#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cgs s VAL 2 N 0.00 3.81 0.06 5.15 -7.23 -1.24 -4.47 120.40 116.49 1cgs s VAL 2 Ca 0.00 1.46 0.02 0.00 -1.81 0.00 0.00 61.98 61.64 1cgs s VAL 2 Cb 0.00 -3.79 -0.03 0.00 0.56 0.00 0.00 36.38 33.12 1cgs s VAL 2 CO 0.00 0.08 -0.06 -1.58 -0.31 0.00 0.00 175.10 173.22 1cgs s GLN 3 N -2.28 0.63 -0.14 4.82 0.74 0.26 -4.92 119.66 118.77 1cgs s GLN 3 Ca 0.54 -0.99 -0.04 0.00 0.05 0.00 0.00 55.36 54.92 1cgs s GLN 3 Cb -0.22 -0.18 0.05 0.00 1.10 0.00 0.00 33.01 33.76 1cgs s GLN 3 CO 0.28 0.00 0.07 -0.51 -0.55 0.00 0.00 175.29 174.58 1cgs s LEU 4 N -2.22 0.45 0.04 3.68 2.01 -1.24 -0.86 118.68 120.55 1cgs s LEU 4 Ca -0.01 -0.46 0.05 0.00 0.01 0.00 0.00 54.13 53.72 1cgs s LEU 4 Cb -0.03 -0.29 -0.03 0.00 0.01 0.00 0.00 46.19 45.84 1cgs s LEU 4 CO -0.03 -0.31 -0.10 -0.76 1.01 0.00 0.00 176.35 176.16 1cgs s LEU 5 N 2.09 3.00 0.26 1.79 1.43 0.11 -3.88 118.68 123.48 1cgs s LEU 5 Ca 0.02 -0.28 0.12 0.00 -1.03 0.00 0.00 54.13 52.97 1cgs s LEU 5 Cb -0.15 -1.76 -0.05 0.00 0.03 0.00 0.00 46.19 44.26 1cgs s LEU 5 CO -0.07 0.25 -0.20 -1.61 0.23 0.00 0.00 176.35 174.94 1cgs s GLU 6 N -1.64 1.67 1.06 1.70 2.02 -1.26 -1.51 118.70 120.73 1cgs s GLU 6 Ca 0.18 -1.69 -0.12 0.00 0.02 0.00 0.00 54.97 53.35 1cgs s GLU 6 Cb -0.11 -1.81 0.22 0.00 0.10 0.00 0.00 34.13 32.53 1cgs s GLU 6 CO 0.09 0.35 1.07 -1.54 0.02 0.00 0.00 175.26 175.25 1cgs s SER 7 N -3.30 2.04 0.08 -0.19 1.04 -1.21 -4.93 113.70 107.23 1cgs s SER 7 Ca 0.28 1.33 -0.17 0.00 0.48 0.00 0.00 55.95 57.86 1cgs s SER 7 Cb -0.06 -2.03 -0.07 0.00 0.10 0.00 0.00 66.02 63.96 1cgs s SER 7 CO 0.14 -3.52 0.54 -0.83 0.98 0.00 0.00 173.24 170.55 1cgs s GLY 8 N -3.11 2.58 0.04 7.32 0.00 -1.26 -4.49 107.32 108.40 1cgs s GLY 8 Ca 0.66 -0.05 -0.23 0.00 0.00 0.00 0.00 44.72 45.10 1cgs s GLY 8 CO 0.60 0.32 0.57 0.00 0.00 0.00 0.00 173.10 174.59 1cgs n ALA 9 N 1.48 -2.40 -2.48 3.20 0.00 -1.26 -4.84 120.51 114.21 1cgs n ALA 9 Ca -0.10 0.35 -0.24 0.00 0.00 0.00 0.00 53.44 53.46 1cgs n ALA 9 Cb 0.51 -1.08 -0.10 0.00 0.00 0.00 0.00 19.45 18.78 1cgs n ALA 9 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1cgs s GLU 10 N -0.20 1.68 -0.25 0.00 2.02 0.55 -4.87 118.70 117.63 1cgs s GLU 10 Ca 0.52 -1.85 0.03 0.00 0.02 0.00 0.00 54.97 53.69 1cgs s GLU 10 Cb -0.73 -1.45 0.06 0.00 0.10 0.00 0.00 34.13 32.10 1cgs s GLU 10 CO 0.36 0.11 -0.11 -0.51 0.02 0.00 0.00 175.26 175.12 1cgs s LEU 11 N -3.52 3.32 0.10 1.80 1.43 -1.26 -2.08 118.68 118.46 1cgs s LEU 11 Ca 0.31 -1.34 0.10 0.00 -1.03 0.00 0.00 54.13 52.16 1cgs s LEU 11 Cb 0.02 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.68 1cgs s LEU 11 CO 0.14 -0.18 -0.23 -0.04 0.23 0.00 0.00 176.35 176.27 1cgs s MET 12 N 1.13 1.68 0.56 1.70 -1.94 -0.60 -5.01 119.30 116.81 1cgs s MET 12 Ca -0.08 -1.21 -0.10 0.00 -1.71 0.00 0.00 55.69 52.59 1cgs s MET 12 Cb -0.19 -2.01 -0.04 0.00 2.01 0.00 0.00 34.83 34.59 1cgs s MET 12 CO -0.06 0.48 0.94 -1.59 -0.01 0.00 0.00 175.02 174.79 1cgs s LYS 13 N -1.84 3.63 0.75 2.03 0.00 -1.26 -2.33 119.74 120.72 1cgs s LYS 13 Ca 0.15 0.61 -0.14 0.00 0.00 0.00 0.00 55.97 56.59 1cgs s LYS 13 Cb -0.10 -2.19 0.05 0.00 0.00 0.00 0.00 37.83 35.59 1cgs s LYS 13 CO 0.06 -0.40 1.17 -2.14 0.00 0.00 0.00 175.35 174.04 1cgs s PRO 14 N -4.85 2.08 0.00 1.78 0.02 -1.26 -3.65 135.00 129.12 1cgs s PRO 14 Ca 0.53 1.59 0.00 0.00 0.02 0.00 0.00 61.00 63.14 1cgs s PRO 14 Cb -0.11 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.57 1cgs s PRO 14 CO 0.48 -1.84 0.00 0.41 -0.33 0.00 0.00 177.00 175.71 1cgs n GLY 15 N 0.02 2.10 3.39 0.52 0.00 -1.19 -4.92 105.19 105.11 1cgs n GLY 15 Ca 0.12 -0.26 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 1cgs n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cgs n ALA 16 N 0.00 -1.94 -2.52 4.61 0.00 -1.24 -2.02 120.51 117.40 1cgs n ALA 16 Ca 0.00 0.02 -0.25 0.00 0.00 0.00 0.00 53.44 53.21 1cgs n ALA 16 Cb 0.00 -1.66 -0.10 0.00 0.00 0.00 0.00 19.45 17.69 1cgs n ALA 16 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1cgs s SER 17 N -1.06 3.90 0.31 0.00 1.04 -1.26 -3.50 113.70 113.13 1cgs s SER 17 Ca 0.63 -0.81 0.09 0.00 0.48 0.00 0.00 55.95 56.34 1cgs s SER 17 Cb -0.51 -0.50 -0.05 0.00 0.10 0.00 0.00 66.02 65.07 1cgs s SER 17 CO 0.59 0.07 0.03 0.68 0.98 0.00 0.00 173.24 175.59 1cgs s VAL 18 N -2.09 3.07 -0.30 5.02 -7.23 -1.20 -4.99 120.40 112.67 1cgs s VAL 18 Ca 0.27 -1.89 0.02 0.00 -1.81 0.00 0.00 61.98 58.57 1cgs s VAL 18 Cb -0.07 -2.85 0.09 0.00 0.56 0.00 0.00 36.38 34.11 1cgs s VAL 18 CO 0.15 -0.27 0.03 -1.58 -0.31 0.00 0.00 175.10 173.11 1cgs s GLN 19 N -3.73 1.34 0.08 4.82 2.00 -1.26 -2.94 119.66 119.97 1cgs s GLN 19 Ca 0.34 -1.39 -0.10 0.00 -2.00 0.00 0.00 55.36 52.21 1cgs s GLN 19 Cb -0.04 -2.69 -0.06 0.00 0.80 0.00 0.00 33.01 31.03 1cgs s GLN 19 CO 0.20 -0.84 0.41 0.42 -0.50 0.00 0.00 175.29 174.97 1cgs s ILE 20 N 1.24 5.09 0.23 -2.34 1.01 -0.60 -4.98 121.20 120.85 1cgs s ILE 20 Ca 0.05 0.47 0.07 0.00 0.00 0.00 0.00 60.65 61.24 1cgs s ILE 20 Cb -0.19 -3.65 -0.05 0.00 0.01 0.00 0.00 42.46 38.59 1cgs s ILE 20 CO -0.12 0.29 -0.12 -0.94 0.00 0.00 0.00 174.94 174.05 1cgs s SER 21 N -1.75 2.62 -0.41 3.58 1.04 -1.26 -2.65 113.70 114.87 1cgs s SER 21 Ca 0.33 -1.07 0.04 0.00 0.48 0.00 0.00 55.95 55.73 1cgs s SER 21 Cb -0.14 -0.14 0.17 0.00 0.10 0.00 0.00 66.02 66.00 1cgs s SER 21 CO 0.18 -0.22 0.41 0.00 0.98 0.00 0.00 173.24 174.59 1cgs s LYS 23 N 0.84 4.36 -0.21 0.00 2.20 -0.57 -1.95 119.74 124.40 1cgs s LYS 23 Ca 0.25 1.94 -0.01 0.00 -0.36 0.00 0.00 55.97 57.79 1cgs s LYS 23 Cb -0.07 -3.32 0.01 0.00 -1.51 0.00 0.00 37.83 32.94 1cgs s LYS 23 CO -0.08 -0.38 -0.11 0.00 -0.36 0.00 0.00 175.35 174.42 1cgs s ALA 24 N 1.23 2.60 -0.10 3.13 0.00 -0.69 0.03 121.76 127.96 1cgs s ALA 24 Ca 0.62 -1.27 0.01 0.00 0.00 0.00 0.00 51.96 51.33 1cgs s ALA 24 Cb -0.33 -1.50 -0.02 0.00 0.00 0.00 0.00 23.12 21.26 1cgs s ALA 24 CO 0.29 -0.50 -0.14 0.95 0.00 0.00 0.00 175.76 176.36 1cgs s THR 25 N 1.37 3.00 0.00 0.00 -4.23 -0.04 -4.82 115.64 110.92 1cgs s THR 25 Ca 0.04 -0.70 0.00 0.00 -1.18 0.00 0.00 61.69 59.85 1cgs s THR 25 Cb -0.14 -2.23 0.00 0.00 1.34 0.00 0.00 72.50 71.47 1cgs s THR 25 CO -0.07 0.55 0.00 0.61 -0.54 0.00 0.00 174.62 175.16 1cgs n GLY 26 N 3.17 1.90 0.00 3.99 0.00 -1.26 0.90 105.19 113.88 1cgs n GLY 26 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1cgs n GLY 26 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1cgs n TYR 27 N -0.49 0.00 -3.32 1.61 0.18 -1.26 -4.42 117.16 109.46 1cgs n TYR 27 Ca 0.00 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 59.40 1cgs n TYR 27 Cb 0.00 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 38.90 1cgs n TYR 27 CO 0.00 0.00 0.00 -0.08 -2.08 0.00 0.00 176.86 174.70 1cgs s THR 28 N -3.00 4.82 0.00 -3.48 -1.32 -1.26 -5.02 115.64 106.39 1cgs s THR 28 Ca 0.00 1.13 0.00 0.00 -1.21 0.00 0.00 61.69 61.61 1cgs s THR 28 Cb 0.00 -3.86 0.00 0.00 -1.51 0.00 0.00 72.50 67.13 1cgs s THR 28 CO 0.00 0.55 0.44 0.33 -2.21 0.00 0.00 174.62 173.73 1cgs n PHE 29 N 1.84 0.00 -0.09 9.09 -0.00 -1.26 -4.46 117.46 122.58 1cgs