 -0.03 0.00 -1.74 0.00 0.00 68.15 69.09 3nwn h THR 100 CO -0.29 0.75 0.11 0.22 0.37 0.00 0.00 175.52 176.68 3nwn h TYR 101 N 0.19 1.11 -0.27 3.16 3.20 -1.87 0.25 116.97 122.75 3nwn h TYR 101 Ca -0.08 -0.14 -0.09 0.00 3.14 0.00 0.00 58.73 61.56 3nwn h TYR 101 Cb 1.59 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 39.54 3nwn h TYR 101 CO 0.05 0.93 -0.18 1.15 -1.64 0.00 0.00 178.16 178.48 3nwn h THR 102 N 0.99 1.30 0.01 1.81 2.02 -0.67 -0.52 112.91 117.86 3nwn h THR 102 Ca 0.20 -1.30 -0.10 0.00 0.77 0.00 0.00 66.41 65.97 3nwn h THR 102 Cb 0.42 1.57 -0.01 0.00 -1.74 0.00 0.00 68.15 68.39 3nwn h THR 102 CO 0.01 0.41 -0.55 -0.03 0.37 0.00 0.00 175.52 175.73 3nwn h MET 103 N 0.32 0.03 0.01 6.66 1.85 -1.10 -1.97 114.93 120.73 3nwn h MET 103 Ca 0.05 -0.04 -0.25 0.00 -0.61 0.00 0.00 59.70 58.85 3nwn h MET 103 Cb 0.71 0.02 -0.03 0.00 0.43 0.00 0.00 31.60 32.72 3nwn h MET 103 CO 0.05 1.02 -1.38 -0.12 -0.40 0.00 0.00 176.91 176.08 3nwn n MET 104 N -4.49 0.59 -0.17 0.39 0.00 0.78 -0.73 117.12 113.49 3nwn n MET 104 Ca -0.19 0.54 0.02 0.00 -0.00 0.00 0.00 57.70 58.07 3nwn n MET 104 Cb 0.59 -1.74 -0.01 0.00 0.00 0.00 0.00 33.22 32.06 3nwn n MET 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3nwn n GLY 105 N 1.49 -1.57 3.68 -5.12 0.00 -0.20 -0.50 105.19 102.98 3nwn n GLY 105 Ca -0.33 -1.21 -0.44 0.00 0.00 0.00 0.00 46.02 44.04 3nwn n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3nwn n ALA 106 N -0.35 1.71 1.54 4.61 0.00 -0.66 -4.70 120.51 122.66 3nwn n ALA 106 Ca 0.00 0.31 0.14 0.00 0.00 0.00 0.00 53.44 53.89 3nwn n ALA 106 Cb 0.08 -2.56 0.56 0.00 0.00 0.00 0.00 19.45 17.53 3nwn n ALA 106 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3nwn n THR 107 N 4.77 0.02 -1.95 0.00 -2.24 -1.26 -4.12 114.28 109.49 3nwn n THR 107 Ca 0.19 -0.23 0.02 0.00 -2.27 0.00 0.00 64.05 61.77 3nwn n THR 107 Cb 0.35 0.36 0.03 0.00 -2.10 0.00 0.00 70.33 68.97 3nwn n THR 107 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3nwn n GLU 108 N 0.04 0.23 -3.63 -0.78 1.02 -1.26 -5.02 120.64 111.24 3nwn n GLU 108 Ca 0.19 -1.48 -0.04 0.00 -0.02 0.00 0.00 57.16 55.81 3nwn n GLU 108 Cb 0.32 -0.58 -0.06 0.00 -0.02 0.00 0.00 31.44 31.10 3nwn n GLU 108 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3nwn s ASN 109 N -1.52 -0.94 0.23 1.62 2.20 -1.26 -5.08 114.94 110.19 3nwn s ASN 109 Ca 0.12 1.43 -0.17 0.00 -0.94 0.00 0.00 52.86 53.30 3nwn s ASN 109 Cb 0.12 1.64 0.24 0.00 -2.00 0.00 0.00 41.25 41.25 3nwn s ASN 109 CO -0.03 -0.22 1.56 0.22 -2.94 0.00 0.00 177.10 175.69 3nwn h TYR 110 N 7.20 -1.00 -0.70 1.54 3.20 -1.95 -2.57 116.97 122.69 3nwn h TYR 110 Ca -0.26 0.10 0.14 0.00 3.14 0.00 0.00 58.73 61.85 3nwn h TYR 110 Cb 1.19 0.57 -0.04 0.00 1.54 0.00 0.00 36.73 39.98 3nwn h TYR 110 CO 0.09 -0.40 0.47 -0.22 -1.64 0.00 0.00 178.16 176.46 3nwn h LYS 111 N -0.03 0.37 -0.61 1.82 1.63 -1.98 -1.55 116.57 116.23 3nwn h LYS 111 Ca 0.34 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.12 3nwn h LYS 111 Cb 0.60 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.14 3nwn h LYS 111 CO -0.93 0.25 0.00 0.72 -3.45 0.00 0.00 179.45 176.04 3nwn n HIS 112 N -4.47 1.21 -2.13 1.91 8.25 -0.97 -4.56 115.22 114.46 3nwn n HIS 112 Ca 0.13 -0.59 -0.34 0.00 -0.26 0.00 0.00 57.72 56.66 3nwn n HIS 112 Cb 0.50 -0.17 0.01 0.00 1.12 0.00 0.00 29.99 31.45 3nwn n HIS 112 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 3nwn s ARG 113 N -1.61 3.23 0.00 -0.41 1.70 -0.58 -1.65 118.95 119.62 3nwn s ARG 113 Ca 0.47 1.54 0.00 0.00 -0.47 0.00 0.00 55.73 57.27 3nwn s ARG 113 Cb 0.29 -1.99 0.00 0.00 -0.57 0.00 0.00 34.95 32.67 3nwn s ARG 113 CO 0.25 -0.94 0.00 0.41 -1.08 0.00 0.00 175.30 173.94 3nwn n GLY 114 N -0.05 1.04 0.16 3.88 0.00 0.35 -4.82 105.19 105.75 3nwn n GLY 114 Ca 0.11 -1.94 -0.08 0.00 0.00 0.00 0.00 46.02 44.11 3nwn n GLY 114 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3nwn h ILE 115 N -0.11 1.07 0.59 -0.61 2.04 -0.80 -2.84 117.51 116.86 3nwn h ILE 115 Ca 0.00 -0.15 -0.03 0.00 1.00 0.00 0.00 64.86 65.68 3nwn h ILE 115 Cb 0.00 0.58 0.01 0.00 -0.74 0.00 0.00 36.82 36.67 3nwn h ILE 115 CO 0.00 0.08 -0.28 0.25 0.00 0.00 0.00 178.15 178.20 3nwn h LEU 116 N 0.45 -0.67 -1.46 1.44 5.85 -1.21 0.11 115.31 119.82 3nwn h LEU 116 Ca 0.13 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.87 3nwn h LEU 116 Cb -0.03 0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 3nwn h LEU 116 CO -0.04 -0.44 0.38 1.55 -0.34 0.00 0.00 178.44 179.54 3nwn h PRO 117 N -0.85 0.72 -0.37 5.25 0.13 -1.78 -1.96 132.00 133.14 3nwn h PRO 117 Ca -0.08 -0.04 -0.07 0.00 -0.87 0.00 0.00 66.00 64.94 3nwn h PRO 117 Cb 0.63 -0.16 -0.02 0.00 0.13 0.00 0.00 31.00 31.58 3nwn h PRO 117 CO 0.13 0.47 -0.07 0.00 -0.23 0.00 0.00 178.00 178.31 3nwn h ARG 118 N 0.74 0.61 -0.22 0.86 3.08 -1.23 -1.44 114.38 116.78 3nwn h ARG 118 Ca 0.22 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 3nwn h ARG 118 Cb -0.03 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 3nwn h ARG 118 CO -0.05 0.68 0.09 0.00 -1.07 0.00 0.00 179.97 179.62 3nwn h ALA 119 N 1.36 0.29 -0.76 0.04 0.00 -0.06 0.89 119.26 121.02 3nwn h ALA 119 Ca 0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3nwn h ALA 119 Cb 0.46 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 3nwn h ALA 119 CO 0.02 -0.11 0.41 -0.07 0.00 0.00 0.00 179.25 179.50 3nwn h LEU 120 N 0.20 0.94 -0.27 0.00 3.38 -1.32 -0.54 115.31 117.69 3nwn h LEU 120 Ca 0.07 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 3nwn h LEU 120 Cb 0.18 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3nwn h LEU 120 CO -0.01 0.76 -0.07 -0.61 0.09 0.00 0.00 178.44 178.61 3nwn h GLN 121 N 1.06 0.53 -0.23 1.13 4.15 -1.00 -2.99 115.11 117.76 3nwn h GLN 121 Ca 0.27 -0.20 -0.01 0.00 0.77 0.00 0.00 58.65 59.48 3nwn h GLN 121 Cb 0.03 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 3nwn h GLN 121 CO -0.04 0.74 0.12 0.37 -1.93 0.00 0.00 178.83 178.08 3nwn h GLN 122 N 0.28 0.33 -0.43 1.69 4.15 -0.59 -1.84 115.11 118.70 3nwn h GLN 122 Ca 0.07 -0.05 0.08 0.00 0.77 0.00 0.00 58.65 59.52 3nwn h GLN 122 Cb 0.54 -0.06 -0.09 0.00 0.21 0.00 0.00 27.48 28.08 3nwn h GLN 122 CO 0.03 0.33 -0.36 0.28 -1.93 0.00 0.00 178.83 177.17 3nwn h VAL 123 N 0.25 0.18 0.00 2.39 2.07 -1.12 0.76 116.25 120.79 3nwn h VAL 123 Ca 0.08 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.53 3nwn h VAL 123 Cb 0.10 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 3nwn h VAL 123 CO -0.01 0.00 -0.36 -0.26 0.02 0.00 0.00 177.57 176.96 3nwn h PHE 124 N -0.27 0.00 0.14 1.57 0.04 -1.49 -1.79 116.94 115.15 3nwn h PHE 124 Ca 0.17 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.93 3nwn h PHE 124 Cb 0.56 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.71 3nwn h PHE 124 CO -0.58 0.36 -0.07 -0.09 -0.60 0.00 0.00 178.31 177.33 3nwn h ARG 125 N 0.00 -0.18 -0.94 1.51 2.43 -1.02 -3.19 114.38 112.99 3nwn h ARG 125 Ca -0.00 0.01 0.14 0.00 -0.81 0.00 0.00 59.98 59.32 3nwn h ARG 125 Cb 0.81 0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 30.33 3nwn h ARG 125 CO 0.05 0.20 0.60 0.52 -1.51 0.00 0.00 179.97 179.82 3nwn h MET 126 N -0.61 0.78 -0.13 0.20 2.86 -0.65 -0.71 114.93 116.67 3nwn h MET 126 Ca -0.02 -0.05 0.04 0.00 -2.06 0.00 0.00 59.70 57.61 3nwn h MET 126 Cb 0.47 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 3nwn h MET 126 CO 0.03 0.52 0.10 0.82 1.06 0.00 0.00 176.91 179.43 3nwn h ILE 127 N 0.80 0.86 0.00 -1.22 2.04 -1.32 -1.17 117.51 117.51 3nwn h ILE 127 Ca 0.48 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 66.23 3nwn h ILE 127 Cb 0.65 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 3nwn h ILE 127 CO -0.24 0.00 -0.51 -0.33 0.00 0.00 0.00 178.15 177.07 3nwn h GLU 128 N 0.00 0.00 -0.03 2.37 4.39 -1.12 -3.02 114.58 117.18 3nwn h GLU 128 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 3nwn h GLU 128 Cb 0.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 3nwn h GLU 128 CO -0.00 0.51 0.00 0.39 -1.16 0.00 0.00 179.01 178.75 3nwn n GLU 129 N -3.62 1.15 -3.08 2.33 -0.58 -0.45 -4.09 120.64 112.31 3nwn n GLU 129 Ca -0.00 -0.23 -0.22 0.00 -0.42 0.00 0.00 57.16 56.28 3nwn n GLU 129 Cb 0.59 -1.37 -0.04 0.00 -0.57 0.00 0.00 31.44 30.05 3nwn n GLU 129 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3nwn n ARG 130 N -0.61 2.00 0.31 3.49 1.74 -1.14 -4.95 116.66 117.50 3nwn n ARG 130 Ca 0.17 -4.06 0.20 0.00 -0.77 0.00 0.00 57.85 53.39 3nwn n ARG 130 Cb 0.13 -1.94 0.97 0.00 -1.02 0.00 0.00 32.46 30.61 3nwn n ARG 130 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3nwn h PRO 131 N 3.04 0.00 -0.04 5.56 0.13 -1.74 -1.86 132.00 137.09 3nwn h PRO 131 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3nwn h PRO 131 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 3nwn h PRO 131 CO 0.65 0.01 0.00 0.25 -0.23 0.00 0.00 178.00 178.68 3nwn n THR 132 N -3.13 0.03 -4.19 1.56 -2.24 -1.26 -4.87 114.28 100.18 3nwn n THR 132 Ca -0.01 -0.27 -0.35 0.00 -2.27 0.00 0.00 64.05 61.14 3nwn n THR 132 Cb 0.18 0.50 -0.09 0.00 -2.10 0.00 0.00 70.33 68.82 3nwn n THR 132 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3nwn s HIS 133 N -1.97 3.28 -0.51 4.78 3.76 -0.70 -5.05 115.29 118.87 3nwn s HIS 133 Ca 0.37 0.23 -0.19 0.00 -0.15 0.00 0.00 55.06 55.31 3nwn s HIS 133 Cb 0.21 -1.89 0.06 0.00 1.11 0.00 0.00 32.58 32.06 3nwn s HIS 133 CO 0.33 0.45 0.63 0.00 -0.85 0.00 0.00 174.74 175.30 3nwn s ALA 134 N -0.61 3.38 -0.18 -1.40 0.00 -0.60 -4.96 121.76 117.39 3nwn s ALA 134 Ca 0.11 -1.72 -0.02 0.00 0.00 0.00 0.00 51.96 50.32 3nwn s ALA 134 Cb -0.12 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.63 3nwn s ALA 134 CO 0.02 -2.01 -0.08 0.42 0.00 0.00 0.00 175.76 174.11 3nwn s ILE 135 N 2.66 3.28 -0.11 0.00 1.01 -1.26 -2.23 121.20 124.55 3nwn s ILE 135 Ca 0.16 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.28 3nwn s ILE 135 Cb -0.19 -2.44 -0.01 0.00 0.01 0.00 0.00 42.46 39.83 3nwn s ILE 135 CO 0.12 0.47 -0.19 -0.89 0.00 0.00 0.00 174.94 174.46 3nwn s THR 136 N 0.91 2.56 -0.10 2.92 2.01 0.51 -5.01 115.64 119.43 3nwn s THR 136 Ca -0.02 -0.85 0.02 0.00 0.31 0.00 0.00 61.69 61.15 3nwn s THR 136 Cb -0.15 -2.02 -0.02 0.00 0.01 0.00 0.00 72.50 70.32 3nwn s THR 136 CO 0.00 0.55 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.63 3nwn s VAL 137 N 0.28 2.85 0.08 3.82 1.01 -1.26 -2.04 120.40 125.15 3nwn s VAL 137 Ca -0.13 -0.75 0.05 0.00 0.00 0.00 0.00 61.98 61.14 3nwn s VAL 137 Cb -0.17 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 3nwn s VAL 137 CO 0.07 0.55 -0.12 -0.13 0.00 0.00 0.00 175.10 175.46 3nwn s ARG 138 N 0.08 0.83 0.07 2.72 0.52 -0.54 -0.85 118.95 121.79 3nwn s ARG 138 Ca -0.07 -1.04 0.04 0.00 -0.52 0.00 0.00 55.73 54.15 3nwn s ARG 138 Cb -0.15 -0.70 -0.03 0.00 0.52 0.00 0.00 34.95 34.59 3nwn s ARG 138 CO 0.05 0.14 -0.11 0.14 0.02 0.00 0.00 175.30 175.54 3nwn s VAL 139 N -1.75 0.91 0.07 3.52 -7.23 0.82 -0.28 120.40 116.46 3nwn s VAL 139 Ca 0.01 -1.36 -0.00 0.00 -1.81 0.00 0.00 61.98 58.81 3nwn s VAL 139 Cb -0.07 -1.05 -0.04 0.00 0.56 0.00 0.00 36.38 35.77 3nwn s VAL 139 CO 0.02 -0.38 -0.04 -0.94 -0.31 0.00 0.00 175.10 173.45 3nwn s SER 140 N -1.94 0.66 -0.19 4.85 1.04 -0.55 -0.88 113.70 116.70 3nwn s SER 140 Ca -0.01 -1.01 -0.04 0.00 0.48 0.00 0.00 55.95 55.36 3nwn s SER 140 Cb -0.08 0.18 0.09 0.00 0.10 0.00 0.00 66.02 66.31 3nwn s SER 140 CO 0.01 -0.57 0.28 -0.47 0.98 0.00 0.00 173.24 173.48 3nwn s TYR 141 N -3.84 -0.49 -0.06 5.02 5.04 -1.26 -1.41 117.35 120.35 3nwn s TYR 141 Ca 0.09 0.70 0.05 0.00 -2.44 0.00 0.00 57.07 55.47 3nwn s TYR 141 Cb 0.07 -0.12 -0.01 0.00 0.35 0.00 0.00 41.96 42.26 3nwn s TYR 141 CO -0.08 -0.54 -0.21 -1.17 -1.34 0.00 0.00 175.55 172.21 3nwn s LEU 142 N 2.43 1.99 -0.11 6.97 2.96 -0.70 -1.41 118.68 130.80 3nwn s LEU 142 Ca 0.06 -0.44 -0.01 0.00 -0.22 0.00 0.00 54.13 53.52 3nwn s LEU 142 Cb -0.14 -1.18 -0.03 0.00 0.50 0.00 0.00 46.19 45.34 3nwn s LEU 142 CO -0.12 0.19 -0.06 -0.70 -1.32 0.00 0.00 176.35 174.34 3nwn s GLU 143 N 0.01 3.19 -0.21 1.98 2.12 0.08 -0.61 118.70 125.26 3nwn s GLU 143 Ca -0.06 -0.54 -0.05 0.00 0.36 0.00 0.00 54.97 54.68 3nwn s GLU 143 Cb -0.13 -2.73 -0.02 0.00 0.26 0.00 0.00 34.13 31.51 3nwn s GLU 143 CO 0.04 0.46 -0.01 0.42 -0.54 0.00 0.00 175.26 175.62 3nwn s ILE 144 N -0.24 3.80 -0.11 -3.70 1.01 0.11 -0.29 121.20 121.77 3nwn s ILE 144 Ca 0.03 -0.36 -0.03 0.00 0.00 0.00 0.00 60.65 60.29 3nwn s ILE 144 Cb -0.13 -2.72 0.05 0.00 0.01 0.00 0.00 42.46 39.67 3nwn s ILE 144 CO 0.03 0.42 0.15 -0.47 0.00 0.00 0.00 174.94 175.06 3nwn s TYR 145 N 1.20 -0.11 -1.30 3.97 5.04 -0.44 -0.94 117.35 124.77 3nwn s TYR 145 Ca 0.03 0.39 -0.01 0.00 -2.44 0.00 0.00 57.07 55.04 3nwn s TYR 145 Cb -0.15 -0.36 -0.00 0.00 0.35 0.00 0.00 41.96 41.80 3nwn s TYR 145 CO 0.01 -0.34 0.69 -1.71 -1.34 0.00 0.00 175.55 172.85 3nwn n ASN 146 N 5.32 -1.43 -0.41 4.32 5.15 -1.26 -1.33 115.26 125.62 3nwn n ASN 146 Ca -0.05 -0.84 -0.05 0.00 -0.60 0.00 0.00 54.58 53.04 3nwn n ASN 146 Cb 0.50 -3.97 -0.02 0.00 -0.53 0.00 0.00 39.78 35.75 3nwn n ASN 146 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3nwn n GLU 147 N -4.25 -1.44 -4.26 1.20 -0.58 -1.26 -5.01 120.64 105.04 3nwn n GLU 147 Ca -0.29 0.62 -0.30 0.00 -0.42 0.00 0.00 57.16 56.77 3nwn n GLU 147 Cb 0.67 -4.80 -0.10 0.00 -0.57 0.00 0.00 31.44 26.64 3nwn n GLU 147 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 3nwn s SER 148 N -2.27 4.55 -0.15 1.62 0.01 -0.44 -4.92 113.70 112.09 3nwn s SER 148 Ca 0.00 -0.30 -0.06 0.00 1.31 0.00 0.00 55.95 56.90 3nwn s SER 148 Cb 0.00 -0.95 -0.04 0.00 0.21 0.00 0.00 66.02 65.25 3nwn s SER 148 CO 0.00 0.20 0.05 -0.76 0.41 0.00 0.00 173.24 173.14 3nwn s LEU 149 N -2.06 3.77 -0.02 2.44 1.43 -1.26 -1.33 118.68 121.65 3nwn s LEU 149 Ca 0.21 0.11 0.05 0.00 -1.03 0.00 0.00 54.13 53.47 3nwn s LEU 149 Cb -0.11 -1.93 -0.01 0.00 0.03 0.00 0.00 46.19 44.17 3nwn s LEU 149 CO 0.13 0.24 -0.16 -0.36 0.23 0.00 0.00 176.35 176.43 3nwn s PHE 150 N -0.04 1.50 -0.42 0.29 0.08 0.60 -4.43 117.98 115.56 3nwn s PHE 150 Ca 0.06 -0.33 -0.16 0.00 0.12 0.00 0.00 56.93 56.61 3nwn s PHE 150 Cb -0.12 -0.98 0.02 0.00 -0.57 0.00 0.00 43.02 41.37 3nwn s PHE 150 CO 0.01 -0.07 0.38 0.34 -0.10 0.00 0.00 175.22 175.79 3nwn s ASP 151 N -0.24 6.16 0.09 1.36 -1.08 -1.26 -0.74 116.67 120.96 3nwn s ASP 151 Ca 0.03 -0.78 0.18 0.00 -0.52 0.00 0.00 52.55 51.46 3nwn s ASP 151 Cb -0.08 -2.20 0.75 0.00 -1.46 0.00 0.00 42.92 39.94 3nwn s ASP 151 CO 0.00 -0.53 1.55 0.18 0.52 0.00 0.00 175.17 176.89 3nwn n LEU 152 N 5.42 0.24 -0.54 -1.34 4.77 -0.50 -2.64 117.00 122.40 3nwn n LEU 152 Ca -0.09 0.56 0.08 0.00 -0.03 0.00 0.00 56.01 56.53 3nwn n LEU 152 Cb 0.47 -0.53 0.20 0.00 -2.33 0.00 0.00 43.42 41.24 