n PHE 29 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.34 1cgs n PHE 29 Cb 0.51 -0.42 0.00 0.00 -0.00 0.00 0.00 39.48 39.57 1cgs n PHE 29 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 1cgs n SER 30 N -1.77 0.00 0.00 -2.13 7.64 -1.25 -2.69 113.62 113.42 1cgs n SER 30 Ca 0.00 -0.53 0.00 0.00 1.01 0.00 0.00 58.87 59.35 1cgs n SER 30 Cb 0.00 -0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.17 1cgs n SER 30 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1cgs n GLU 31 N 2.22 0.72 -4.46 1.43 4.07 -1.26 -4.93 120.64 118.43 1cgs n GLU 31 Ca 0.00 0.00 -0.33 0.00 -0.06 0.00 0.00 57.16 56.77 1cgs n GLU 31 Cb 0.00 -0.07 -0.10 0.00 -0.06 0.00 0.00 31.44 31.20 1cgs n GLU 31 CO 0.00 0.00 0.00 0.71 -0.06 0.00 0.00 177.13 177.78 1cgs s TYR 32 N -0.19 3.00 0.10 4.31 1.51 -1.10 -5.01 117.35 119.98 1cgs s TYR 32 Ca 0.00 0.05 -0.31 0.00 -1.01 0.00 0.00 57.07 55.81 1cgs s TYR 32 Cb 0.00 -1.69 -0.10 0.00 -0.11 0.00 0.00 41.96 40.06 1cgs s TYR 32 CO 0.00 0.40 1.79 -1.58 -1.11 0.00 0.00 175.55 175.05 1cgs s TRP 33 N -0.93 2.16 -0.72 2.71 0.23 -1.25 -4.22 118.94 116.92 1cgs s TRP 33 Ca 0.15 0.04 -0.23 0.00 -2.03 0.00 0.00 56.10 54.04 1cgs s TRP 33 Cb -0.11 -4.13 0.07 0.00 0.03 0.00 0.00 33.47 29.34 1cgs s TRP 33 CO 0.05 -4.64 1.05 0.42 0.96 0.00 0.00 176.95 174.78 1cgs s ILE 34 N 2.83 4.29 0.38 2.03 -1.09 0.61 -3.28 121.20 126.97 1cgs s ILE 34 Ca 0.79 -0.46 -0.08 0.00 -2.23 0.00 0.00 60.65 58.67 1cgs s ILE 34 Cb -0.44 -4.74 -0.06 0.00 -1.58 0.00 0.00 42.46 35.64 1cgs s ILE 34 CO 0.36 -1.54 0.71 -1.61 -1.23 0.00 0.00 174.94 171.63 1cgs s GLU 35 N 4.11 3.71 -0.01 2.79 0.41 0.15 -3.35 118.70 126.50 1cgs s GLU 35 Ca 0.26 0.30 -0.02 0.00 -0.41 0.00 0.00 54.97 55.10 1cgs s GLU 35 Cb -0.13 -2.47 0.00 0.00 -1.78 0.00 0.00 34.13 29.75 1cgs s GLU 35 CO 0.07 0.02 0.05 -1.58 -0.49 0.00 0.00 175.26 173.32 1cgs s TRP 36 N -2.33 -0.02 0.09 1.61 0.52 -1.24 0.17 118.94 117.74 1cgs s TRP 36 Ca 0.49 0.07 0.03 0.00 0.02 0.00 0.00 56.10 56.70 1cgs s TRP 36 Cb -0.10 -0.00 -0.04 0.00 -1.15 0.00 0.00 33.47 32.18 1cgs s TRP 36 CO 0.32 -0.05 -0.09 0.08 0.02 0.00 0.00 176.95 177.23 1cgs s VAL 37 N -0.16 0.85 -0.18 4.03 1.01 0.76 -1.44 120.40 125.26 1cgs s VAL 37 Ca -0.02 -1.63 -0.03 0.00 0.00 0.00 0.00 61.98 60.30 1cgs s VAL 37 Cb -0.02 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 35.02 1cgs s VAL 37 CO 0.00 -0.60 -0.07 -0.75 0.00 0.00 0.00 175.10 173.68 1cgs s LYS 38 N -2.85 3.43 -0.31 2.72 2.20 -0.40 -1.94 119.74 122.59 1cgs s LYS 38 Ca 0.05 -0.63 0.01 0.00 -0.36 0.00 0.00 55.97 55.04 1cgs s LYS 38 Cb -0.02 -2.88 0.07 0.00 -1.51 0.00 0.00 37.83 33.49 1cgs s LYS 38 CO -0.01 -0.00 0.00 -2.00 -0.36 0.00 0.00 175.35 172.98 1cgs s GLU 39 N 0.96 2.13 -0.07 4.03 2.12 -0.22 -1.97 118.70 125.69 1cgs s GLU 39 Ca -0.01 -1.48 0.04 0.00 0.36 0.00 0.00 54.97 53.88 1cgs s GLU 39 Cb -0.15 -3.15 -0.02 0.00 0.26 0.00 0.00 34.13 31.08 1cgs s GLU 39 CO 0.00 -0.72 -0.18 0.50 -0.54 0.00 0.00 175.26 174.32 1cgs s ARG 40 N 1.12 2.67 0.15 4.30 3.52 -1.20 -1.03 118.95 128.48 1cgs s ARG 40 Ca -0.02 -0.78 -0.31 0.00 -0.13 0.00 0.00 55.73 54.49 1cgs s ARG 40 Cb -0.20 -2.34 -0.10 0.00 -1.56 0.00 0.00 34.95 30.75 1cgs s ARG 40 CO -0.04 0.46 1.67 -2.14 -0.81 0.00 0.00 175.30 174.44 1cgs s PRO 41 N -0.32 4.18 0.00 5.12 0.02 -1.26 -2.18 135.00 140.55 1cgs s PRO 41 Ca 0.02 2.45 0.00 0.00 0.02 0.00 0.00 61.00 63.49 1cgs s PRO 41 Cb -0.13 -3.30 0.00 0.00 0.02 0.00 0.00 34.50 31.09 1cgs s PRO 41 CO 0.02 -0.71 0.00 0.41 -0.33 0.00 0.00 177.00 176.40 1cgs n GLY 42 N 3.94 3.06 0.19 0.52 0.00 -1.26 -4.80 105.19 106.83 1cgs n GLY 42 Ca 0.15 -0.82 -0.17 0.00 0.00 0.00 0.00 46.02 45.19 1cgs n GLY 42 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1cgs h HIS 43 N 0.00 0.85 0.00 1.61 -0.00 -1.86 -3.50 115.15 112.25 1cgs h HIS 43 Ca 0.00 -0.39 0.00 0.00 -0.00 0.00 0.00 60.37 59.98 1cgs h HIS 43 Cb 0.00 -0.12 0.00 0.00 -0.00 0.00 0.00 27.41 27.29 1cgs h HIS 43 CO 0.00 1.19 0.00 0.41 -0.00 0.00 0.00 177.93 179.53 1cgs n GLY 44 N 0.77 0.81 3.34 5.26 0.00 -1.11 -4.93 105.19 109.34 1cgs n GLY 44 Ca -0.08 -1.65 -0.35 0.00 0.00 0.00 0.00 46.02 43.94 1cgs n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cgs s LEU 45 N 0.00 2.92 -0.46 0.99 2.01 -1.25 -3.21 118.68 119.67 1cgs s LEU 45 Ca 0.00 -0.35 -0.05 0.00 0.01 0.00 0.00 54.13 53.74 1cgs s LEU 45 Cb 0.00 -1.73 0.12 0.00 0.01 0.00 0.00 46.19 44.59 1cgs s LEU 45 CO 0.00 0.03 0.29 -0.70 1.01 0.00 0.00 176.35 176.98 1cgs s GLU 46 N 1.17 2.25 0.14 1.70 2.12 -0.83 -4.92 118.70 120.32 1cgs s GLU 46 Ca 0.02 -1.91 -0.33 0.00 0.36 0.00 0.00 54.97 53.11 1cgs s GLU 46 Cb -0.14 -3.72 -0.13 0.00 0.26 0.00 0.00 34.13 30.39 1cgs s GLU 46 CO -0.01 -1.13 1.67 1.87 -0.54 0.00 0.00 175.26 177.12 1cgs n TRP 47 N 4.54 2.42 -0.09 5.30 -0.00 -1.26 -1.27 117.44 127.08 1cgs n TRP 47 Ca -0.02 0.14 -0.15 0.00 -0.00 0.00 0.00 57.50 57.47 1cgs n TRP 47 Cb 0.41 -2.61 -0.08 0.00 -0.00 0.00 0.00 31.31 29.03 1cgs n TRP 47 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 177.69 178.51 1cgs h ILE 48 N 3.98 0.60 0.00 5.87 2.04 -1.59 -3.46 117.51 124.95 1cgs h ILE 48 Ca -0.45 -1.74 0.00 0.00 1.00 0.00 0.00 64.86 63.67 1cgs h ILE 48 Cb 1.24 1.42 0.00 0.00 -0.74 0.00 0.00 36.82 38.74 1cgs h ILE 48 CO 0.92 0.20 0.00 0.61 0.00 0.00 0.00 178.15 179.88 1cgs n GLY 49 N 1.51 1.72 3.98 5.37 0.00 -1.24 -2.25 105.19 114.28 1cgs n GLY 49 Ca -0.22 -0.32 -0.22 0.00 0.00 0.00 0.00 46.02 45.26 1cgs n GLY 49 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cgs s GLU 50 N -1.91 2.30 0.00 1.61 2.02 -0.16 -3.66 118.70 118.90 1cgs s GLU 50 Ca 0.00 -0.87 0.00 0.00 0.02 0.00 0.00 54.97 54.12 1cgs s GLU 50 Cb 0.00 -2.44 0.00 0.00 0.10 0.00 0.00 34.13 31.79 1cgs s GLU 50 CO 0.00 -0.93 0.00 1.51 0.02 0.00 0.00 175.26 175.86 1cgs n ILE 51 N -2.49 0.00 -3.60 -1.63 3.06 -1.21 -1.99 119.36 111.50 1cgs n ILE 51 Ca 0.10 0.00 -0.36 0.00 -2.50 0.00 0.00 62.75 59.99 1cgs n ILE 51 Cb 0.60 0.00 -0.07 0.00 0.54 0.00 0.00 39.64 40.71 1cgs n ILE 51 CO 0.00 0.00 0.00 -1.48 -2.50 0.00 0.00 176.55 172.57 1cgs s LEU 52 N 0.00 4.27 0.57 9.51 0.05 -1.18 -0.28 118.68 131.63 1cgs s LEU 52 Ca 0.00 0.50 -0.17 0.00 0.05 0.00 0.00 54.13 54.51 1cgs s LEU 52 Cb 0.00 -2.32 -0.05 0.00 -2.05 0.00 0.00 46.19 41.77 1cgs s LEU 52 CO 0.00 0.16 1.06 -2.84 -0.55 0.00 0.00 176.35 174.18 1cgs s PRO 53 N 0.17 3.40 0.00 1.48 0.02 -1.26 -3.02 135.00 135.78 1cgs s PRO 53 Ca 0.16 1.27 0.00 0.00 0.02 0.00 0.00 61.00 62.44 1cgs s PRO 53 Cb -0.13 -2.04 0.00 0.00 0.02 0.00 0.00 34.50 32.35 1cgs s PRO 53 CO 0.04 -0.75 0.00 0.41 -0.33 0.00 0.00 177.00 176.37 1cgs n GLY 54 N -0.75 2.71 0.12 0.52 0.00 -1.26 -3.89 105.19 102.64 1cgs n GLY 54 Ca 0.09 -0.64 -0.01 0.00 0.00 0.00 0.00 46.02 45.46 1cgs n GLY 54 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1cgs h SER 55 N 0.00 0.00 0.00 1.61 4.64 -1.93 -3.47 113.55 114.40 1cgs h SER 55 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1cgs h SER 55 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1cgs h SER 55 CO 0.00 0.68 0.00 0.61 -0.87 0.00 0.00 176.83 177.25 1cgs n GLY 56 N 0.82 0.84 3.58 -0.77 0.00 -1.17 -5.01 105.19 103.48 1cgs n GLY 56 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1cgs n GLY 56 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1cgs n ARG 57 N -2.03 -0.25 -4.21 1.61 0.63 -1.23 -4.88 116.66 106.29 1cgs n ARG 57 Ca 0.00 -0.01 -0.17 0.00 -0.92 0.00 0.00 57.85 56.75 1cgs n ARG 57 Cb 0.00 -2.19 -0.07 0.00 0.45 0.00 0.00 32.46 30.65 1cgs n ARG 57 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 1cgs s THR 58 N -2.42 0.00 -0.30 5.15 -4.23 -1.26 -3.08 115.64 109.50 1cgs s THR 58 Ca 0.65 -1.88 -0.16 0.00 -1.18 0.00 0.00 61.69 59.11 1cgs s THR 58 Cb -0.24 -2.53 0.18 0.00 1.34 0.00 0.00 72.50 71.25 1cgs s THR 58 CO 0.60 0.00 1.13 0.21 -0.54 0.00 0.00 174.62 176.02 1cgs s ASN 59 N -3.30 -0.28 0.16 3.99 3.84 -0.84 -4.85 114.94 113.66 1cgs s ASN 59 Ca 0.38 0.43 0.06 0.00 0.21 0.00 0.00 52.86 53.93 1cgs s ASN 59 Cb 0.02 1.18 -0.04 0.00 -0.55 0.00 0.00 41.25 41.86 1cgs s ASN 59 CO 0.23 -0.07 -0.12 -0.31 -2.79 0.00 0.00 177.10 174.04 1cgs s TYR 60 N 1.48 1.44 0.01 0.43 2.02 -1.26 -0.98 117.35 120.48 1cgs s TYR 60 Ca -0.06 -0.66 -0.28 0.00 -0.37 0.00 0.00 57.07 55.70 1cgs s TYR 60 Cb -0.03 -0.71 -0.04 0.00 -0.40 0.00 0.00 41.96 40.78 1cgs s TYR 60 CO -0.13 0.19 0.87 0.50 -1.57 0.00 0.00 175.55 175.41 1cgs s ARG 61 N -3.52 4.54 0.19 -0.62 3.52 -0.95 -4.91 118.95 117.19 1cgs s ARG 61 Ca 0.17 1.23 -0.15 0.00 -0.13 0.00 0.00 55.73 56.85 1cgs s ARG 61 Cb 0.00 -3.43 0.19 0.00 -1.56 0.00 0.00 34.95 30.15 1cgs s ARG 61 CO 0.03 0.07 1.29 -1.91 -0.81 0.00 0.00 175.30 173.97 1cgs n GLU 62 N 3.52 -0.20 -0.36 5.12 4.07 -1.26 0.66 120.64 132.18 1cgs n GLU 62 Ca 0.02 1.27 0.04 0.00 -0.06 0.00 0.00 57.16 58.44 1cgs n GLU 62 Cb 0.51 -1.89 0.12 0.00 -0.06 0.00 0.00 31.44 30.12 1cgs n GLU 62 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 1cgs h LYS 63 N 0.00 -0.00 -0.00 5.31 3.64 -1.95 -0.89 116.57 122.68 1cgs h LYS 63 Ca 0.28 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 1cgs h LYS 63 Cb 0.49 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1cgs h LYS 63 CO -0.82 -0.00 -0.29 1.19 -2.27 0.00 0.00 179.45 177.26 1cgs n PHE 64 N -5.59 0.00 -1.94 1.91 3.01 0.21 -4.85 117.46 110.21 1cgs n PHE 64 Ca 0.15 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.18 1cgs n PHE 64 Cb 0.48 -0.33 -0.03 0.00 -0.01 0.00 0.00 39.48 39.59 1cgs n PHE 64 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1cgs s LYS 65 N -2.94 3.86 0.00 -1.08 2.20 -0.34 -1.21 119.74 120.23 1cgs s LYS 65 Ca 0.14 2.01 0.00 0.00 -0.36 0.00 0.00 55.97 57.76 1cgs s LYS 65 Cb 0.18 -4.09 0.00 0.00 -1.51 0.00 0.00 37.83 32.41 1cgs s LYS 65 CO 0.62 -1.24 0.00 0.41 -0.36 0.00 0.00 175.35 174.78 1cgs n GLY 66 N 4.66 2.12 0.08 5.54 0.00 -1.26 -4.89 105.19 111.44 1cgs n GLY 66 Ca 0.20 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.16 1cgs n GLY 66 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1cgs n LYS 67 N -0.36 0.94 -4.32 1.61 3.00 -0.35 -4.89 118.16 113.79 1cgs n LYS 67 Ca 0.00 -0.04 -0.29 0.00 -0.00 0.00 0.00 58.31 57.99 1cgs n LYS 67 Cb 0.00 -1.47 -0.11 0.00 0.00 0.00 0.00 35.03 33.45 1cgs n LYS 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1cgs s ALA 68 N -2.59 2.67 0.03 3.14 0.00 -1.04 -2.04 121.76 121.94 1cgs s ALA 68 Ca -0.09 -1.41 0.03 0.00 0.00 0.00 0.00 51.96 50.49 1cgs s ALA 68 Cb 0.07 -0.60 -0.02 0.00 0.00 0.00 0.00 23.12 22.57 1cgs s ALA 68 CO 0.76 0.56 -0.10 0.99 0.00 0.00 0.00 175.76 177.97 1cgs s THR 69 N -1.26 0.75 -0.09 0.00 2.01 -0.64 -4.89 115.64 111.52 1cgs s THR 69 Ca 0.19 -0.82 0.01 0.00 0.31 0.00 0.00 61.69 61.38 1cgs s THR 69 Cb -0.10 -0.71 0.02 0.00 0.01 0.00 0.00 72.50 71.72 1cgs s THR 69 CO 0.10 -0.09 -0.11 -0.36 -0.69 0.00 0.00 174.62 173.48 1cgs s PHE 70 N -0.83 1.53 0.08 4.92 0.08 -1.26 -2.38 117.98 120.13 1cgs s PHE 70 Ca -0.02 -0.65 0.01 0.00 0.12 0.00 0.00 56.93 56.39 1cgs s PHE 70 Cb -0.07 -1.16 -0.04 0.00 -0.57 0.00 0.00 43.02 41.18 1cgs s PHE 70 CO 0.01 -0.38 -0.05 0.95 -0.10 0.00 0.00 175.22 175.65 1cgs s THR 71 N 1.04 0.51 -0.10 0.64 -4.23 -1.23 -4.96 115.64 107.30 1cgs s THR 71 Ca -0.07 -1.89 -0.06 0.00 -1.18 0.00 0.00 61.69 58.49 1cgs s THR 71 Cb -0.15 -1.63 0.04 0.00 1.34 0.00 0.00 72.50 72.10 1cgs s THR 71 CO -0.01 -0.91 0.25 0.00 -0.54 0.00 0.00 174.62 173.41 1cgs s ALA 72 N -3.74 -0.59 -0.88 3.99 0.00 -1.26 0.09 121.76 119.37 1cgs s ALA 72 Ca 0.10 0.94 -0.10 0.00 0.00 0.00 0.00 51.96 52.90 1cgs s ALA 72 Cb 0.06 -0.59 0.23 0.00 0.00 0.00 0.00 23.12 22.82 1cgs s ALA 72 CO -0.06 -0.18 0.82 0.34 0.00 0.00 0.00 175.76 176.67 1cgs s ASP 73 N 0.99 6.67 0.38 0.00 2.15 -1.15 -4.85 116.67 120.86 1cgs s ASP 73 Ca -0.07 -3.03 0.28 0.00 0.43 0.00 0.00 52.55 50.15 1cgs s ASP 73 Cb -0.08 -2.14 1.29 0.00 -0.30 0.00 0.00 42.92 41.68 1cgs s ASP 73 CO -0.07 -0.44 1.35 0.35 -0.17 0.00 0.00 175.17 176.20 1cgs n THR 74 N 3.45 -0.23 -1.68 1.71 -2.24 -1.26 -0.39 114.28 113.65 1cgs n THR 74 Ca 0.16 1.57 -0.35 0.00 -2.27 0.00 0.00 64.05 63.17 1cgs n THR 74 Cb 0.43 -2.58 0.02 0.00 -2.10 0.00 0.00 70.33 66.11 1cgs n THR 74 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1cgs n SER 75 N -4.46 7.26 0.00 3.42 3.41 -1.26 -3.57 113.62 118.42 1cgs n SER 75 Ca 0.35 -3.64 0.00 0.00 -0.26 0.00 0.00 58.87 55.32 1cgs n SER 75 Cb 1.35 -1.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 1cgs n SER 75 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1cgs n SER 76 N -0.21 0.00 -3.17 4.04 2.88 0.48 -5.02 113.62 112.61 1cgs n SER 76 Ca 0.53 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.87 1cgs n SER 76 Cb 0.39 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.84 1cgs n SER 76 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1cgs n ASN 77 N 0.00 -3.40 -4.89 -3.46 4.13 -0.37 -4.87 115.26 102.41 1cgs n ASN 77 Ca 0.00 -0.24 -0.28 0.00 1.68 0.00 0.00 54.58 55.74 1cgs n ASN 77 Cb 0.00 -2.85 -0.04 0.00 -1.54 0.00 0.00 39.78 35.35 1cgs n ASN 77 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1cgs s THR 78 N -2.80 5.10 0.35 3.41 2.01 -1.26 -1.70 115.64 120.76 1cgs s THR 78 Ca 0.31 -0.69 0.09 0.00 0.31 0.00 0.00 61.69 61.71 1cgs s THR 78 Cb -0.17 -3.57 -0.05 0.00 0.01 0.00 0.00 72.50 68.72 1cgs s THR 78 CO 0.38 -0.01 0.05 0.00 -0.69 0.00 0.00 174.62 174.36 1cgs s ALA 79 N -1.64 3.29 -0.00 7.40 0.00 -0.82 -2.92 121.76 127.07 1cgs s ALA 79 Ca 0.33 -1.97 0.00 0.00 0.00 0.00 0.00 51.96 50.33 1cgs s ALA 79 Cb -0.12 -0.42 0.00 0.00 0.00 0.00 0.00 23.12 22.59 1cgs s ALA 79 CO 0.27 0.03 -0.01 0.71 0.00 0.00 0.00 175.76 176.75 1cgs s TYR 80 N -2.52 0.14 -0.08 0.00 2.02 0.11 -2.51 117.35 114.52 1cgs s TYR 80 Ca 0.36 -0.02 -0.02 0.00 -0.37 0.00 0.00 57.07 57.02 1cgs s TYR 80 Cb 0.00 -0.11 0.03 0.00 -0.40 0.00 0.00 41.96 41.49 1cgs s TYR 80 CO 0.20 -0.01 0.02 1.41 -1.57 0.00 0.00 175.55 175.60 1cgs s MET 81 N 0.03 0.47 -0.21 -0.62 -2.45 -1.08 -3.49 119.30 111.94 1cgs s MET 81 Ca 0.00 0.09 0.00 0.00 -1.25 0.00 0.00 55.69 54.54 1cgs s MET 81 Cb -0.01 -1.05 0.03 0.00 1.25 0.00 0.00 34.83 35.04 1cgs s MET 81 CO -0.00 -0.36 -0.14 -1.14 1.05 0.00 0.00 