3nwn n LEU 152 CO 0.44 -0.36 0.63 0.18 -1.33 0.00 0.00 177.39 176.95 3nwn n LEU 153 N -1.77 3.19 -4.77 2.23 4.77 -1.26 -4.28 117.00 115.11 3nwn n LEU 153 Ca 0.03 -3.15 -0.29 0.00 -0.03 0.00 0.00 56.01 52.57 3nwn n LEU 153 Cb 0.19 -0.50 0.15 0.00 -2.33 0.00 0.00 43.42 40.93 3nwn n LEU 153 CO 0.16 0.77 0.71 -0.94 -1.33 0.00 0.00 177.39 176.76 3nwn s SER 154 N -2.45 3.20 0.43 -1.43 1.04 -1.08 -4.95 113.70 108.46 3nwn s SER 154 Ca 0.38 0.92 0.28 0.00 0.48 0.00 0.00 55.95 58.01 3nwn s SER 154 Cb 0.32 -1.44 0.96 0.00 0.10 0.00 0.00 66.02 65.95 3nwn s SER 154 CO 0.05 -2.74 1.81 0.71 0.98 0.00 0.00 173.24 174.05 3nwn h THR 155 N -1.63 0.00 -1.84 2.02 1.35 -1.97 -3.32 112.91 107.53 3nwn h THR 155 Ca -0.50 -0.60 -0.52 0.00 -0.55 0.00 0.00 66.41 64.24 3nwn h THR 155 Cb 1.32 1.55 -0.36 0.00 -1.73 0.00 0.00 68.15 68.94 3nwn h THR 155 CO 0.58 0.00 -1.01 -0.11 -0.25 0.00 0.00 175.52 174.73 3nwn n LEU 156 N -2.85 -0.35 -0.04 3.87 7.94 -1.26 -5.03 117.00 119.28 3nwn n LEU 156 Ca 0.02 -4.45 0.14 0.00 -1.11 0.00 0.00 56.01 50.61 3nwn n LEU 156 Cb 0.37 0.65 0.81 0.00 0.53 0.00 0.00 43.42 45.77 3nwn n LEU 156 CO 0.28 2.02 1.02 -0.81 -1.11 0.00 0.00 177.39 178.80 3nwn n PRO 157 N 1.72 1.05 -0.32 1.96 -0.04 -1.25 -2.61 135.00 135.52 3nwn n PRO 157 Ca 0.21 -0.08 0.10 0.00 -0.04 0.00 0.00 63.50 63.69 3nwn n PRO 157 Cb 0.53 -1.44 0.27 0.00 -0.04 0.00 0.00 33.50 32.82 3nwn n PRO 157 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 3nwn n TYR 158 N -0.85 0.83 -4.37 0.54 4.11 -1.26 -4.69 117.16 111.47 3nwn n TYR 158 Ca 0.21 -0.51 -0.27 0.00 -0.00 0.00 0.00 57.90 57.33 3nwn n TYR 158 Cb 0.12 -0.02 -0.13 0.00 -0.00 0.00 0.00 39.34 39.31 3nwn n TYR 158 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 3nwn s VAL 159 N -1.04 2.13 0.00 -3.48 1.01 -1.07 -4.70 120.40 113.26 3nwn s VAL 159 Ca 0.41 -1.75 0.00 0.00 0.00 0.00 0.00 61.98 60.64 3nwn s VAL 159 Cb 0.21 -1.91 0.00 0.00 0.00 0.00 0.00 36.38 34.68 3nwn s VAL 159 CO 0.27 0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.00 3nwn n GLY 160 N 0.86 -0.93 0.41 4.51 0.00 -1.26 -4.85 105.19 103.93 3nwn n GLY 160 Ca -0.18 -1.66 0.18 0.00 0.00 0.00 0.00 46.02 44.36 3nwn n GLY 160 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3nwn h PRO 161 N 0.00 0.00 -0.96 1.61 0.11 -1.78 -2.66 132.00 128.31 3nwn h PRO 161 Ca 0.00 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.14 3nwn h PRO 161 Cb 0.00 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.06 3nwn h PRO 161 CO 0.00 0.00 0.63 0.66 -0.21 0.00 0.00 178.00 179.08 3nwn h SER 162 N 0.00 1.07 0.23 -2.05 4.64 -1.96 -2.94 113.55 112.53 3nwn h SER 162 Ca 0.21 -0.02 -0.34 0.00 -0.47 0.00 0.00 61.79 61.17 3nwn h SER 162 Cb 1.74 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 63.55 3nwn h SER 162 CO -0.00 0.74 -1.90 0.58 -0.87 0.00 0.00 176.83 175.38 3nwn h VAL 163 N 1.25 0.71 -2.21 0.95 2.07 -1.82 -3.42 116.25 113.78 3nwn h VAL 163 Ca 0.37 -2.45 -0.60 0.00 0.82 0.00 0.00 66.70 64.85 3nwn h VAL 163 Cb -0.05 2.50 -0.42 0.00 -1.52 0.00 0.00 31.29 31.81 3nwn h VAL 163 CO -0.11 0.80 -0.60 0.41 0.02 0.00 0.00 177.57 178.08 3nwn n THR 164 N -3.38 2.52 -2.22 2.57 -1.04 -1.17 -5.09 114.28 106.47 3nwn n THR 164 Ca -0.27 -5.31 -0.41 0.00 -2.04 0.00 0.00 64.05 56.02 3nwn n THR 164 Cb 1.05 -1.94 -0.03 0.00 -1.82 0.00 0.00 70.33 67.59 3nwn n THR 164 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3nwn s PRO 165 N -2.71 4.40 0.06 -2.82 0.04 -1.11 -4.46 135.00 128.40 3nwn s PRO 165 Ca 0.42 2.05 0.05 0.00 0.04 0.00 0.00 61.00 63.56 3nwn s PRO 165 Cb 0.18 -3.19 -0.03 0.00 0.04 0.00 0.00 34.50 31.51 3nwn s PRO 165 CO -0.04 -0.23 -0.13 -1.64 0.04 0.00 0.00 177.00 175.00 3nwn s MET 166 N -0.26 0.83 -0.05 4.56 -1.94 -1.26 -4.56 119.30 116.61 3nwn s MET 166 Ca 0.56 -0.85 -0.02 0.00 -1.71 0.00 0.00 55.69 53.66 3nwn s MET 166 Cb -0.36 -0.82 0.04 0.00 2.01 0.00 0.00 34.83 35.70 3nwn s MET 166 CO 0.39 0.19 0.11 0.99 -0.01 0.00 0.00 175.02 176.69 3nwn s THR 167 N -1.11 -0.10 0.03 2.05 2.01 -0.74 -4.90 115.64 112.88 3nwn s THR 167 Ca -0.01 0.26 -0.30 0.00 0.31 0.00 0.00 61.69 61.94 3nwn s THR 167 Cb -0.09 -0.20 -0.05 0.00 0.01 0.00 0.00 72.50 72.17 3nwn s THR 167 CO 0.02 0.11 1.23 -0.63 -0.69 0.00 0.00 174.62 174.65 3nwn s ILE 168 N 1.49 4.01 0.24 1.82 1.01 -1.26 -0.81 121.20 127.70 3nwn s ILE 168 Ca -0.05 1.42 0.05 0.00 0.00 0.00 0.00 60.65 62.07 3nwn s ILE 168 Cb -0.12 -3.91 -0.05 0.00 0.01 0.00 0.00 42.46 38.38 3nwn s ILE 168 CO -0.05 0.08 -0.04 0.68 0.00 0.00 0.00 174.94 175.61 3nwn s VAL 169 N 1.43 1.30 0.00 2.92 -7.23 0.56 -4.93 120.40 114.46 3nwn s VAL 169 Ca 0.59 -2.08 0.03 0.00 -1.81 0.00 0.00 61.98 58.71 3nwn s VAL 169 Cb -0.29 -2.30 -0.01 0.00 0.56 0.00 0.00 36.38 34.34 3nwn s VAL 169 CO 0.27 -0.38 -0.09 -0.70 -0.31 0.00 0.00 175.10 173.90 3nwn s GLU 170 N -3.79 0.66 0.33 4.82 2.12 -1.26 -0.83 118.70 120.75 3nwn s GLU 170 Ca 0.27 -0.39 0.02 0.00 0.36 0.00 0.00 54.97 55.23 3nwn s GLU 170 Cb 0.04 -0.62 -0.01 0.00 0.26 0.00 0.00 34.13 33.81 3nwn s GLU 170 CO 0.09 0.16 0.40 0.27 -0.54 0.00 0.00 175.26 175.64 3nwn n ASN 171 N 2.61 -1.08 0.28 -1.70 0.23 0.02 -5.00 115.26 110.61 3nwn n ASN 171 Ca -0.15 -2.95 0.12 0.00 -0.53 0.00 0.00 54.58 51.08 3nwn n ASN 171 Cb 0.57 2.15 0.66 0.00 -2.08 0.00 0.00 39.78 41.08 3nwn n ASN 171 CO 0.00 0.00 0.00 -0.65 -0.93 0.00 0.00 177.26 175.68 3nwn h PRO 172 N 0.00 0.00 -0.00 -0.53 0.11 -2.05 -0.98 132.00 128.54 3nwn h PRO 172 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 3nwn h PRO 172 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3nwn h PRO 172 CO 0.35 0.00 -0.64 1.04 -0.21 0.00 0.00 178.00 178.53 3nwn n GLN 173 N -2.61 0.38 0.00 1.05 6.02 -1.26 -5.08 117.38 115.88 3nwn n GLN 173 Ca -0.02 -0.28 0.00 0.00 -0.01 0.00 0.00 57.00 56.69 3nwn n GLN 173 Cb 0.35 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.12 3nwn n GLN 173 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3nwn n GLY 174 N 1.46 0.77 3.55 1.08 0.00 -0.37 -5.06 105.19 106.62 3nwn n GLY 174 Ca 0.07 -2.07 -0.35 0.00 0.00 0.00 0.00 46.02 43.66 3nwn n GLY 174 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3nwn s VAL 175 N -1.56 4.49 0.36 1.61 1.01 -1.26 -0.80 120.40 124.25 3nwn s VAL 175 Ca 0.00 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 61.88 3nwn s VAL 175 Cb 0.00 -3.04 -0.04 0.00 0.00 0.00 0.00 36.38 33.30 3nwn s VAL 175 CO 0.00 0.43 0.10 -0.36 0.00 0.00 0.00 175.10 175.26 3nwn s PHE 176 N 0.76 1.83 -0.34 5.22 0.08 -0.01 -4.98 117.98 120.54 3nwn s PHE 176 Ca 0.03 -1.14 0.03 0.00 0.12 0.00 0.00 56.93 55.96 3nwn s PHE 176 Cb -0.14 -1.19 0.10 0.00 -0.57 0.00 0.00 43.02 41.23 3nwn s PHE 176 CO 0.02 -0.17 0.06 0.42 -0.10 0.00 0.00 175.22 175.45 3nwn s ILE 177 N -3.30 2.44 0.06 0.64 1.01 -1.26 -0.32 121.20 120.47 3nwn s ILE 177 Ca 0.30 -2.23 -0.33 0.00 0.00 0.00 0.00 60.65 58.40 3nwn s ILE 177 Cb 0.06 -2.74 -0.12 0.00 0.01 0.00 0.00 42.46 39.66 3nwn s ILE 177 CO 0.15 -0.56 1.79 1.17 0.00 0.00 0.00 174.94 177.49 3nwn n LYS 178 N 4.33 2.43 0.00 2.79 4.81 0.01 -1.86 118.16 130.67 3nwn n LYS 178 Ca 0.01 0.89 0.00 0.00 -0.87 0.00 0.00 58.31 58.34 3nwn n LYS 178 Cb 0.42 -2.73 0.00 0.00 0.02 0.00 0.00 35.03 32.74 3nwn n LYS 178 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3nwn n GLY 179 N 4.08 0.53 3.64 3.14 0.00 -1.26 -1.80 105.19 113.53 3nwn n GLY 179 