175.02 174.43 1cgs s GLN 82 N 2.00 2.85 -0.44 4.11 0.74 -1.00 -1.55 119.66 126.37 1cgs s GLN 82 Ca 0.04 -0.94 -0.13 0.00 0.05 0.00 0.00 55.36 54.38 1cgs s GLN 82 Cb -0.13 -2.77 0.06 0.00 1.10 0.00 0.00 33.01 31.28 1cgs s GLN 82 CO -0.05 -0.32 0.32 -0.51 -0.55 0.00 0.00 175.29 174.17 1cgs s LEU 83 N 1.28 5.30 0.84 3.68 1.43 -1.15 -1.61 118.68 128.44 1cgs s LEU 83 Ca 0.01 -1.28 -0.09 0.00 -1.03 0.00 0.00 54.13 51.74 1cgs s LEU 83 Cb -0.15 -2.10 0.15 0.00 0.03 0.00 0.00 46.19 44.12 1cgs s LEU 83 CO -0.09 -0.55 1.16 -0.44 0.23 0.00 0.00 176.35 176.66 1cgs s SER 84 N 2.20 3.82 -0.88 2.29 0.01 -0.86 -3.27 113.70 117.01 1cgs s SER 84 Ca 0.04 0.10 -0.23 0.00 1.31 0.00 0.00 55.95 57.16 1cgs s SER 84 Cb -0.23 -0.36 0.03 0.00 0.21 0.00 0.00 66.02 65.68 1cgs s SER 84 CO 0.06 -2.25 0.51 -1.20 0.41 0.00 0.00 173.24 170.77 1cgs n SER 85 N -3.32 -3.18 -4.44 2.44 7.64 -1.13 -4.87 113.62 106.77 1cgs n SER 85 Ca 0.14 -0.96 -0.32 0.00 1.01 0.00 0.00 58.87 58.73 1cgs n SER 85 Cb 0.60 -1.20 0.14 0.00 -1.01 0.00 0.00 64.21 62.74 1cgs n SER 85 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1cgs n LEU 86 N -3.82 -0.03 -3.70 -3.43 4.77 -0.86 -4.74 117.00 105.18 1cgs n LEU 86 Ca -0.11 0.27 -0.02 0.00 -0.03 0.00 0.00 56.01 56.12 1cgs n LEU 86 Cb 0.44 -1.22 -0.01 0.00 -2.33 0.00 0.00 43.42 40.30 1cgs n LEU 86 CO 0.56 -3.36 0.84 0.28 -1.33 0.00 0.00 177.39 174.38 1cgs s THR 87 N -2.41 0.00 0.31 -5.08 -1.32 -1.26 -3.14 115.64 102.74 1cgs s THR 87 Ca 0.58 -0.49 0.17 0.00 -1.21 0.00 0.00 61.69 60.74 1cgs s THR 87 Cb -0.20 -1.96 0.17 0.00 -1.51 0.00 0.00 72.50 69.00 1cgs s THR 87 CO 0.66 0.00 1.45 0.28 -2.21 0.00 0.00 174.62 174.80 1cgs h SER 88 N 2.00 0.00 -0.11 8.08 0.02 -1.98 0.23 113.55 121.79 1cgs h SER 88 Ca -0.26 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 1cgs h SER 88 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1cgs h SER 88 CO 0.26 0.00 0.00 -1.84 -1.14 0.00 0.00 176.83 174.11 1cgs n GLU 89 N -2.35 1.98 0.02 3.45 0.28 -1.26 -4.04 120.64 118.71 1cgs n GLU 89 Ca -0.01 -1.84 0.11 0.00 -0.16 0.00 0.00 57.16 55.26 1cgs n GLU 89 Cb 0.42 -1.41 -0.02 0.00 1.43 0.00 0.00 31.44 31.86 1cgs n GLU 89 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1cgs n ASP 90 N 1.19 0.59 -4.54 -1.84 8.00 0.79 -4.83 116.55 115.92 1cgs n ASP 90 Ca 0.13 -0.29 -0.25 0.00 0.71 0.00 0.00 54.79 55.09 1cgs n ASP 90 Cb 0.52 0.97 -0.11 0.00 -0.02 0.00 0.00 41.12 42.49 1cgs n ASP 90 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1cgs n SER 91 N -1.94 0.97 -2.63 -2.24 7.64 -1.22 -4.79 113.62 109.42 1cgs n SER 91 Ca 0.01 -0.80 -0.04 0.00 1.01 0.00 0.00 58.87 59.05 1cgs n SER 91 Cb 0.44 -1.28 0.02 0.00 -1.01 0.00 0.00 64.21 62.38 1cgs n SER 91 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1cgs n ALA 92 N 13.90 -1.80 -2.80 -0.43 0.00 0.79 -4.87 120.51 125.29 1cgs n ALA 92 Ca 0.52 -0.89 -0.35 0.00 0.00 0.00 0.00 53.44 52.72 1cgs n ALA 92 Cb 0.34 0.60 -0.08 0.00 0.00 0.00 0.00 19.45 20.30 1cgs n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1cgs s VAL 93 N -2.22 5.11 -0.10 0.00 1.01 -0.20 -1.41 120.40 122.58 1cgs s VAL 93 Ca 0.16 0.07 0.03 0.00 0.00 0.00 0.00 61.98 62.24 1cgs s VAL 93 Cb -0.03 -3.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.08 1cgs s VAL 93 CO 0.06 0.53 -0.21 -0.31 0.00 0.00 0.00 175.10 175.17 1cgs s TYR 94 N -0.25 2.61 0.01 5.22 1.51 0.30 -1.06 117.35 125.70 1cgs s TYR 94 Ca 0.09 -0.85 0.05 0.00 -1.01 0.00 0.00 57.07 55.36 1cgs s TYR 94 Cb -0.12 -1.72 -0.03 0.00 -0.11 0.00 0.00 41.96 39.98 1cgs s TYR 94 CO 0.01 -0.31 -0.15 0.71 -1.11 0.00 0.00 175.55 174.71 1cgs s TYR 95 N 0.22 2.67 0.49 2.71 2.02 -0.82 -2.62 117.35 122.01 1cgs s TYR 95 Ca -0.13 -0.19 0.07 0.00 -0.37 0.00 0.00 57.07 56.45 1cgs s TYR 95 Cb -0.16 -1.53 0.04 0.00 -0.40 0.00 0.00 41.96 39.90 1cgs s TYR 95 CO 0.07 0.27 0.67 0.00 -1.57 0.00 0.00 175.55 174.98 1cgs s THR 97 N -2.51 0.00 -0.24 0.00 2.01 0.45 -2.23 115.64 113.12 1cgs s THR 97 Ca 0.57 0.00 -0.08 0.00 0.31 0.00 0.00 61.69 62.50 1cgs s THR 97 Cb -0.09 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.39 1cgs s THR 97 CO 0.36 0.00 0.08 -0.60 -0.69 0.00 0.00 174.62 173.77 1cgs s ARG 98 N -1.02 3.76 -0.11 4.92 3.00 -0.69 0.29 118.95 129.11 1cgs s ARG 98 Ca -0.02 -0.43 -0.18 0.00 -1.00 0.00 0.00 55.73 54.10 1cgs s ARG 98 Cb -0.01 -3.34 0.04 0.00 0.00 0.00 0.00 34.95 31.64 1cgs s ARG 98 CO 0.01 -0.09 0.45 0.20 0.00 0.00 0.00 175.30 175.88 1cgs s GLY 99 N 1.37 -0.32 0.00 8.12 0.00 -1.21 -0.22 107.32 115.06 1cgs s GLY 99 Ca 0.05 1.01 0.00 0.00 0.00 0.00 0.00 44.72 45.79 1cgs s GLY 99 CO 0.04 0.80 0.00 1.58 0.00 0.00 0.00 173.10 175.52 1cgs n TYR 100 N 2.08 0.00 -1.29 1.90 0.18 -1.26 -3.88 117.16 114.89 1cgs n TYR 100 Ca -0.17 0.00 -0.20 0.00 1.88 0.00 0.00 57.90 59.42 1cgs n TYR 100 Cb 0.57 0.00 0.18 0.00 -0.38 0.00 0.00 39.34 39.71 1cgs n TYR 100 CO 0.00 0.00 0.00 -1.13 -2.08 0.00 0.00 176.86 173.65 1cgs n SER 101 N -0.48 3.49 0.00 9.48 3.41 -1.26 -4.86 113.62 123.41 1cgs n SER 101 Ca 0.00 -3.66 0.00 0.00 -0.26 0.00 0.00 58.87 54.95 1cgs n SER 101 Cb 0.00 -0.79 0.00 0.00 -0.26 0.00 0.00 64.21 63.16 1cgs n SER 101 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1cgs n SER 102 N -1.14 0.00 -4.06 4.04 3.41 -1.26 -5.04 113.62 109.56 1cgs n SER 102 Ca 0.54 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.77 1cgs n SER 102 Cb 1.51 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 65.42 1cgs n SER 102 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1cgs n MET 103 N -0.17 3.08 0.00 4.33 2.81 -1.26 -4.22 117.12 121.68 1cgs n MET 103 Ca 0.00 -4.51 0.00 0.00 -1.81 0.00 0.00 57.70 51.38 1cgs n MET 103 Cb 0.00 -2.44 0.00 0.00 -0.71 0.00 0.00 33.22 30.07 1cgs n MET 103 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1cgs n ASP 104 N 2.05 0.00 -3.94 7.83 9.92 0.70 -4.68 116.55 128.43 1cgs n ASP 104 Ca 0.24 0.52 -0.19 0.00 -0.53 0.00 0.00 54.79 54.83 1cgs n ASP 104 Cb 0.37 -0.17 -0.16 0.00 -0.64 0.00 0.00 41.12 40.52 1cgs n ASP 104 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1cgs s TYR 105 N -1.97 0.78 -0.12 1.24 1.51 -0.12 -4.98 117.35 113.69 1cgs s TYR 105 Ca 0.00 -0.20 -0.03 0.00 -1.01 0.00 0.00 57.07 55.83 1cgs s TYR 105 Cb 0.00 -0.61 -0.03 0.00 -0.11 0.00 0.00 41.96 41.20 1cgs s TYR 105 CO 0.00 -0.13 0.01 -1.58 -1.11 0.00 0.00 175.55 172.75 1cgs s TRP 106 N 0.47 3.17 1.19 2.71 0.52 -1.26 -1.70 118.94 124.05 1cgs s TRP 106 Ca -0.07 0.10 -0.13 0.00 0.02 0.00 0.00 56.10 56.02 1cgs s TRP 106 Cb -0.10 -1.88 0.30 0.00 -1.15 0.00 0.00 33.47 30.63 1cgs s TRP 106 CO 0.00 0.33 1.02 0.20 0.02 0.00 0.00 176.95 178.52 1cgs s GLY 107 N -0.43 1.53 -0.06 0.98 0.00 -0.95 -4.89 107.32 103.50 1cgs s GLY 107 Ca 0.08 -0.19 -0.18 0.00 0.00 0.00 0.00 44.72 44.43 1cgs s GLY 107 CO 0.02 0.56 0.74 0.06 0.00 0.00 0.00 173.10 174.48 1cgs h GLN 108 N -2.72 -0.24 0.00 2.90 -0.00 -1.90 -3.44 115.11 109.71 1cgs h GLN 108 Ca -0.63 0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.04 1cgs h GLN 108 Cb 1.34 0.05 0.00 0.00 -0.00 0.00 0.00 27.48 28.87 1cgs h GLN 108 CO 0.50 0.13 0.00 0.41 -0.00 0.00 0.00 178.83 179.88 1cgs n GLY 109 N 0.72 3.66 3.55 0.06 0.00 -1.26 -4.99 105.19 106.94 1cgs n GLY 109 Ca -0.07 -0.47 -0.34 0.00 0.00 0.00 0.00 46.02 45.15 1cgs n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cgs s THR 110 N 0.00 3.97 -0.06 2.61 2.01 -1.08 -4.68 115.64 118.42 1cgs s THR 110 Ca 0.00 -0.34 -0.03 0.00 0.31 0.00 0.00 61.69 61.62 1cgs s THR 110 Cb 0.00 -2.71 -0.04 0.00 0.01 0.00 0.00 72.50 69.76 1cgs s THR 110 CO 0.00 0.53 0.10 -0.44 -0.69 0.00 0.00 174.62 174.12 1cgs s SER 111 N -0.05 5.93 -0.14 3.53 0.01 -1.26 -0.54 113.70 121.18 1cgs s SER 111 Ca 0.02 0.29 -0.03 0.00 1.31 0.00 0.00 55.95 57.54 1cgs s SER 111 Cb -0.13 -1.81 0.05 0.00 0.21 0.00 0.00 66.02 64.34 1cgs s SER 111 CO 0.02 0.34 0.04 -0.69 0.41 0.00 0.00 173.24 173.37 1cgs s VAL 112 N -1.09 0.27 -0.16 3.43 1.01 -0.50 -0.33 120.40 123.03 1cgs s VAL 112 Ca 0.19 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.02 1cgs s VAL 112 Cb -0.12 -0.68 0.01 0.00 0.00 0.00 0.00 36.38 35.58 1cgs s VAL 112 CO 0.09 -0.05 -0.18 0.42 0.00 0.00 0.00 175.10 175.38 1cgs s THR 113 N 1.99 2.34 -0.23 3.92 -4.23 -0.89 -0.15 115.64 118.39 1cgs s THR 113 Ca 0.02 -0.87 -0.10 0.00 -1.18 0.00 0.00 61.69 59.56 1cgs s THR 113 Cb -0.15 -1.98 -0.05 0.00 1.34 0.00 0.00 72.50 71.67 1cgs s THR 113 CO -0.07 0.53 0.14 -0.69 -0.54 0.00 0.00 174.62 173.99 1cgs s VAL 114 N 0.99 5.20 -0.28 2.29 1.01 -1.26 -1.55 120.40 126.80 1cgs s VAL 114 Ca -0.02 0.12 -0.25 0.00 0.00 0.00 0.00 61.98 61.83 1cgs s VAL 114 Cb -0.15 -3.41 0.11 0.00 0.00 0.00 0.00 36.38 32.94 1cgs s VAL 114 CO -0.04 0.37 0.97 -0.55 0.00 0.00 0.00 175.10 175.85 1cgs s SER 115 N 0.96 -0.51 0.19 3.32 0.15 -0.99 -4.76 113.70 112.07 1cgs s SER 115 Ca 0.07 0.97 -0.09 0.00 0.70 0.00 0.00 55.95 57.60 1cgs s SER 115 Cb -0.13 1.00 0.10 0.00 -1.71 0.00 0.00 66.02 65.27 1cgs s SER 115 CO 0.03 -0.17 1.67 0.00 1.20 0.00 0.00 173.24 175.98 1cgs h ALA 116 N 4.44 0.88 -0.83 5.45 0.00 -1.88 -3.39 119.26 123.93 1cgs h ALA 116 Ca -0.28 -0.29 -0.25 0.00 0.00 0.00 0.00 54.91 54.09 1cgs h ALA 116 Cb 1.17 -0.24 0.08 0.00 0.00 0.00 0.00 17.79 18.80 1cgs h ALA 116 CO 0.10 0.67 -0.49 0.00 0.00 0.00 0.00 179.25 179.53 1cgs n ALA 117 N -2.48 -2.22 -2.60 0.00 0.00 -1.26 -5.02 120.51 106.93 1cgs n ALA 117 Ca 0.04 -0.03 -0.25 0.00 0.00 0.00 0.00 53.44 53.20 1cgs n ALA 117 Cb 0.32 -0.58 -0.15 0.00 0.00 0.00 0.00 19.45 19.03 1cgs n ALA 117 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1cgs s LYS 118 N -0.43 1.46 0.12 0.00 2.20 -1.26 -5.08 119.74 116.75 1cgs s LYS 118 Ca 0.23 -0.60 -0.34 0.00 -0.36 0.00 0.00 55.97 54.90 1cgs s LYS 118 Cb -0.20 -1.37 -0.17 0.00 -1.51 0.00 0.00 37.83 34.58 1cgs s LYS 118 CO 0.28 0.33 1.09 0.25 -0.36 0.00 0.00 175.35 176.94 1cgs n THR 119 N 2.78 0.70 -3.63 3.43 -2.24 -1.26 -4.87 114.28 109.19 1cgs n THR 119 Ca -0.15 -0.18 -0.15 0.00 -2.27 0.00 0.00 64.05 61.30 1cgs n THR 119 Cb 0.54 -0.54 -0.07 0.00 -2.10 0.00 0.00 70.33 68.15 1cgs n THR 119 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1cgs s THR 120 N -0.16 0.00 0.02 4.28 -4.23 -1.21 -5.00 115.64 109.35 1cgs s THR 120 Ca 0.78 -0.04 -0.26 0.00 -1.18 0.00 0.00 61.69 60.99 1cgs s THR 120 Cb -0.97 -0.89 -0.05 0.00 1.34 0.00 0.00 72.50 71.93 1cgs s THR 120 CO 0.53 -0.02 0.83 -2.16 -0.54 0.00 0.00 174.62 173.26 1cgs s PRO 121 N -0.18 4.53 -0.49 3.99 0.04 -1.26 -2.55 135.00 139.08 1cgs s PRO 121 Ca -0.04 1.16 -0.44 0.00 0.04 0.00 0.00 61.00 61.72 1cgs s PRO 121 Cb -0.03 -3.40 -0.19 0.00 0.04 0.00 0.00 34.50 30.92 1cgs s PRO 121 CO 0.03 0.16 2.01 -2.30 0.04 0.00 0.00 177.00 176.94 1cgs n PRO 122 N 3.24 0.07 -2.76 0.56 -0.02 -1.25 -4.85 135.00 129.99 1cgs n PRO 122 Ca 0.00 0.02 -0.43 0.00 -2.02 0.00 0.00 63.50 61.08 1cgs n PRO 122 Cb 0.50 -1.55 -0.03 0.00 -0.02 0.00 0.00 33.50 32.40 1cgs n PRO 122 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1cgs s SER 123 N 5.30 6.64 -0.67 2.55 0.01 -1.15 -4.93 113.70 121.45 1cgs s SER 123 Ca 1.16 0.47 -0.24 0.00 1.31 0.00 0.00 55.95 58.65 1cgs s SER 123 Cb -1.46 -2.48 0.06 0.00 0.21 0.00 0.00 66.02 62.34 1cgs s SER 123 CO 0.69 -0.99 1.05 -0.69 0.41 0.00 0.00 173.24 173.72 1cgs s VAL 124 N 3.75 4.15 -0.29 3.43 1.01 -1.26 -1.68 120.40 129.51 1cgs s VAL 124 Ca 0.40 -0.09 -0.07 0.00 0.00 0.00 0.00 61.98 62.23 1cgs s VAL 124 Cb -0.11 -4.74 0.00 0.00 0.00 0.00 0.00 36.38 31.54 1cgs s VAL 124 CO 0.23 -1.55 0.08 -0.31 0.00 0.00 0.00 175.10 173.55 1cgs s TYR 125 N 4.54 3.14 -0.61 5.22 2.02 -0.77 -4.93 117.35 125.96 1cgs s TYR 125 Ca 0.27 -0.89 -0.27 0.00 -0.37 0.00 0.00 57.07 55.81 1cgs s TYR 125 Cb -0.14 -2.26 0.00 0.00 -0.40 0.00 0.00 41.96 39.17 1cgs s TYR 125 CO 0.12 -0.54 1.56 -1.25 -1.57 0.00 0.00 175.55 173.87 1cgs s PRO 126 N 1.52 3.03 -0.58 -1.71 0.04 -1.26 0.34 135.00 136.37 1cgs s PRO 126 Ca 0.03 0.38 -0.27 0.00 0.04 0.00 0.00 61.00 61.18 1cgs s PRO 126 Cb -0.17 -4.24 -0.01 0.00 0.04 0.00 0.00 34.50 30.13 1cgs s PRO 126 CO 0.03 -2.28 1.67 -0.51 0.04 0.00 0.00 177.00 175.95 1cgs s LEU 127 N 7.12 3.33 -0.16 -3.56 1.43 -0.01 -4.91 118.68 121.92 1cgs s LEU 127 Ca 0.55 0.36 -0.00 0.00 -1.03 0.00 0.00 54.13 54.00 1cgs s LEU 127 Cb -0.11 -2.79 0.04 0.00 0.03 0.00 0.00 46.19 43.35 1cgs s LEU 127 CO 0.21 -2.06 -0.08 0.00 0.23 0.00 0.00 176.35 174.65 1cgs s ALA 128 N 7.65 1.60 0.02 4.21 0.00 -1.26 -1.37 121.76 132.61 1cgs s ALA 128 Ca 0.61 -0.85 -0.35 0.00 0.00 0.00 0.00 51.96 51.37 1cgs s ALA 128 Cb -0.13 -1.10 -0.18 0.00 0.00 0.00 0.00 23.12 21.71 1cgs s ALA 128 CO 0.23 -0.65 0.92 -0.35 0.00 0.00 0.00 175.76 175.91 1cgs n PRO 129 N 4.84 0.00 0.00 0.00 -0.04 -1.26 -4.95 135.00 133.58 1cgs n PRO 129 Ca -0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 1cgs n PRO 129 Cb 0.48 -1.32 0.00 0.00 -0.04 0.00 0.00 33.50 32.62 1cgs n PRO 129 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1cgs n GLY 130 N 1.41 1.21 3.59 0.55 0.00 -1.26 -4.95 105.19 105.75 1cgs n GLY 130 Ca 0.18 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.27 1cgs n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cgs n GLY 132 N 5.81 -0.52 0.00 0.00 0.00 -1.26 -4.92 105.19 104.30 1cgs n GLY 132 Ca 0.31 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.55 1cgs n GLY 132 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1cgs n ASP 133 N -1.33 0.00 -4.64 1.61 2.03 -1.26 -5.03 116.55 107.93 1cgs n ASP 133 Ca -0.10 0.00 -0.64 0.00 0.52 0.00 0.00 54.79 54.58 1cgs n ASP 133 Cb 0.41 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.71 1cgs n ASP 133 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1cgs n THR 134 N 0.00 0.08 -4.25 5.18 -2.24 -1.26 -5.00 114.28 106.79 1cgs n THR 134 Ca 0.00 -0.02 -0.18 0.00 -2.27 0.00 0.00 64.05 61.58 1cgs n THR 134 Cb 0.00 -0.71 -0.13 0.00 -2.10 0.00 0.00 70.33 67.39 1cgs n THR 134 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1cgs s THR 135 N 3.87 0.88 0.00 4.28 2.01 -1.26 -5.07 115.64 120.35 1cgs s THR 135 Ca 1.07 -0.92 0.00 0.00 0.31 0.00 0.00 61.69 62.14 1cgs s THR 135 Cb -1.38 -0.83 0.00 0.00 0.01 0.00 0.00 72.50 70.31 1cgs s THR 135 CO 0.74 -0.08 0.00 0.61 -0.69 0.00 