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 3nwn n GLY 179 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3nwn s LEU 180 N 0.00 4.09 0.31 0.99 2.96 -0.77 -4.88 118.68 121.37 3nwn s LEU 180 Ca 0.00 0.79 -0.29 0.00 -0.22 0.00 0.00 54.13 54.41 3nwn s LEU 180 Cb 0.00 -2.91 -0.10 0.00 0.50 0.00 0.00 46.19 43.68 3nwn s LEU 180 CO 0.00 -0.35 1.34 -0.94 -1.32 0.00 0.00 176.35 175.08 3nwn s SER 181 N 1.36 6.74 -0.13 3.68 1.04 -1.26 -4.96 113.70 120.17 3nwn s SER 181 Ca 0.28 2.67 0.03 0.00 0.48 0.00 0.00 55.95 59.41 3nwn s SER 181 Cb -0.16 -2.64 0.01 0.00 0.10 0.00 0.00 66.02 63.33 3nwn s SER 181 CO 0.09 -0.58 -0.21 -0.69 0.98 0.00 0.00 173.24 172.83 3nwn s VAL 182 N -0.81 1.99 -0.15 5.02 1.01 -1.26 -4.52 120.40 121.68 3nwn s VAL 182 Ca 0.52 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.57 3nwn s VAL 182 Cb -0.40 -1.75 0.01 0.00 0.00 0.00 0.00 36.38 34.23 3nwn s VAL 182 CO 0.50 0.54 -0.19 -1.00 0.00 0.00 0.00 175.10 174.94 3nwn s HIS 183 N 0.76 2.72 0.07 5.22 3.76 -0.06 -4.92 115.29 122.84 3nwn s HIS 183 Ca -0.09 -1.28 -0.31 0.00 -0.15 0.00 0.00 55.06 53.23 3nwn s HIS 183 Cb -0.16 -1.85 -0.06 0.00 1.11 0.00 0.00 32.58 31.62 3nwn s HIS 183 CO -0.00 -0.59 1.19 -1.17 -0.85 0.00 0.00 174.74 173.31 3nwn s LEU 184 N 0.88 4.38 -0.31 0.89 2.96 -1.26 -0.13 118.68 126.08 3nwn s LEU 184 Ca -0.05 2.02 0.03 0.00 -0.22 0.00 0.00 54.13 55.91 3nwn s LEU 184 Cb -0.15 -3.58 0.09 0.00 0.50 0.00 0.00 46.19 43.05 3nwn s LEU 184 CO -0.03 -0.45 0.01 0.42 -1.32 0.00 0.00 176.35 174.99 3nwn s THR 185 N 0.96 2.11 0.27 3.68 -4.23 -0.03 -4.96 115.64 113.45 3nwn s THR 185 Ca 0.58 -2.06 0.07 0.00 -1.18 0.00 0.00 61.69 59.10 3nwn s THR 185 Cb -0.29 -2.47 -0.01 0.00 1.34 0.00 0.00 72.50 71.07 3nwn s THR 185 CO 0.30 -0.45 1.63 0.28 -0.54 0.00 0.00 174.62 175.83 3nwn h SER 186 N 7.70 0.20 -5.35 3.99 0.02 -1.95 -3.38 113.55 114.78 3nwn h SER 186 Ca -0.09 -0.10 -0.14 0.00 -0.84 0.00 0.00 61.79 60.62 3nwn h SER 186 Cb 1.03 -0.06 -0.13 0.00 0.14 0.00 0.00 62.40 63.38 3nwn h SER 186 CO 0.50 0.70 -0.45 -1.10 -1.14 0.00 0.00 176.83 175.33 3nwn s GLN 187 N -3.87 1.10 0.48 3.45 -0.21 -1.26 -4.99 119.66 114.36 3nwn s GLN 187 Ca -0.04 -1.32 0.14 0.00 0.02 0.00 0.00 55.36 54.17 3nwn s GLN 187 Cb 0.13 0.32 1.12 0.00 1.00 0.00 0.00 33.01 35.58 3nwn s GLN 187 CO 0.78 -0.37 2.08 1.05 -2.12 0.00 0.00 175.29 176.71 3nwn h GLU 188 N 2.65 0.07 -0.52 2.91 4.11 -1.92 -0.66 114.58 121.23 3nwn h GLU 188 Ca -0.33 -0.01 -0.06 0.00 0.07 0.00 0.00 59.36 59.04 3nwn h GLU 188 Cb 1.22 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 3nwn h GLU 188 CO 0.52 0.11 0.09 0.93 0.07 0.00 0.00 179.01 180.73 3nwn h GLU 189 N 0.07 0.82 -0.80 1.06 3.07 -1.98 0.14 114.58 116.96 3nwn h GLU 189 Ca 0.02 -0.18 -0.05 0.00 -0.50 0.00 0.00 59.36 58.65 3nwn h GLU 189 Cb 0.10 -0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 27.86 3nwn h GLU 189 CO 0.00 0.76 0.31 -0.44 -1.40 0.00 0.00 179.01 178.25 3nwn h ASP 190 N 0.78 1.11 -0.19 1.42 3.32 -1.51 -1.37 116.42 119.97 3nwn h ASP 190 Ca 0.17 -0.18 -0.19 0.00 0.02 0.00 0.00 57.03 56.85 3nwn h ASP 190 Cb 0.34 -0.29 0.01 0.00 0.22 0.00 0.00 39.33 39.61 3nwn h ASP 190 CO 0.00 0.99 -0.61 0.00 -1.72 0.00 0.00 179.24 177.90 3nwn h ALA 191 N 1.17 0.33 -0.73 3.45 0.00 -1.22 -2.84 119.26 119.42 3nwn h ALA 191 Ca 0.26 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3nwn h ALA 191 Cb 0.23 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 3nwn h ALA 191 CO -0.02 0.59 0.47 0.74 0.00 0.00 0.00 179.25 181.02 3nwn h PHE 192 N 0.47 0.92 -0.27 0.00 0.04 -0.69 -1.38 116.94 116.03 3nwn h PHE 192 Ca -0.02 0.02 -0.13 0.00 2.80 0.00 0.00 57.97 60.64 3nwn h PHE 192 Cb 1.23 -0.31 -0.00 0.00 2.20 0.00 0.00 35.95 39.07 3nwn h PHE 192 CO 0.09 0.59 -0.32 0.77 -0.60 0.00 0.00 178.31 178.84 3nwn h SER 193 N 0.99 0.76 -0.62 2.17 0.02 -1.21 -1.99 113.55 113.67 3nwn h SER 193 Ca 0.26 -0.49 -0.06 0.00 -0.84 0.00 0.00 61.79 60.67 3nwn h SER 193 Cb -0.09 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.21 3nwn h SER 193 CO -0.05 1.09 0.17 -0.07 -1.14 0.00 0.00 176.83 176.83 3nwn h LEU 194 N 0.44 0.94 -0.32 5.07 3.38 -1.42 0.53 115.31 123.93 3nwn h LEU 194 Ca 0.04 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 3nwn h LEU 194 Cb 0.90 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 3nwn h LEU 194 CO 0.08 0.90 0.18 0.25 0.09 0.00 0.00 178.44 179.95 3nwn h LEU 195 N 0.96 0.39 -0.09 1.67 5.85 -1.14 -0.65 115.31 122.32 3nwn h LEU 195 Ca 0.21 -0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.89 3nwn h LEU 195 Cb 0.32 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 3nwn h LEU 195 CO -0.00 0.35 -0.13 0.15 -0.34 0.00 0.00 178.44 178.47 3nwn h PHE 196 N 0.41 -0.33 -0.49 1.25 3.57 -1.23 -1.50 116.94 118.61 3nwn h PHE 196 Ca 0.11 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.71 3nwn h PHE 196 Cb 0.04 0.16 -0.06 0.00 2.79 0.00 0.00 35.95 38.88 3nwn h PHE 196 CO -0.03 -0.20 0.12 1.49 -2.23 0.00 0.00 178.31 177.46 3nwn h GLU 197 N -0.18 0.26 -0.16 1.11 4.81 -0.75 -0.96 114.58 118.71 3nwn h GLU 197 Ca 0.08 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.16 3nwn h GLU 197 Cb 0.29 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 3nwn h GLU 197 CO -0.19 0.17 -0.48 0.78 -0.73 0.00 0.00 179.01 178.56 3nwn h GLY 198 N 0.27 0.44 0.70 1.92 0.00 -0.98 0.55 103.07 105.96 3nwn h GLY 198 Ca 0.24 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 3nwn h GLY 198 CO -0.30 0.42 -0.01 -2.09 0.00 0.00 0.00 176.54 174.56 3nwn h GLU 199 N 0.32 0.14 -0.58 4.80 4.57 -1.18 0.71 114.58 123.36 3nwn h GLU 199 Ca 0.02 -0.05 0.09 0.00 -1.18 0.00 0.00 59.36 58.23 3nwn h GLU 199 Cb 0.97 -0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 29.48 3nwn h GLU 199 CO 0.08 0.46 0.21 1.15 -1.18 0.00 0.00 179.01 179.73 3nwn h THR 200 N -0.19 0.78 -0.64 0.32 2.02 -1.03 -2.53 112.91 111.64 3nwn h THR 200 Ca 0.02 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 67.04 3nwn h THR 200 Cb 0.40 0.35 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 3nwn h THR 200 CO 0.01 0.07 0.32 0.78 0.37 0.00 0.00 175.52 177.06 3nwn h ASN 201 N 0.39 0.82 -0.08 4.18 2.35 -0.74 -2.04 115.58 120.46 3nwn h ASN 201 Ca 0.29 -0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 55.96 3nwn h ASN 201 Cb 0.35 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.51 3nwn h ASN 201 CO -0.30 0.69 0.04 -0.09 -1.65 0.00 0.00 177.43 176.12 3nwn h ARG 202 N 0.91 0.11 -0.23 0.81 2.43 -0.49 0.54 114.38 118.46 3nwn h ARG 202 Ca 0.23 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.39 3nwn h ARG 202 Cb 0.08 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 3nwn h ARG 202 CO -0.03 0.18 0.14 0.82 -1.51 0.00 0.00 179.97 179.57 3nwn h ILE 203 N 0.01 1.04 -0.44 1.20 2.04 -1.15 -0.46 117.51 119.74 3nwn h ILE 203 Ca 0.03 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.77 3nwn h ILE 203 Cb 0.11 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 3nwn h ILE 203 CO -0.00 0.05 0.21 0.40 0.00 0.00 0.00 178.15 178.81 3nwn h ILE 204 N 0.29 1.18 -0.36 -0.67 2.04 -1.20 -2.51 117.51 116.28 3nwn h ILE 204 Ca 0.09 -0.52 -0.04 0.00 1.00 0.00 0.00 64.86 65.38 3nwn h ILE 204 Cb -0.02 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 3nwn h ILE 204 CO -0.03 0.20 0.04 0.00 0.00 0.00 0.00 178.15 178.36 3nwn h ALA 205 N 1.06 