0.00 174.62 175.20 1cgs n GLY 136 N 1.91 0.35 0.00 4.40 0.00 -1.26 -4.96 105.19 105.63 1cgs n GLY 136 Ca -0.19 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.26 1cgs n GLY 136 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1cgs n SER 137 N 0.00 0.00 -4.66 1.61 3.41 -1.26 -4.23 113.62 108.49 1cgs n SER 137 Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.20 1cgs n SER 137 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 1cgs n SER 137 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1cgs s SER 138 N -2.92 6.74 -0.37 4.04 0.15 -1.26 0.29 113.70 120.37 1cgs s SER 138 Ca 0.00 0.91 -0.28 0.00 0.70 0.00 0.00 55.95 57.28 1cgs s SER 138 Cb 0.00 -2.38 0.02 0.00 -1.71 0.00 0.00 66.02 61.95 1cgs s SER 138 CO 0.00 -0.33 1.07 0.54 1.20 0.00 0.00 173.24 175.71 1cgs s VAL 139 N 2.12 4.43 0.29 4.45 0.11 0.49 -4.82 120.40 127.47 1cgs s VAL 139 Ca 0.31 1.49 -0.14 0.00 -2.93 0.00 0.00 61.98 60.72 1cgs s VAL 139 Cb -0.16 -4.46 -0.08 0.00 -1.53 0.00 0.00 36.38 30.15 1cgs s VAL 139 CO 0.10 -0.64 0.68 -0.89 -3.33 0.00 0.00 175.10 171.02 1cgs s THR 140 N 3.85 4.74 0.31 5.04 2.01 -1.26 -2.21 115.64 128.13 1cgs s THR 140 Ca 0.45 0.83 0.07 0.00 0.31 0.00 0.00 61.69 63.35 1cgs s THR 140 Cb -0.11 -3.62 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 1cgs s THR 140 CO 0.21 -0.14 0.25 0.18 -0.69 0.00 0.00 174.62 174.43 1cgs n LEU 141 N -0.25 0.00 -3.70 4.42 4.32 0.20 -4.73 117.00 117.26 1cgs n LEU 141 Ca 0.02 -2.89 -0.03 0.00 -0.02 0.00 0.00 56.01 53.09 1cgs n LEU 141 Cb 0.53 1.48 -0.01 0.00 -1.62 0.00 0.00 43.42 43.80 1cgs n LEU 141 CO 0.42 -0.48 0.79 -0.83 -1.22 0.00 0.00 177.39 176.08 1cgs s GLY 142 N -3.14 -0.29 -0.16 -0.72 0.00 -0.47 -1.09 107.32 101.44 1cgs s GLY 142 Ca 0.35 0.36 -0.04 0.00 0.00 0.00 0.00 44.72 45.39 1cgs s GLY 142 CO 0.25 0.07 0.22 0.00 0.00 0.00 0.00 173.10 173.64 1cgs s LEU 144 N 2.35 4.09 -0.11 0.00 2.96 0.15 -1.54 118.68 126.58 1cgs s LEU 144 Ca 0.05 0.44 -0.01 0.00 -0.22 0.00 0.00 54.13 54.38 1cgs s LEU 144 Cb -0.14 -3.27 0.03 0.00 0.50 0.00 0.00 46.19 43.31 1cgs s LEU 144 CO -0.10 -0.21 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.01 1cgs s VAL 145 N -2.17 0.61 -0.27 1.68 1.01 0.55 -1.84 120.40 119.97 1cgs s VAL 145 Ca 0.40 -0.14 -0.04 0.00 0.00 0.00 0.00 61.98 62.19 1cgs s VAL 145 Cb -0.10 -0.79 0.02 0.00 0.00 0.00 0.00 36.38 35.50 1cgs s VAL 145 CO 0.33 0.20 0.01 -0.75 0.00 0.00 0.00 175.10 174.89 1cgs s LYS 146 N 1.87 2.98 0.46 2.72 2.47 -0.68 -1.40 119.74 128.16 1cgs s LYS 146 Ca 0.04 -0.91 0.00 0.00 -1.56 0.00 0.00 55.97 53.54 1cgs s LYS 146 Cb -0.13 -3.17 0.00 0.00 -1.46 0.00 0.00 37.83 33.06 1cgs s LYS 146 CO -0.07 -0.41 0.00 0.41 0.16 0.00 0.00 175.35 175.44 1cgs n GLY 147 N 4.77 -4.04 0.00 5.54 0.00 -0.37 -2.93 105.19 108.16 1cgs n GLY 147 Ca -0.16 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1cgs n GLY 147 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1cgs n TYR 148 N -0.70 0.00 -3.61 1.61 4.11 -1.16 -3.52 117.16 113.89 1cgs n TYR 148 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.90 57.81 1cgs n TYR 148 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 39.34 39.28 1cgs n TYR 148 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.86 176.98 1cgs s PHE 149 N -2.06 -0.41 0.49 -3.48 5.36 -1.06 -0.43 117.98 116.40 1cgs s PHE 149 Ca 0.00 0.88 0.07 0.00 -0.96 0.00 0.00 56.93 56.92 1cgs s PHE 149 Cb 0.00 0.41 0.07 0.00 -0.34 0.00 0.00 43.02 43.16 1cgs s PHE 149 CO 0.00 -0.27 0.58 -0.35 -1.46 0.00 0.00 175.22 173.72 1cgs n PRO 150 N 1.53 0.70 0.08 10.12 -0.04 -1.26 -3.35 135.00 142.79 1cgs n PRO 150 Ca -0.11 -2.74 0.00 0.00 -0.04 0.00 0.00 63.50 60.60 1cgs n PRO 150 Cb 0.57 -0.05 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 1cgs n PRO 150 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1cgs n GLU 151 N -1.93 0.01 -0.67 0.54 -0.58 -1.26 -4.42 120.64 112.33 1cgs n GLU 151 Ca 0.09 0.24 -0.42 0.00 -0.42 0.00 0.00 57.16 56.65 1cgs n GLU 151 Cb 0.52 -1.71 -0.11 0.00 -0.57 0.00 0.00 31.44 29.57 1cgs n GLU 151 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1cgs n SER 152 N -1.20 1.18 -4.08 1.62 2.88 -1.26 -4.78 113.62 107.99 1cgs n SER 152 Ca 0.00 -2.52 -0.25 0.00 -1.33 0.00 0.00 58.87 54.77 1cgs n SER 152 Cb 0.52 -0.67 -0.16 0.00 -0.75 0.00 0.00 64.21 63.14 1cgs n SER 152 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1cgs s VAL 153 N 7.78 1.27 -0.09 2.46 1.01 -1.26 -3.91 120.40 127.65 1cgs s VAL 153 Ca 0.69 -0.59 -0.04 0.00 0.00 0.00 0.00 61.98 62.04 1cgs s VAL 153 Cb 0.13 -1.12 0.05 0.00 0.00 0.00 0.00 36.38 35.44 1cgs s VAL 153 CO 0.31 0.38 0.20 -0.89 0.00 0.00 0.00 175.10 175.10 1cgs s THR 154 N 0.35 -0.16 -0.20 3.92 2.01 -0.74 -5.00 115.64 115.82 1cgs s THR 154 Ca -0.09 0.23 -0.04 0.00 0.31 0.00 0.00 61.69 62.10 1cgs s THR 154 Cb -0.13 -0.33 -0.02 0.00 0.01 0.00 0.00 72.50 72.03 1cgs s THR 154 CO 0.03 0.10 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.34 1cgs s VAL 155 N 1.68 3.70 -0.40 3.82 1.01 -1.26 -1.47 120.40 127.48 1cgs s VAL 155 Ca -0.04 -0.40 -0.12 0.00 0.00 0.00 0.00 61.98 61.42 1cgs s VAL 155 Cb -0.11 -2.66 0.04 0.00 0.00 0.00 0.00 36.38 33.64 1cgs s VAL 155 CO -0.07 0.44 0.25 -0.89 0.00 0.00 0.00 175.10 174.83 1cgs s THR 156 N 1.07 4.69 -0.20 3.92 2.01 -0.48 -4.84 115.64 121.81 1cgs s THR 156 Ca 0.02 -0.96 0.14 0.00 0.31 0.00 0.00 61.69 61.20 1cgs s THR 156 Cb -0.15 -3.68 0.42 0.00 0.01 0.00 0.00 72.50 69.11 1cgs s THR 156 CO 0.01 -0.34 1.30 1.87 -0.69 0.00 0.00 174.62 176.77 1cgs n TRP 157 N 5.03 0.46 -1.36 4.92 -0.00 -1.26 -0.19 117.44 125.05 1cgs n TRP 157 Ca -0.11 -1.24 -0.53 0.00 -0.00 0.00 0.00 57.50 55.61 1cgs n TRP 157 Cb 0.45 -0.29 -0.07 0.00 -0.00 0.00 0.00 31.31 31.40 1cgs n TRP 157 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 177.69 177.96 1cgs n ASN 158 N -1.09 0.07 -3.05 5.87 6.94 -1.26 -4.70 115.26 118.03 1cgs n ASN 158 Ca 0.22 1.04 -0.23 0.00 -0.02 0.00 0.00 54.58 55.58 1cgs n ASN 158 Cb 0.80 -0.82 0.02 0.00 -2.36 0.00 0.00 39.78 37.42 1cgs n ASN 158 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 1cgs n SER 159 N 1.50 -2.15 -0.00 0.53 2.88 -1.26 -4.50 113.62 110.61 1cgs n SER 159 Ca 0.19 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.62 1cgs n SER 159 Cb 0.06 -0.39 -0.14 0.00 -0.75 0.00 0.00 64.21 63.00 1cgs n SER 159 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1cgs h GLY 160 N -0.95 0.06 0.00 0.46 0.00 -1.84 -3.41 103.07 97.39 1cgs h GLY 160 Ca -0.23 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 46.94 1cgs h GLY 160 CO 0.13 0.14 0.00 -1.26 0.00 0.00 0.00 176.54 175.54 1cgs n SER 161 N -3.16 0.00 -4.01 0.19 2.88 -1.26 -4.15 113.62 104.10 1cgs n SER 161 Ca -0.17 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.04 1cgs n SER 161 Cb 1.04 0.08 -0.11 0.00 -0.75 0.00 0.00 64.21 64.47 1cgs n SER 161 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 1cgs s LEU 162 N -2.84 4.86 0.04 2.46 2.96 -1.26 -5.08 118.68 119.82 1cgs s LEU 162 Ca 0.00 -3.17 -0.28 0.00 -0.22 0.00 0.00 54.13 50.46 1cgs s LEU 162 Cb 0.00 -1.75 0.09 0.00 0.50 0.00 0.00 46.19 45.03 1cgs s LEU 162 CO 0.00 -0.25 0.98 -0.55 -1.32 0.00 0.00 176.35 175.21 1cgs s SER 163 N -0.11 -0.25 0.05 3.68 0.15 -1.26 -3.67 113.70 112.30 1cgs s SER 163 Ca 0.19 -0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.68 1cgs s SER 163 Cb -0.19 0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 1cgs s SER 163 CO -0.05 -0.66 0.00 -1.54 1.20 0.00 0.00 173.24 172.18 1cgs n SER 164 N -0.34 -0.38 -4.53 5.45 3.41 -1.24 -4.83 113.62 111.15 1cgs n SER 164 Ca -0.07 0.10 -0.27 0.00 -0.26 0.00 0.00 58.87 58.37 1cgs n SER 164 Cb 0.61 0.69 -0.12 0.00 -0.26 0.00 0.00 64.21 65.12 1cgs n SER 164 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1cgs n SER 165 N -2.61 0.69 -4.35 4.04 7.64 -1.26 -4.88 113.62 112.88 1cgs n SER 165 Ca 0.00 -0.63 -0.36 0.00 1.01 0.00 0.00 58.87 58.89 1cgs n SER 165 Cb 0.00 -1.17 -0.13 0.00 -1.01 0.00 0.00 64.21 61.90 1cgs n SER 165 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1cgs s VAL 166 N 8.91 3.73 -0.08 0.44 1.01 -1.26 -1.86 120.40 131.28 1cgs s VAL 166 Ca 1.15 -0.49 0.01 0.00 0.00 0.00 0.00 61.98 62.65 1cgs s VAL 166 Cb -0.59 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 1cgs s VAL 166 CO 0.35 0.31 -0.09 -1.00 0.00 0.00 0.00 175.10 174.67 1cgs s HIS 167 N 1.51 2.88 -0.33 5.22 3.76 0.23 -4.96 115.29 123.60 1cgs s HIS 167 Ca 0.05 -0.12 0.00 0.00 -0.15 0.00 0.00 55.06 54.84 1cgs s HIS 167 Cb -0.15 -1.73 0.08 0.00 1.11 0.00 0.00 32.58 31.88 1cgs s HIS 167 CO -0.00 0.21 0.04 0.99 -0.85 0.00 0.00 174.74 175.12 1cgs s THR 168 N -0.55 2.73 0.47 1.30 2.01 -1.26 -0.46 115.64 119.88 1cgs s THR 168 Ca 0.08 -1.81 -0.19 0.00 0.31 0.00 0.00 61.69 60.08 1cgs s THR 168 Cb -0.12 -2.75 -0.09 0.00 0.01 0.00 0.00 72.50 69.55 1cgs s THR 168 CO 0.02 -0.34 0.96 -0.36 -0.69 0.00 0.00 174.62 174.21 1cgs s PHE 169 N 1.12 3.38 1.33 4.92 0.08 -1.24 -5.02 117.98 122.55 1cgs s PHE 169 Ca 0.01 1.52 -0.18 0.00 0.12 0.00 0.00 56.93 58.40 1cgs s PHE 169 Cb -0.20 -2.81 0.34 0.00 -0.57 0.00 0.00 43.02 39.78 1cgs s PHE 169 CO -0.04 -0.23 0.92 -2.30 -0.10 0.00 0.00 175.22 173.47 1cgs n PRO 170 N -1.09 -3.69 -4.15 0.24 -0.02 -1.26 -4.46 135.00 120.58 1cgs n PRO 170 Ca 0.07 -1.08 -0.35 0.00 -2.02 0.00 0.00 63.50 60.13 1cgs n PRO 170 Cb 0.54 -2.03 -0.12 0.00 -0.02 0.00 0.00 33.50 31.87 1cgs n PRO 170 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1cgs s ALA 171 N -2.25 3.11 0.51 3.55 0.00 -1.26 -4.62 121.76 120.80 1cgs s ALA 171 Ca 0.68 -0.89 -0.11 0.00 0.00 0.00 0.00 51.96 51.63 1cgs s ALA 171 Cb -0.19 -1.75 -0.06 0.00 0.00 0.00 0.00 23.12 21.12 1cgs s ALA 171 CO 0.61 0.01 0.91 -0.51 0.00 0.00 0.00 175.76 176.79 1cgs s LEU 172 N 0.71 3.55 -0.03 0.00 1.43 -1.21 -4.96 118.68 118.17 1cgs s LEU 172 Ca 0.00 1.30 0.14 0.00 -1.03 0.00 0.00 54.13 54.54 1cgs s LEU 172 Cb -0.14 -4.26 0.43 0.00 0.03 0.00 0.00 46.19 42.25 1cgs s LEU 172 CO 0.02 -0.63 1.36 0.18 0.23 0.00 0.00 176.35 177.51 1cgs n LEU 173 N -2.00 3.39 -4.65 1.79 4.32 -1.26 -3.50 117.00 115.09 1cgs n LEU 173 Ca 0.04 -2.15 -0.52 0.00 -0.02 0.00 0.00 56.01 53.36 1cgs n LEU 173 Cb 0.54 -0.34 -0.06 0.00 -1.62 0.00 0.00 43.42 41.94 1cgs n LEU 173 CO 0.51 0.78 1.17 1.67 -1.22 0.00 0.00 177.39 180.31 1cgs n GLN 174 N 0.68 1.47 -2.71 3.23 0.00 -1.21 -3.02 117.38 115.82 1cgs n GLN 174 Ca 0.16 0.53 -0.22 0.00 -0.00 0.00 0.00 57.00 57.48 1cgs n GLN 174 Cb 0.55 -2.24 0.01 0.00 0.00 0.00 0.00 30.24 28.56 1cgs n GLN 174 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1cgs n SER 175 N 4.18 -5.96 0.00 1.69 7.64 -1.26 -1.98 113.62 117.93 1cgs n SER 175 Ca 0.21 -0.15 0.00 0.00 1.01 0.00 0.00 58.87 59.95 1cgs n SER 175 Cb 0.20 -4.89 0.00 0.00 -1.01 0.00 0.00 64.21 58.51 1cgs n SER 175 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1cgs n GLY 176 N -1.26 0.65 3.48 0.23 0.00 -1.17 -4.98 105.19 102.15 1cgs n GLY 176 Ca -0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.60 1cgs n GLY 176 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cgs s LEU 177 N 0.00 2.63 -0.08 0.99 1.43 -0.84 -4.62 118.68 118.19 1cgs s LEU 177 Ca 0.00 -1.12 0.00 0.00 -1.03 0.00 0.00 54.13 51.98 1cgs s LEU 177 Cb 0.00 -0.95 -0.03 0.00 0.03 0.00 0.00 46.19 45.24 1cgs s LEU 177 CO 0.00 -0.14 -0.08 -0.31 0.23 0.00 0.00 176.35 176.05 1cgs s TYR 178 N -2.67 2.91 -0.17 0.29 2.02 0.43 -3.31 117.35 116.85 1cgs s TYR 178 Ca 0.30 -0.10 -0.05 0.00 -0.37 0.00 0.00 57.07 56.86 1cgs s TYR 178 Cb -0.00 -1.74 0.08 0.00 -0.40 0.00 0.00 41.96 39.90 1cgs s TYR 178 CO 0.14 0.22 0.29 -0.08 -1.57 0.00 0.00 175.55 174.55 1cgs s THR 179 N -0.54 -0.46 0.17 -0.71 -1.32 -1.23 -1.23 115.64 110.32 1cgs s THR 179 Ca 0.08 0.15 -0.07 0.00 -1.21 0.00 0.00 61.69 60.64 1cgs s THR 179 Cb -0.12 -0.56 -0.02 0.00 -1.51 0.00 0.00 72.50 70.29 1cgs s THR 179 CO 0.02 0.02 0.25 0.00 -2.21 0.00 0.00 174.62 172.70 1cgs s MET 180 N 2.45 1.15 0.00 7.08 0.23 -0.49 -3.34 119.30 126.38 1cgs s MET 180 Ca 0.03 -1.25 0.00 0.00 -1.03 0.00 0.00 55.69 53.44 1cgs s MET 180 Cb -0.13 0.35 0.00 0.00 -1.53 0.00 0.00 34.83 33.52 1cgs s MET 180 CO -0.11 -0.41 0.00 -1.13 -2.03 0.00 0.00 175.02 171.34 1cgs n SER 181 N -0.21 1.59 -3.65 -1.18 3.41 -1.26 -0.33 113.62 111.99 1cgs n SER 181 Ca -0.06 -0.48 -0.11 0.00 -0.26 0.00 0.00 58.87 57.96 1cgs n SER 181 Cb 0.63 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.53 1cgs n SER 181 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1cgs s SER 182 N -0.18 -0.23 -0.26 4.04 0.01 -0.59 -3.63 113.70 112.86 1cgs s SER 182 Ca 0.00 -0.24 -0.20 0.00 1.31 0.00 0.00 55.95 56.82 1cgs s SER 182 Cb 0.00 0.45 0.07 0.00 0.21 0.00 0.00 66.02 66.76 1cgs s SER 182 CO 0.00 -0.80 0.66 -0.94 0.41 0.00 0.00 173.24 172.58 1cgs s SER 183 N -2.58 -0.78 0.10 2.44 1.04 0.39 -3.15 113.70 111.16 1cgs s SER 183 Ca 0.01 1.39 0.07 0.00 0.48 0.00 0.00 55.95 57.89 1cgs s SER 183 Cb 0.01 1.34 -0.03 0.00 0.10 0.00 0.00 66.02 67.44 1cgs s SER 183 CO -0.09 -0.23 -0.17 -0.69 0.98 0.00 0.00 173.24 173.04 1cgs s VAL 184 N 0.90 1.41 -0.99 5.02 1.01 -0.25 -0.60 120.40 126.90 1cgs s VAL 184 Ca -0.04 -1.50 -0.04 0.00 0.00 0.00 0.00 61.98 60.39 1cgs s VAL 184 Cb -0.05 -1.38 0.25 0.00 0.00 0.00 0.00 36.38 35.21 1cgs s VAL 184 CO -0.08 -0.21 0.99 0.41 0.00 0.00 0.00 175.10 176.22 1cgs n THR 185 N 1.01 3.84 -3.63 3.92 -1.04 -0.78 -0.62 114.28 116.98 1cgs n THR 185 Ca -0.19 -5.32 -0.38 0.00 -2.04 0.00 0.00 64.05 56.12 1cgs n THR 185 Cb 0.55 -2.41 -0.11 0.00 -1.82 0.00 0.00 70.33 66.53 1cgs n THR 185 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1cgs s VAL 186 N -1.57 5.02 0.06 12.58 1.01 -0.94 -3.71 120.40 132.86 1cgs s VAL 186 Ca 0.30 0.04 -0.31 0.00 0.00 0.00 0.00 61.98 62.01 1cgs s VAL 186 Cb -0.06 -3.40 -0.06 0.00 0.00 0.00 0.00 36.38 32.86 1cgs s VAL 186 CO -0.08 0.25 1.28 -2.16 0.00 0.00 0.00 175.10 174.39 1cgs s PRO 187 N 1.72 4.38 0.00 2.72 0.04 -1.24 0.19 135.00 142.80 1cgs s PRO 187 Ca 0.07 1.87 0.00 0.00 0.04 0.00 0.00 61.00 62.98 1cgs s PRO 187 Cb -0.16 -3.36 0.00 0.00 0.04 0.00 0.00 34.50 31.03 1cgs s PRO 187 CO 0.09 -0.36 0.00 -1.13 0.04 0.00 0.00 177.00 175.64 1cgs n SER 188 N 4.18 0.00 -0.36 6.66 