1.40 -0.58 1.87 0.00 -0.66 0.38 119.26 122.71 3nwn h ALA 205 Ca 0.15 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 3nwn h ALA 205 Cb 0.13 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3nwn h ALA 205 CO -0.02 0.43 -0.02 0.66 0.00 0.00 0.00 179.25 180.30 3nwn h SER 206 N 0.53 1.01 -0.12 0.00 4.64 -0.67 0.01 113.55 118.96 3nwn h SER 206 Ca 0.12 -0.29 -0.09 0.00 -0.47 0.00 0.00 61.79 61.06 3nwn h SER 206 Cb 0.28 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 3nwn h SER 206 CO 0.00 1.07 -0.27 0.45 -0.87 0.00 0.00 176.83 177.21 3nwn h HIS 207 N 0.94 0.50 -0.35 4.77 -0.00 -1.14 -0.60 115.15 119.27 3nwn h HIS 207 Ca 0.17 -0.19 -0.11 0.00 -0.00 0.00 0.00 60.37 60.24 3nwn h HIS 207 Cb 0.57 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.41 27.87 3nwn h HIS 207 CO 0.04 0.89 -0.24 1.15 -0.00 0.00 0.00 177.93 179.76 3nwn h THR 208 N -0.04 1.27 -0.29 2.45 2.02 -0.18 -3.11 112.91 115.03 3nwn h THR 208 Ca -0.00 -1.34 0.00 0.00 0.77 0.00 0.00 66.41 65.84 3nwn h THR 208 Cb 0.88 1.27 0.00 0.00 -1.74 0.00 0.00 68.15 68.56 3nwn h THR 208 CO 0.06 0.44 0.00 0.23 0.37 0.00 0.00 175.52 176.62 3nwn n MET 209 N -4.11 2.24 -3.63 6.66 2.81 -0.02 -4.98 117.12 116.09 3nwn n MET 209 Ca -0.00 -2.07 -0.21 0.00 -1.81 0.00 0.00 57.70 53.61 3nwn n MET 209 Cb 0.43 -1.44 0.05 0.00 -0.71 0.00 0.00 33.22 31.56 3nwn n MET 209 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3nwn n ASN 210 N 1.25 -2.17 -4.84 7.83 4.13 -0.40 -4.98 115.26 116.07 3nwn n ASN 210 Ca 0.16 -0.74 -0.37 0.00 1.68 0.00 0.00 54.58 55.32 3nwn n ASN 210 Cb 0.54 -4.43 -0.06 0.00 -1.54 0.00 0.00 39.78 34.29 3nwn n ASN 210 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 3nwn s LYS 211 N -5.88 3.95 -0.39 3.52 1.02 -0.37 -5.05 119.74 116.54 3nwn s LYS 211 Ca 0.11 0.44 -0.21 0.00 0.02 0.00 0.00 55.97 56.32 3nwn s LYS 211 Cb -0.05 -3.12 0.01 0.00 -0.52 0.00 0.00 37.83 34.15 3nwn s LYS 211 CO 0.78 0.61 0.68 1.21 -0.92 0.00 0.00 175.35 177.72 3nwn s ASN 212 N -1.36 6.43 0.54 2.83 3.84 -1.26 -4.73 114.94 121.22 3nwn s ASN 212 Ca 0.29 0.06 0.30 0.00 0.21 0.00 0.00 52.86 53.72 3nwn s ASN 212 Cb -0.16 -2.35 1.55 0.00 -0.55 0.00 0.00 41.25 39.74 3nwn s ASN 212 CO 0.16 -0.70 2.10 0.77 -2.79 0.00 0.00 177.10 176.65 3nwn h SER 213 N 8.61 0.00 0.14 -4.21 4.64 -1.96 -1.92 113.55 118.85 3nwn h SER 213 Ca -0.26 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3nwn h SER 213 Cb 1.10 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3nwn h SER 213 CO 0.88 0.09 -0.01 0.77 -0.87 0.00 0.00 176.83 177.69 3nwn h SER 214 N 0.00 0.00 0.02 4.97 4.64 -1.97 -2.44 113.55 118.77 3nwn h SER 214 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3nwn h SER 214 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 3nwn h SER 214 CO 0.01 0.01 -0.17 0.54 -0.87 0.00 0.00 176.83 176.35 3nwn n ARG 215 N -3.28 1.67 -3.85 4.77 1.74 -0.72 -0.11 116.66 116.89 3nwn n ARG 215 Ca -0.03 -1.27 -0.31 0.00 -0.77 0.00 0.00 57.85 55.48 3nwn n ARG 215 Cb 0.11 -1.47 -0.04 0.00 -1.02 0.00 0.00 32.46 30.04 3nwn n ARG 215 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3nwn s SER 216 N -2.21 6.40 -0.14 0.55 1.04 -0.92 -4.63 113.70 113.78 3nwn s SER 216 Ca 0.27 0.36 -0.05 0.00 0.48 0.00 0.00 55.95 57.00 3nwn s SER 216 Cb 0.20 -2.00 -0.04 0.00 0.10 0.00 0.00 66.02 64.28 3nwn s SER 216 CO 0.42 0.13 0.05 -1.00 0.98 0.00 0.00 173.24 173.82 3nwn s HIS 217 N -1.57 3.27 -0.10 5.02 3.76 -0.12 -2.51 115.29 123.05 3nwn s HIS 217 Ca 0.37 0.16 0.04 0.00 -0.15 0.00 0.00 55.06 55.48 3nwn s HIS 217 Cb -0.13 -1.96 -0.00 0.00 1.11 0.00 0.00 32.58 31.60 3nwn s HIS 217 CO 0.27 0.34 -0.24 0.00 -0.85 0.00 0.00 174.74 174.26 3nwn s ILE 219 N 0.34 1.50 -0.21 0.00 1.01 0.22 -1.08 121.20 122.98 3nwn s ILE 219 Ca -0.19 -1.43 -0.19 0.00 0.00 0.00 0.00 60.65 58.84 3nwn s ILE 219 Cb -0.18 -1.90 -0.03 0.00 0.01 0.00 0.00 42.46 40.36 3nwn s ILE 219 CO 0.09 -0.30 0.56 0.12 0.00 0.00 0.00 174.94 175.40 3nwn s PHE 220 N 1.37 3.36 -0.14 3.97 5.36 -0.37 -1.72 117.98 129.80 3nwn s PHE 220 Ca 0.00 0.81 -0.00 0.00 -0.96 0.00 0.00 56.93 56.78 3nwn s PHE 220 Cb -0.19 -2.72 -0.01 0.00 -0.34 0.00 0.00 43.02 39.76 3nwn s PHE 220 CO -0.10 -0.15 -0.13 0.99 -1.46 0.00 0.00 175.22 174.37 3nwn s THR 221 N 1.80 3.01 -0.28 0.12 2.01 -0.50 -0.52 115.64 121.27 3nwn s THR 221 Ca 0.25 -0.67 -0.09 0.00 0.31 0.00 0.00 61.69 61.49 3nwn s THR 221 Cb -0.16 -2.27 -0.02 0.00 0.01 0.00 0.00 72.50 70.07 3nwn s THR 221 CO 0.10 0.52 0.12 -0.63 -0.69 0.00 0.00 174.62 174.04 3nwn s ILE 222 N 0.45 4.57 -0.26 1.82 1.01 -0.11 -1.48 121.20 127.20 3nwn s ILE 222 Ca -0.10 -0.25 -0.14 0.00 0.00 0.00 0.00 60.65 60.16 3nwn s ILE 222 Cb -0.16 -3.24 -0.04 0.00 0.01 0.00 0.00 42.46 39.03 3nwn s ILE 222 CO 0.05 0.20 0.32 -0.31 0.00 0.00 0.00 174.94 175.19 3nwn s TYR 223 N 1.63 3.27 -0.08 3.97 2.02 0.62 -0.81 117.35 127.97 3nwn s TYR 223 Ca 0.06 0.38 0.01 0.00 -0.37 0.00 0.00 57.07 57.14 3nwn s TYR 223 Cb -0.16 -2.49 -0.03 0.00 -0.40 0.00 0.00 41.96 38.88 3nwn s TYR 223 CO 0.06 -0.14 -0.09 -0.51 -1.57 0.00 0.00 175.55 173.30 3nwn s LEU 224 N 1.75 3.02 -0.06 -1.29 1.43 0.10 -1.47 118.68 122.17 3nwn s LEU 224 Ca 0.13 -0.11 -0.00 0.00 -1.03 0.00 0.00 54.13 53.12 3nwn s LEU 224 Cb -0.15 -1.66 0.03 0.00 0.03 0.00 0.00 46.19 44.44 3nwn s LEU 224 CO 0.09 0.32 -0.01 -0.70 0.23 0.00 0.00 176.35 176.27 3nwn s GLU 225 N -0.54 0.67 -0.03 1.70 -6.30 -0.86 -1.16 118.70 112.19 3nwn s GLU 225 Ca 0.08 0.04 0.01 0.00 -2.50 0.00 0.00 54.97 52.59 3nwn s GLU 225 Cb -0.12 -0.91 0.02 0.00 0.00 0.00 0.00 34.13 33.12 3nwn s GLU 225 CO 0.02 -0.23 -0.02 0.00 0.02 0.00 0.00 175.26 175.05 3nwn s ALA 226 N 1.59 0.43 0.02 6.30 0.00 -0.66 -0.36 121.76 129.07 3nwn s ALA 226 Ca -0.01 0.02 -0.03 0.00 0.00 0.00 0.00 51.96 51.94 3nwn s ALA 226 Cb -0.13 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.69 3nwn s ALA 226 CO -0.04 -0.01 0.03 -3.38 0.00 0.00 0.00 175.76 172.37 3nwn s HIS 227 N 0.69 0.22 -0.09 0.00 -3.43 -0.95 -1.42 115.29 110.31 3nwn s HIS 227 Ca -0.08 -0.47 -0.03 0.00 -0.80 0.00 0.00 55.06 53.68 3nwn s HIS 227 Cb -0.11 -0.16 0.01 0.00 -1.43 0.00 0.00 32.58 30.89 3nwn s HIS 227 CO -0.01 -0.25 0.07 1.63 -2.00 0.00 0.00 174.74 174.18 3nwn n LYS 235 N 1.34 -2.24 -4.12 -0.38 5.02 -1.26 -1.57 118.16 114.96 3nwn n LYS 235 Ca -0.22 1.93 -0.34 0.00 -2.02 0.00 0.00 58.31 57.65 3nwn n LYS 235 Cb 0.56 -2.51 -0.14 0.00 -0.02 0.00 0.00 35.03 32.92 3nwn n LYS 235 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3nwn s TYR 236 N -0.56 2.94 0.01 2.13 2.02 -1.26 -5.11 117.35 117.52 3nwn s TYR 236 Ca -0.08 -0.79 0.04 0.00 -0.37 0.00 0.00 57.07 55.87 3nwn s TYR 236 Cb 0.01 -2.04 -0.01 0.00 -0.40 0.00 0.00 41.96 39.51 3nwn s TYR 236 CO 0.30 -0.42 -0.11 0.42 -1.57 0.00 0.00 175.55 174.17 3nwn s ILE 237 N 1.14 0.90 0.06 2.71 1.01 -0.51 -5.04 121.20 121.47 3nwn s ILE 237 Ca 0.02 -0.62 0.03 0.00 0.00 0.00 0.00 60.65 60.08 3nwn s ILE 237 Cb -0.15 -0.78 -0.03 0.00 0.01 0.00 0.00 42.46 41.52 3nwn s ILE 237 CO -0.01 0.16 -0.09 0.42 0.00 0.00 0.00 174.94 175.42 3nwn s THR 238 N -0.45 0.69 0.25 2.92 -4.23 -1.26 -1.66 115.64 111.90 3nwn s THR 238 Ca 0.03 -1.26 -0.17 0.00 -1.18 0.00 0.00 61.69 59.11 3nwn s THR 238 Cb -0.05 -0.87 0.01 0.00 1.34 0.00 0.00 72.50 72.93 3nwn s THR 238 CO 0.00 -0.42 0.58 -0.94 -0.54 0.00 0.00 174.62 173.30 3nwn s SER 239 N -1.84 -0.20 0.01 3.99 1.04 -0.31 -4.60 113.70 111.79 3nwn s SER 239 Ca -0.05 -0.69 0.04 0.00 0.48 0.00 0.00 55.95 55.73 3nwn s SER 239 Cb -0.08 0.64 -0.01 0.00 0.10 0.00 0.00 66.02 66.67 3nwn s SER 239 CO 0.00 -1.20 -0.13 -0.54 0.98 0.00 0.00 173.24 172.36 3nwn s LYS 240 N -3.94 0.95 -0.20 4.02 1.02 -1.26 0.03 119.74 120.36 3nwn s LYS 240 Ca 0.15 -0.56 -0.04 0.00 0.02 0.00 0.00 55.97 55.54 3nwn s LYS 240 Cb -0.03 -0.93 -0.01 0.00 -0.52 0.00 0.00 37.83 36.34 3nwn s LYS 240 CO 0.05 0.25 -0.04 0.42 -0.92 0.00 0.00 175.35 175.11 3nwn s ILE 241 N -0.52 3.51 -0.25 2.17 1.01 0.01 -1.49 121.20 125.64 3nwn s ILE 241 Ca 0.03 -0.46 -0.06 0.00 0.00 0.00 0.00 60.65 60.16 3nwn s ILE 241 Cb -0.06 -2.58 -0.02 0.00 0.01 0.00 0.00 42.46 39.81 3nwn s ILE 241 CO 0.00 0.43 0.04 0.20 0.00 0.00 0.00 174.94 175.62 3nwn s ASN 242 N 1.21 4.93 -0.29 3.58 0.01 0.64 -0.94 114.94 124.08 3nwn s ASN 242 Ca 0.03 -0.33 -0.06 0.00 -0.71 0.00 0.00 52.86 51.79 3nwn s ASN 242 Cb -0.14 -1.87 0.01 0.00 0.41 0.00 0.00 41.25 39.66 3nwn s ASN 242 CO -0.01 -0.05 0.06 -0.76 -1.51 0.00 0.00 177.10 174.82 3nwn s LEU 243 N 1.57 3.76 -0.12 0.60 1.43 0.32 -0.33 118.68 125.90 3nwn s LEU 243 Ca 0.06 -0.77 0.03 0.00 -1.03 0.00 0.00 54.13 52.41 3nwn s LEU 243 Cb -0.15 -1.84 0.01 0.00 0.03 0.00 0.00 46.19 44.24 3nwn s LEU 243 CO 0.02 -0.19 -0.21 -0.69 0.23 0.00 0.00 176.35 175.51 3nwn s VAL 244 N 1.46 1.93 -0.38 -1.59 1.01 0.92 -1.24 120.40 122.51 3nwn s VAL 244 Ca 0.02 -0.91 -0.05 0.00 0.00 0.00 0.00 61.98 61.04 3nwn s VAL 244 Cb -0.17 -1.70 0.08 0.00 0.00 0.00 0.00 36.38 34.58 3nwn s VAL 244 CO 0.01 0.53 0.16 -0.62 0.00 0.00 0.00 175.10 175.18 3nwn s ASP 245 N 0.70 5.28 0.66 3.32 -1.08 -0.24 -0.66 116.67 124.66 3nwn s ASP 245 Ca -0.11 -1.60 -0.10 0.00 -0.52 0.00 0.00 52.55 50.22 3nwn s ASP 245 Cb -0.16 -1.85 -0.00 0.00 -1.46 0.00 0.00 42.92 39.45 3nwn s ASP 245 CO 0.01 -0.45 1.04 -0.76 0.52 0.00 0.00 175.17 175.54 3nwn s LEU 246 N 1.28 3.05 0.62 -1.34 1.43 -0.95 -1.06 118.68 121.71 3nwn s LEU 246 Ca 0.02 1.14 -0.19 0.00 -1.03 0.00 0.00 54.13 54.07 3nwn s LEU 246 Cb -0.22 -4.00 -0.02 0.00 0.03 0.00 0.00 46.19 41.98 3nwn s LEU 246 CO -0.01 -1.16 1.28 0.00 0.23 0.00 0.00 176.35 176.69 3nwn s ALA 247 N -3.25 2.49 0.28 4.21 0.00 -1.04 -4.80 121.76 119.65 3nwn s ALA 247 Ca 0.56 1.19 -0.30 0.00 0.00 0.00 0.00 51.96 53.42 3nwn s ALA 247 Cb -0.11 -3.53 -0.13 0.00 0.00 0.00 0.00 23.12 19.35 3nwn s ALA 247 CO 0.51 -1.46 1.32 0.41 0.00 0.00 0.00 175.76 176.54 3nwn n GLY 248 N 0.79 0.59 0.86 0.00 0.00 0.85 -4.68 105.19 103.60 3nwn n GLY 248 Ca 0.14 0.41 0.10 0.00 0.00 0.00 0.00 46.02 46.68 3nwn n GLY 248 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3nwn n SER 249 N 1.50 2.56 -2.25 1.61 3.41 -0.78 -4.57 113.62 115.09 3nwn n SER 249 Ca 0.09 -1.88 0.00 0.00 -0.26 0.00 0.00 58.87 56.81 3nwn n SER 249 Cb 0.33 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 3nwn n SER 249 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 3nwn n GLU 250 N 0.90 0.00 -3.40 4.33 0.00 -1.26 -4.80 120.64 116.40 3nwn n GLU 250 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 57.16 56.95 3nwn n GLU 250 Cb 0.45 -1.48 -0.08 0.00 0.00 0.00 0.00 31.44 30.34 3nwn n GLU 250 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 3nwn s TYR 267 N 2.45 3.37 0.11 -1.84 1.51 -1.26 -4.57 117.35 117.12 3nwn s TYR 267 Ca 0.00 0.59 -0.17 0.00 -1.01 0.00 0.00 57.07 56.48 3nwn s TYR 267 Cb 0.00 -2.51 -0.04 0.00 -0.11 0.00 0.00 41.96 39.30 3nwn s TYR 267 CO 0.00 -0.01 1.61 0.82 -1.11 0.00 0.00 175.55 176.86 3nwn h ILE 268 N 5.04 1.22 -3.00 2.71 1.08 -1.89 -3.38 117.51 119.30 3nwn h ILE 268 Ca -0.36 -0.75 -0.72 0.00 -0.39 0.00 0.00 64.86 62.64 3nwn h ILE 268 Cb 1.16 1.08 -0.21 0.00 -3.07 0.00 0.00 36.82 35.79 3nwn h ILE 268 CO 0.71 0.25 0.17 0.20 -0.69 0.00 0.00 178.15 178.79 3nwn s ASN 269 N -5.91 6.32 0.27 1.72 0.01 -1.26 -4.96 114.94 111.12 3nwn s ASN 269 Ca -0.13 -1.72 -0.08 0.00 -0.71 0.00 0.00 52.86 50.21 3nwn s ASN 269 Cb 0.09 -2.29 0.45 0.00 0.41 0.00 0.00 41.25 39.90 3nwn s ASN 269 CO 0.75 -1.01 1.58 0.50 -1.51 0.00 0.00 177.10 177.42 3nwn h LYS 270 N 8.91 0.01 -0.38 -0.60 3.64 -1.98 -2.55 116.57 123.62 3nwn h LYS 270 Ca -0.18 -0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.31 3nwn h LYS 270 Cb 1.07 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.88 3nwn h LYS 270 CO 1.05 0.01 0.31 0.66 -2.27 0.00 0.00 179.45 179.20 3nwn h SER 271 N 0.01 0.00 -0.03 4.20 4.64 -1.96 0.20 113.55 120.61 3nwn h SER 271 Ca 0.45 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.75 3nwn h SER 271 Cb 0.73 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.82 3nwn h SER 271 CO -0.90 0.00 -0.03 -0.07 -0.87 0.00 0.00 176.83 174.96 3nwn h LEU 272 N 0.00 0.16 -0.67 5.97 3.38 -1.87 -1.95 115.31 120.33 3nwn h LEU 272 Ca 0.18 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 58.01 3nwn h LEU 272 Cb 0.79 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 3nwn h LEU 272 CO -0.00 0.22 -0.27 0.77 0.09 0.00 0.00 178.44 179.25 3nwn h SER 273 N 0.17 0.77 -0.30 -0.43 4.64 -0.76 0.25 113.55 117.89 3nwn h SER 273 Ca 0.04 -0.29 -0.16 0.00 -0.47 0.00 0.00 61.79 60.91 3nwn h SER 273 Cb 0.17 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.04 3nwn h SER 273 CO 0.01 1.00 -0.41 -0.26 -0.87 0.00 0.00 176.83 176.29 3nwn h PHE 274 N 0.64 1.03 -0.59 4.77 0.04 -1.52 0.22 116.94 121.53 3nwn h PHE 274 Ca 0.08 -0.32 0.01 0.00 2.80 0.00 0.00 57.97 60.55 3nwn h PHE 274 Cb 0.78 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 38.69 3nwn h PHE 274 CO 0.04 1.12 0.39 1.25 -0.60 0.00 0.00 178.31 180.51 3nwn h LEU 275 N 0.69 0.66 -0.28 1.54 5.85 -1.05 0.13 115.31 122.86 3nwn h LEU 275 Ca 0.05 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.69 3nwn h LEU 275 Cb 0.99 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.85 3nwn h LEU 275 CO 0.10 0.48 -0.10 -0.08 -0.34 0.00 0.00 178.44 178.49 3nwn h GLU 276 N 0.79 0.55 -0.76 1.25 4.81 -0.38 -2.35 114.58 118.50 3nwn h GLU 276 Ca 0.22 -0.23 0.12 0.00 -0.13 0.00 0.00 59.36 59.35 3nwn h GLU 276 Cb -0.07 -0.02 -0.09 0.00 0.63 0.00 0.00 28.75 29.20 3nwn h GLU 276 CO -0.06 0.78 0.35 0.37 -0.73 0.00 0.00 179.01 179.72 3nwn h GLN 277 N 0.30 0.52 -0.38 1.92 4.15 -0.48 -0.84 115.11 120.31 3nwn h GLN 277 Ca 0.07 -0.03 0.02 0.00 0.77 0.00 0.00 58.65 59.47 3nwn h GLN 277 Cb 0.60 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 28.14 3nwn h GLN 277 CO 0.03 0.35 0.22 0.00 -1.93 0.00 0.00 178.83 177.50 3nwn h ALA 278 N 1.50 0.47 -0.07 3.38 0.00 -0.55 -1.00 119.26 123.00 3nwn h ALA 278 Ca 0.40 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.20 3nwn h ALA 278 Cb 0.53 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3nwn h ALA 278 CO -0.34 -0.13 -0.45 0.82 0.00 0.00 0.00 179.25 179.14 3nwn h ILE 279 N 0.44 1.33 -0.19 0.00 2.04 -1.02 -0.78 117.51 119.33 3nwn h ILE 279 Ca 0.15 -1.61 -0.02 0.00 1.00 0.00 0.00 64.86 64.38 3nwn h ILE 279 Cb 0.01 1.