3.41 0.14 -1.22 113.62 126.43 1cgs n SER 188 Ca 0.10 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.63 1cgs n SER 188 Cb 0.45 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.33 1cgs n SER 188 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1cgs n SER 189 N -1.25 -0.87 0.16 4.04 3.41 -1.26 -0.87 113.62 116.98 1cgs n SER 189 Ca 0.00 1.54 0.10 0.00 -0.26 0.00 0.00 58.87 60.25 1cgs n SER 189 Cb 0.00 -0.22 0.55 0.00 -0.26 0.00 0.00 64.21 64.28 1cgs n SER 189 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1cgs n THR 190 N -5.11 1.05 -4.74 6.66 5.66 -0.36 -4.34 114.28 113.09 1cgs n THR 190 Ca 0.03 0.73 -0.26 0.00 -3.05 0.00 0.00 64.05 61.50 1cgs n THR 190 Cb 0.24 -1.73 -0.16 0.00 -1.55 0.00 0.00 70.33 67.13 1cgs n THR 190 CO 0.00 0.00 0.00 0.86 -3.05 0.00 0.00 175.07 172.88 1cgs s TRP 191 N -3.51 1.68 -0.38 1.09 -0.00 -0.05 -3.07 118.94 114.71 1cgs s TRP 191 Ca -0.02 -0.60 0.05 0.00 -0.00 0.00 0.00 56.10 55.53 1cgs s TRP 191 Cb 0.06 -1.18 0.44 0.00 -0.00 0.00 0.00 33.47 32.79 1cgs s TRP 191 CO 0.18 -0.27 1.43 -2.30 -0.00 0.00 0.00 176.95 176.00 1cgs n PRO 192 N 3.59 2.43 -0.30 5.86 -0.02 -1.26 -4.81 135.00 140.48 1cgs n PRO 192 Ca -0.21 -1.86 0.24 0.00 -2.02 0.00 0.00 63.50 59.65 1cgs n PRO 192 Cb 0.52 -1.82 0.55 0.00 -0.02 0.00 0.00 33.50 32.74 1cgs n PRO 192 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1cgs h SER 193 N 1.36 0.36 -3.77 2.55 4.64 -1.75 -3.39 113.55 113.54 1cgs h SER 193 Ca 0.23 0.06 -0.45 0.00 -0.47 0.00 0.00 61.79 61.16 1cgs h SER 193 Cb 1.83 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.79 1cgs h SER 193 CO 0.52 0.09 -0.58 -1.10 -0.87 0.00 0.00 176.83 174.88 1cgs s GLN 194 N -5.38 1.65 -0.07 4.77 1.11 -1.17 -5.14 119.66 115.42 1cgs s GLN 194 Ca -0.08 -1.94 0.04 0.00 0.01 0.00 0.00 55.36 53.39 1cgs s GLN 194 Cb 0.24 -0.53 -0.02 0.00 -1.01 0.00 0.00 33.01 31.70 1cgs s GLN 194 CO 0.79 -0.33 -0.18 0.99 0.01 0.00 0.00 175.29 176.57 1cgs s THR 195 N -3.44 2.65 0.16 -0.19 2.01 -1.26 -4.71 115.64 110.86 1cgs s THR 195 Ca 0.34 -0.85 -0.13 0.00 0.31 0.00 0.00 61.69 61.36 1cgs s THR 195 Cb 0.06 -2.03 -0.07 0.00 0.01 0.00 0.00 72.50 70.47 1cgs s THR 195 CO 0.15 0.57 0.53 -0.69 -0.69 0.00 0.00 174.62 174.49 1cgs s VAL 196 N -0.21 4.91 -0.16 3.82 1.01 -1.26 -4.61 120.40 123.89 1cgs s VAL 196 Ca -0.01 0.70 -0.13 0.00 0.00 0.00 0.00 61.98 62.54 1cgs s VAL 196 Cb -0.13 -3.70 0.05 0.00 0.00 0.00 0.00 36.38 32.60 1cgs s VAL 196 CO 0.03 0.18 0.41 -0.89 0.00 0.00 0.00 175.10 174.83 1cgs s THR 197 N -1.54 -0.01 0.25 3.92 2.01 -1.26 -2.99 115.64 116.03 1cgs s THR 197 Ca 0.39 0.03 0.06 0.00 0.31 0.00 0.00 61.69 62.48 1cgs s THR 197 Cb -0.14 -0.58 -0.03 0.00 0.01 0.00 0.00 72.50 71.76 1cgs s THR 197 CO 0.19 0.01 0.33 0.00 -0.69 0.00 0.00 174.62 174.47 1cgs s SER 199 N -3.96 1.25 -0.20 0.00 1.04 0.73 -1.22 113.70 111.34 1cgs s SER 199 Ca 0.35 0.02 -0.08 0.00 0.48 0.00 0.00 55.95 56.71 1cgs s SER 199 Cb -0.09 -0.24 -0.04 0.00 0.10 0.00 0.00 66.02 65.75 1cgs s SER 199 CO 0.28 -0.22 0.09 -0.69 0.98 0.00 0.00 173.24 173.68 1cgs s VAL 200 N 2.05 4.98 -0.24 5.02 1.01 -0.29 -1.38 120.40 131.56 1cgs s VAL 200 Ca 0.04 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.06 1cgs s VAL 200 Cb -0.12 -3.26 0.06 0.00 0.00 0.00 0.00 36.38 33.06 1cgs s VAL 200 CO -0.04 0.44 -0.03 0.00 0.00 0.00 0.00 175.10 175.47 1cgs s ALA 201 N 0.49 1.82 -0.80 5.51 0.00 -0.54 -0.55 121.76 127.69 1cgs s ALA 201 Ca 0.05 -1.31 0.02 0.00 0.00 0.00 0.00 51.96 50.72 1cgs s ALA 201 Cb -0.12 -1.42 0.21 0.00 0.00 0.00 0.00 23.12 21.78 1cgs s ALA 201 CO 0.00 -1.23 0.70 1.58 0.00 0.00 0.00 175.76 176.81 1cgs n HIS 202 N 4.72 3.69 0.29 0.00 -0.00 -1.10 -1.79 115.22 121.03 1cgs n HIS 202 Ca -0.10 -4.14 0.15 0.00 0.46 0.00 0.00 57.72 54.08 1cgs n HIS 202 Cb 0.44 -0.86 0.79 0.00 -0.12 0.00 0.00 29.99 30.24 1cgs n HIS 202 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1cgs h PRO 203 N 5.47 0.00 0.00 1.57 0.13 -1.78 -1.22 132.00 136.17 1cgs h PRO 203 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1cgs h PRO 203 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1cgs h PRO 203 CO 0.82 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.59 1cgs n ALA 204 N -1.85 1.27 -0.56 -0.56 0.00 -1.26 -2.58 120.51 114.96 1cgs n ALA 204 Ca -0.02 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1cgs n ALA 204 Cb 0.27 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1cgs n ALA 204 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1cgs n SER 205 N -2.09 0.52 -3.88 0.00 3.41 -0.48 -5.03 113.62 106.08 1cgs n SER 205 Ca 0.00 -1.09 -0.31 0.00 -0.26 0.00 0.00 58.87 57.22 1cgs n SER 205 Cb 0.10 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.06 1cgs n SER 205 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1cgs n SER 206 N -0.04 -2.80 -3.90 4.04 7.64 -1.06 -4.96 113.62 112.54 1cgs n SER 206 Ca 0.00 -1.06 -0.14 0.00 1.01 0.00 0.00 58.87 58.67 1cgs n SER 206 Cb 0.19 -2.93 -0.14 0.00 -1.01 0.00 0.00 64.21 60.32 1cgs n SER 206 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1cgs s THR 207 N -3.72 0.19 0.06 0.44 2.01 -1.23 -5.04 115.64 108.36 1cgs s THR 207 Ca 0.26 -0.08 -0.09 0.00 0.31 0.00 0.00 61.69 62.10 1cgs s THR 207 Cb -0.11 -0.19 0.00 0.00 0.01 0.00 0.00 72.50 72.22 1cgs s THR 207 CO 0.89 0.07 0.19 -0.89 -0.69 0.00 0.00 174.62 174.19 1cgs s THR 208 N 0.11 0.13 -0.02 -0.82 2.01 -1.26 -2.70 115.64 113.08 1cgs s THR 208 Ca -0.01 -1.05 -0.02 0.00 0.31 0.00 0.00 61.69 60.93 1cgs s THR 208 Cb -0.03 -1.13 0.00 0.00 0.01 0.00 0.00 72.50 71.35 1cgs s THR 208 CO -0.00 -0.58 0.05 -0.69 -0.69 0.00 0.00 174.62 172.70 1cgs s VAL 209 N -3.23 0.01 -0.09 3.82 1.01 0.29 -4.98 120.40 117.23 1cgs s VAL 209 Ca 0.00 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 61.96 1cgs s VAL 209 Cb 0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 36.38 36.30 1cgs s VAL 209 CO -0.08 -0.03 -0.21 -1.81 0.00 0.00 0.00 175.10 172.98 1cgs s ASP 210 N -0.08 3.40 -0.06 3.32 1.11 -1.26 -1.13 116.67 121.97 1cgs s ASP 210 Ca -0.01 -0.45 -0.03 0.00 0.18 0.00 0.00 52.55 52.24 1cgs s ASP 210 Cb -0.01 -1.22 0.04 0.00 1.07 0.00 0.00 42.92 42.79 1cgs s ASP 210 CO 0.00 0.21 0.11 -0.54 1.18 0.00 0.00 175.17 176.12 1cgs s LYS 211 N 0.08 -0.03 0.49 8.23 1.02 -0.36 -4.99 119.74 124.18 1cgs s LYS 211 Ca -0.09 0.46 -0.19 0.00 0.02 0.00 0.00 55.97 56.17 1cgs s LYS 211 Cb -0.15 -0.41 -0.09 0.00 -0.52 0.00 0.00 37.83 36.66 1cgs s LYS 211 CO 0.06 -0.32 1.00 0.15 -0.92 0.00 0.00 175.35 175.31 1cgs s LYS 212 N 2.23 3.92 0.00 1.68 1.02 -1.26 -1.86 119.74 125.46 1cgs s LYS 212 Ca 0.04 1.17 0.00 0.00 0.02 0.00 0.00 55.97 57.21 1cgs s LYS 212 Cb -0.12 -2.13 0.00 0.00 -0.52 0.00 0.00 37.83 35.06 1cgs s LYS 212 CO -0.04 -0.31 0.00 1.28 -0.92 0.00 0.00 175.35 175.36 1cgs n LEU 213 N -1.11 0.05 0.00 3.17 4.32 -1.16 -4.98 117.00 117.29 1cgs n LEU 213 Ca 0.08 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.07 1cgs n LEU 213 Cb 0.53 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.33 1cgs n LEU 213 CO 0.41 0.00 0.17 1.21 -1.22 0.00 0.00 177.39 177.95