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 3nwn h ILE 279 CO -0.07 0.47 0.05 0.40 0.00 0.00 0.00 178.15 179.00 3nwn h ILE 280 N 0.13 1.19 -0.38 -0.67 2.04 -0.92 -2.31 117.51 116.61 3nwn h ILE 280 Ca 0.01 -0.61 0.02 0.00 1.00 0.00 0.00 64.86 65.27 3nwn h ILE 280 Cb 0.86 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 38.16 3nwn h ILE 280 CO 0.07 0.19 0.21 0.00 0.00 0.00 0.00 178.15 178.62 3nwn h ALA 281 N 0.87 0.47 -0.31 1.87 0.00 -0.49 -2.42 119.26 119.25 3nwn h ALA 281 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3nwn h ALA 281 Cb 0.25 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3nwn h ALA 281 CO -0.00 -0.14 0.15 -0.07 0.00 0.00 0.00 179.25 179.19 3nwn h LEU 282 N 0.43 0.38 -0.65 0.00 3.38 -1.14 -2.19 115.31 115.51 3nwn h LEU 282 Ca 0.15 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 3nwn h LEU 282 Cb 0.03 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3nwn h LEU 282 CO -0.09 0.32 -0.34 1.23 0.09 0.00 0.00 178.44 179.66 3nwn h GLY 283 N 0.53 0.00 0.00 0.83 0.00 -1.05 -3.42 103.07 99.97 3nwn h GLY 283 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 3nwn h GLY 283 CO -0.02 0.00 -0.07 -0.55 0.00 0.00 0.00 176.54 175.90 3nwn h ASP 284 N 0.00 0.00 0.00 0.19 3.32 -0.92 -3.45 116.42 115.56 3nwn h ASP 284 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3nwn h ASP 284 Cb 1.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.55 3nwn h ASP 284 CO 0.04 0.11 0.00 -0.38 -1.72 0.00 0.00 179.24 177.30 3nwn n ILE 290 N -2.60 0.00 -2.82 0.35 5.41 -1.26 -5.12 119.36 113.32 3nwn n ILE 290 Ca -0.01 0.00 -0.44 0.00 1.00 0.00 0.00 62.75 63.30 3nwn n ILE 290 Cb 0.04 0.00 -0.00 0.00 -0.71 0.00 0.00 39.64 38.97 3nwn n ILE 290 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 3nwn s PRO 291 N 0.00 4.04 0.38 0.38 0.04 -1.26 -4.81 135.00 133.77 3nwn s PRO 291 Ca 0.00 -2.36 0.06 0.00 0.04 0.00 0.00 61.00 58.74 3nwn s PRO 291 Cb 0.00 -5.22 0.77 0.00 0.04 0.00 0.00 34.50 30.09 3nwn s PRO 291 CO 0.00 -1.94 1.99 0.74 0.04 0.00 0.00 177.00 177.84 3nwn h PHE 292 N 7.35 0.69 0.00 0.56 0.04 -1.94 -2.61 116.94 121.04 3nwn h PHE 292 Ca 0.36 0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.14 3nwn h PHE 292 Cb 0.88 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 38.80 3nwn h PHE 292 CO 1.21 0.39 0.00 0.54 -0.60 0.00 0.00 178.31 179.86 3nwn n ARG 293 N -4.47 0.03 0.20 1.51 1.74 -1.26 -1.72 116.66 112.69 3nwn n ARG 293 Ca 0.08 0.18 0.15 0.00 -0.77 0.00 0.00 57.85 57.49 3nwn n ARG 293 Cb 0.17 -1.50 0.60 0.00 -1.02 0.00 0.00 32.46 30.70 3nwn n ARG 293 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 3nwn h GLN 294 N 0.00 0.00 -3.14 5.56 5.75 -1.88 -3.43 115.11 117.98 3nwn h GLN 294 Ca 0.00 0.00 -0.20 0.00 -0.15 0.00 0.00 58.65 58.30 3nwn h GLN 294 Cb 0.30 0.00 -0.29 0.00 1.07 0.00 0.00 27.48 28.56 3nwn h GLN 294 CO 0.00 0.00 -0.50 0.00 -2.65 0.00 0.00 178.83 175.68 3nwn h LYS 296 N 6.68 0.59 0.27 0.00 1.79 -1.84 -0.75 116.57 123.31 3nwn h LYS 296 Ca -0.35 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.08 3nwn h LYS 296 Cb 1.17 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 31.67 3nwn h LYS 296 CO 0.38 0.39 -0.26 1.25 -1.08 0.00 0.00 179.45 180.13 3nwn h LEU 297 N 0.61 -0.71 -0.97 2.94 5.85 -1.92 0.97 115.31 122.08 3nwn h LEU 297 Ca 0.34 0.06 -0.10 0.00 0.84 0.00 0.00 57.88 59.03 3nwn h LEU 297 Cb 0.35 0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 3nwn h LEU 297 CO -0.26 -0.38 -0.34 0.71 -0.34 0.00 0.00 178.44 177.83 3nwn h THR 298 N -0.57 1.28 -0.00 1.05 1.35 -1.75 -1.06 112.91 113.21 3nwn h THR 298 Ca -0.01 -1.38 -0.00 0.00 -0.55 0.00 0.00 66.41 64.47 3nwn h THR 298 Cb 0.52 1.53 -0.00 0.00 -1.73 0.00 0.00 68.15 68.47 3nwn h THR 298 CO -0.05 0.42 -0.00 -0.74 -0.25 0.00 0.00 175.52 174.90 3nwn h HIS 299 N 0.29 0.01 -0.35 4.73 -0.00 -0.26 -0.91 115.15 118.65 3nwn h HIS 299 Ca 0.04 -0.00 0.08 0.00 -0.00 0.00 0.00 60.37 60.48 3nwn h HIS 299 Cb 0.74 -0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 28.13 3nwn h HIS 299 CO 0.02 0.32 0.25 0.00 -0.00 0.00 0.00 177.93 178.52 3nwn h ALA 300 N 0.68 2.17 -0.58 5.26 0.00 -0.68 -2.09 119.26 124.03 3nwn h ALA 300 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3nwn h ALA 300 Cb 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3nwn h ALA 300 CO 0.00 -0.26 0.00 1.28 0.00 0.00 0.00 179.25 180.27 3nwn n LEU 301 N -4.46 4.17 -0.20 0.00 4.77 -0.41 -4.66 117.00 116.20 3nwn n LEU 301 Ca 0.05 -2.31 0.01 0.00 -0.03 0.00 0.00 56.01 53.73 3nwn n LEU 301 Cb 0.34 -0.49 0.11 0.00 -2.33 0.00 0.00 43.42 41.05 3nwn n LEU 301 CO 0.35 0.83 0.92 0.50 -1.33 0.00 0.00 177.39 178.66 3nwn h LYS 302 N 3.55 0.26 0.00 3.23 3.64 -0.43 -0.08 116.57 126.74 3nwn h LYS 302 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3nwn h LYS 302 Cb 1.21 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 3nwn h LYS 302 CO 0.13 0.17 0.00 0.38 -2.27 0.00 0.00 179.45 177.87 3nwn h ASP 303 N 0.27 0.00 1.33 4.20 2.03 -1.83 -2.51 116.42 119.91 3nwn h ASP 303 Ca 0.32 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.62 3nwn h ASP 303 Cb 0.48 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.98 3nwn h ASP 303 CO -0.40 0.00 -0.15 -1.20 -1.03 0.00 0.00 179.24 176.45 3nwn n SER 304 N -2.86 0.80 -0.00 4.15 7.64 -0.06 -4.32 113.62 118.96 3nwn n SER 304 Ca 0.01 0.46 -0.00 0.00 1.01 0.00 0.00 58.87 60.36 3nwn n SER 304 Cb 0.32 -0.56 -0.00 0.00 -1.01 0.00 0.00 64.21 62.95 3nwn n SER 304 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3nwn n LEU 305 N -2.24 0.04 -4.58 -3.43 4.77 -0.99 -4.73 117.00 105.85 3nwn n LEU 305 Ca 0.05 0.01 -0.27 0.00 -0.03 0.00 0.00 56.01 55.77 3nwn n LEU 305 Cb 0.43 -0.32 -0.07 0.00 -2.33 0.00 0.00 43.42 41.14 3nwn n LEU 305 CO 0.32 -0.50 1.46 -0.83 -1.33 0.00 0.00 177.39 176.51 3nwn s GLY 306 N -3.04 0.02 0.00 -0.72 0.00 -0.98 -4.80 107.32 97.80 3nwn s GLY 306 Ca -0.00 -2.09 0.00 0.00 0.00 0.00 0.00 44.72 42.63 3nwn s GLY 306 CO 0.01 3.64 0.00 0.61 0.00 0.00 0.00 173.10 177.35 3nwn n GLY 307 N 5.84 1.97 2.46 0.20 0.00 -1.26 -4.86 105.19 109.53 3nwn n GLY 307 Ca 0.44 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 3nwn n GLY 307 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3nwn n ASN 308 N 3.56 8.09 -3.62 1.61 2.85 -1.26 -4.85 115.26 121.64 3nwn n ASN 308 Ca 0.00 -3.02 -0.13 0.00 -0.11 0.00 0.00 54.58 51.32 3nwn n ASN 308 Cb 0.00 -1.41 -0.07 0.00 1.24 0.00 0.00 39.78 39.55 3nwn n ASN 308 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3nwn s ASN 310 N 0.06 6.31 -0.22 0.00 0.01 0.11 -4.76 114.94 116.45 3nwn s ASN 310 Ca -0.00 -0.47 -0.10 0.00 -0.71 0.00 0.00 52.86 51.57 3nwn s ASN 310 Cb -0.04 -2.41 -0.05 0.00 0.41 0.00 0.00 41.25 39.16 3nwn s ASN 310 CO -0.00 -1.17 0.15 -0.32 -1.51 0.00 0.00 177.10 174.24 3nwn s MET 311 N 3.71 4.10 -0.18 -0.60 -2.45 -0.14 -0.22 119.30 123.52 3nwn s MET 311 Ca 0.27 -0.26 0.01 0.00 -1.25 0.00 0.00 55.69 54.47 3nwn s MET 311 Cb -0.14 -3.49 0.02 0.00 1.25 0.00 0.00 34.83 32.48 3nwn s MET 311 CO 0.18 0.14 -0.19 0.08 1.05 0.00 0.00 175.02 176.28 3nwn s VAL 312 N 0.81 2.03 -0.23 10.11 1.01 0.86 -1.08 120.40 133.90 3nwn s VAL 312 Ca 0.08 -0.96 -0.09 0.00 0.00 0.00 0.00 61.98 61.00 3nwn s VAL 312 Cb -0.13 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.35 3nwn s VAL 312 CO 0.02 0.50 0.13 -0.22 0.00 0.00 0.00 175.10 175.53 3nwn s LEU 313 N 1.29 3.93 -0.32 3.92 2.96 -0.14 -1.14 118.68 129.19 3nwn s LEU 313 Ca 0.04 0.04 -0.08 0.00 -0.22 0.00 0.00 54.13 53.91 3nwn s LEU 313 Cb -0.13 -2.05 0.02 0.00 0.50 0.00 0.00 46.19 44.53 3nwn s LEU 313 CO -0.12 0.06 0.12 -0.69 -1.32 0.00 0.00 176.35 174.40 3nwn s VAL 314 N 1.07 4.14 -0.42 1.68 1.01 -0.23 -0.09 120.40 127.55 3nwn s VAL 314 Ca 0.06 -0.79 -0.16 0.00 0.00 0.00 0.00 61.98 61.10 3nwn s VAL 314 Cb -0.14 -3.21 0.02 0.00 0.00 0.00 0.00 36.38 33.05 3nwn s VAL 314 CO 0.04 -0.05 0.34 -0.89 0.00 0.00 0.00 175.10 174.55 3nwn s THR 315 N 1.50 5.22 -0.20 3.92 2.01 0.01 -1.83 115.64 126.27 3nwn s THR 315 Ca 0.02 -0.62 -0.22 0.00 0.31 0.00 0.00 61.69 61.18 3nwn s THR 315 Cb -0.18 -3.97 -0.02 0.00 0.01 0.00 0.00 72.50 68.34 3nwn s THR 315 CO 0.04 -0.36 0.67 0.20 -0.69 0.00 0.00 174.62 174.48 3nwn s ASN 316 N 1.79 6.72 0.01 3.53 -0.87 0.75 -0.93 114.94 125.94 3nwn s ASN 316 Ca 0.07 0.88 0.04 0.00 -1.57 0.00 0.00 52.86 52.28 3nwn s ASN 316 Cb -0.19 -2.37 -0.02 0.00 -0.02 0.00 0.00 41.25 38.66 3nwn s ASN 316 CO 0.11 -0.32 -0.14 0.27 -2.57 0.00 0.00 177.10 174.45 3nwn s ILE 317 N 2.06 1.07 0.70 0.60 -4.36 -0.78 -4.09 121.20 116.39 3nwn s ILE 317 Ca 0.30 -0.77 -0.16 0.00 -0.26 0.00 0.00 60.65 59.77 3nwn s ILE 317 Cb -0.16 -0.93 0.02 0.00 1.25 0.00 0.00 42.46 42.64 3nwn s ILE 317 CO 0.10 0.16 1.21 -0.31 0.24 0.00 0.00 174.94 176.33 3nwn s TYR 318 N -0.56 2.14 -2.33 1.37 1.51 -1.26 -0.15 117.35 118.07 3nwn s TYR 318 Ca 0.03 1.58 0.22 0.00 -1.01 0.00 0.00 57.07 57.89 3nwn s TYR 318 Cb -0.06 -3.47 0.51 0.00 -0.11 0.00 0.00 41.96 38.83 3nwn s TYR 318 CO 0.00 -2.51 1.44 0.41 -1.11 0.00 0.00 175.55 173.79 3nwn n GLY 319 N 0.37 1.61 3.82 0.71 0.00 -1.21 -4.68 105.19 105.81 3nwn n GLY 319 Ca 0.13 -0.69 -0.29 0.00 0.00 0.00 0.00 46.02 45.18 3nwn n GLY 319 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3nwn s GLU 320 N -1.44 3.01 0.16 1.61 2.02 -1.26 -0.82 118.70 121.98 3nwn s GLU 320 Ca 0.39 -0.71 -0.12 0.00 0.02 0.00 0.00 54.97 54.55 3nwn s GLU 320 Cb 0.22 -2.76 0.05 0.00 0.10 0.00 0.00 34.13 31.74 3nwn s GLU 320 CO 0.30 0.54 1.65 0.00 0.02 0.00 0.00 175.26 177.77 3nwn h ALA 321 N 2.86 0.73 -0.02 5.21 0.00 -1.93 -2.94 119.26 123.17 3nwn h ALA 321 Ca -0.47 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.20 3nwn h ALA 321 Cb 1.18 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 3nwn h ALA 321 CO 0.66 0.48 0.08 0.00 0.00 0.00 0.00 179.25 180.48 3nwn h ALA 322 N 0.99 1.23 -0.23 0.00 0.00 -1.97 -1.41 119.26 117.86 3nwn h ALA 322 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3nwn h ALA 322 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3nwn h ALA 322 CO 0.01 -0.09 0.00 1.04 0.00 0.00 0.00 179.25 180.21 3nwn n GLN 323 N -3.24 2.12 -0.23 0.00 3.00 -1.11 -4.72 117.38 113.21 3nwn n GLN 323 Ca -0.02 -1.97 0.25 0.00 -0.01 0.00 0.00 57.00 55.25 3nwn n GLN 323 Cb 0.16 -1.42 0.63 0.00 0.00 0.00 0.00 30.24 29.61 3nwn n GLN 323 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 3nwn h LEU 324 N 3.82 0.18 -0.22 1.08 3.38 -1.28 -1.04 115.31 121.23 3nwn h LEU 324 Ca 0.00 0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.82 3nwn h LEU 324 Cb 0.86 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.61 3nwn h LEU 324 CO 0.00 0.06 -0.53 -0.33 0.09 0.00 0.00 178.44 177.73 3nwn h GLU 325 N 0.18 0.75 -0.38 1.13 3.07 -1.84 -1.17 114.58 116.31 3nwn h GLU 325 Ca 0.47 -0.51 -0.15 0.00 -0.50 0.00 0.00 59.36 58.67 3nwn h GLU 325 Cb 1.55 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 29.53 3nwn h GLU 325 CO -0.10 1.14 -0.34 0.93 -1.40 0.00 0.00 179.01 179.24 3nwn h GLU 326 N 0.48 0.88 -0.40 2.33 4.39 -1.79 -2.45 114.58 118.02 3nwn h GLU 326 Ca -0.00 -0.43 0.07 0.00 0.34 0.00 0.00 59.36 59.33 3nwn h GLU 326 Cb 1.15 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.74 3nwn h GLU 326 CO 0.12 1.08 0.06 1.15 -1.16 0.00 0.00 179.01 180.25 3nwn h THR 327 N 0.73 0.77 -0.70 1.13 2.02 -1.14 -0.75 112.91 114.97 3nwn h THR 327 Ca 0.07 -0.06 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 3nwn h THR 327 Cb 0.91 0.57 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 3nwn h THR 327 CO 0.08 0.03 0.35 0.25 0.37 0.00 0.00 175.52 176.61 3nwn h LEU 328 N 0.18 0.90 -0.79 2.58 5.85 -1.18 -0.26 115.31 122.59 3nwn h LEU 328 Ca 0.19 -0.12 0.06 0.00 0.84 0.00 0.00 57.88 58.85 3nwn h LEU 328 Cb 0.25 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 40.99 3nwn h LEU 328 CO -0.27 0.76 0.48 0.28 -0.34 0.00 0.00 178.44 179.35 3nwn h SER 329 N 0.97 0.74 -0.48 1.25 0.02 -1.08 0.59 113.55 115.56 3nwn h SER 329 Ca 0.24 0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 61.11 3nwn h SER 329 Cb 0.09 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 3nwn h SER 329 CO -0.03 0.48 -0.08 0.28 -1.14 0.00 0.00 176.83 176.34 3nwn h SER 330 N 0.88 0.90 0.04 3.07 0.02 -0.59 -2.47 113.55 115.39 3nwn h SER 330 Ca 0.34 -0.35 -0.12 0.00 -0.84 0.00 0.00 61.79 60.83 3nwn h SER 330 Cb 0.16 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 3nwn h SER 330 CO -0.17 1.03 -0.37 -0.07 -1.14 0.00 0.00 176.83 176.11 3nwn h LEU 331 N 0.75 0.47 -1.22 5.07 3.38 -0.74 0.64 115.31 123.66 3nwn h LEU 331 Ca 0.13 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3nwn h LEU 331 Cb 0.62 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 3nwn h LEU 331 CO 0.04 0.80 0.32 0.03 0.09 0.00 0.00 178.44 179.72 3nwn h ARG 332 N 0.38 0.86 0.16 1.13 3.08 -0.78 -1.08 114.38 118.12 3nwn h ARG 332 Ca 0.04 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 3nwn h ARG 332 Cb 0.82 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.71 3nwn h ARG 332 CO 0.07 0.65 -0.07 0.35 -1.07 0.00 0.00 179.97 179.89 3nwn h PHE 333 N 0.86 -0.19 -0.97 3.04 3.57 -0.96 -3.01 116.94 119.28 3nwn h PHE 333 Ca 0.22 -0.00 0.26 0.00 3.53 0.00 0.00 57.97 61.97 3nwn h PHE 333 Cb 0.05 0.06 -0.13 0.00 2.79 0.00 0.00 35.95 38.72 3nwn h PHE 333 CO 0.01 0.18 0.53 0.00 -2.23 0.00 0.00 178.31 176.79 3nwn h ALA 334 N 0.13 1.74 0.00 2.41 0.00 -0.82 -1.13 119.26 121.59 3nwn h ALA 334 Ca -0.02 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3nwn h ALA 334 Cb 0.46 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3nwn h ALA 334 CO 0.04 -0.38 0.00 0.77 0.00 0.00 0.00 179.25 179.68 3nwn h SER 335 N 0.45 0.00 0.91 0.00 0.02 -1.08 -2.86 113.55 110.99 3nwn h SER 335 Ca 0.65 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.60 3nwn h SER 335 Cb 1.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.85 3nwn h SER 335 CO -0.53 0.00 0.00 0.03 -1.14 0.00 0.00 176.83 175.19 3nwn h ARG 336 N 0.00 0.00 0.00 3.45 3.08 -1.07 -3.34 114.38 116.50 3nwn h ARG 336 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 3nwn h ARG 336 Cb 0.53 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.56 3nwn h ARG 336 CO 0.00 0.00 -0.57 0.52 -1.07 0.00 0.00 179.97 178.85 3nwn h MET 337 N 0.00 0.00 0.00 0.04 2.86 -1.63 -3.06 114.93 113.14 3nwn h MET 337 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3nwn h MET 337 Cb 0.45 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.11 3nwn h MET 337 CO 0.00 0.57 0.00 1.57 1.06 0.00 0.00 176.91 180.11 3nwn h LYS 338 N 0.00 0.00 0.00 1.72 2.10 -1.79 -2.48 116.57 116.12 3nwn h LYS 338 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3nwn h LYS 338 Cb 1.06 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.39 3nwn h LYS 338 CO 0.07 0.00 -0.76 1.28 -2.00 0.00 0.00 179.45 178.05 3nwn n LEU 339 N -2.82 0.69 0.00 7.07 4.77 -1.15 -5.13 117.00 120.43 3nwn n LEU 339 Ca -0.01 -0.18 0.09 0.00 -0.03 0.00 0.00 56.01 55.89 3nwn n LEU 339 Cb 0.17 -0.14 0.55 0.00 -2.33 0.00 0.00 43.42 41.67 3nwn n LEU 339 CO 0.21 0.16 0.74 0.52 -1.33 0.00 0.00 177.39 177.69