#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vvq s MET 4 N 0.00 2.83 -0.01 1.61 1.00 -1.26 -4.93 119.30 118.53 2vvq s MET 4 Ca 0.00 -0.54 -0.26 0.00 0.00 0.00 0.00 55.69 54.88 2vvq s MET 4 Cb 0.00 -2.69 -0.04 0.00 0.00 0.00 0.00 34.83 32.11 2vvq s MET 4 CO 0.00 0.65 0.82 0.50 0.00 0.00 0.00 175.02 177.00 2vvq s ARG 5 N -1.23 4.51 -0.12 2.03 3.52 -1.26 -0.08 118.95 126.32 2vvq s ARG 5 Ca 0.16 1.14 -0.01 0.00 -0.13 0.00 0.00 55.73 56.89 2vvq s ARG 5 Cb -0.11 -3.43 0.03 0.00 -1.56 0.00 0.00 34.95 29.87 2vvq s ARG 5 CO 0.06 0.07 -0.05 0.08 -0.81 0.00 0.00 175.30 174.65 2vvq s VAL 6 N 0.67 0.88 -0.15 7.11 1.01 -0.17 -1.28 120.40 128.47 2vvq s VAL 6 Ca 0.43 -0.27 -0.23 0.00 0.00 0.00 0.00 61.98 61.91 2vvq s VAL 6 Cb -0.20 -0.97 -0.02 0.00 0.00 0.00 0.00 36.38 35.18 2vvq s VAL 6 CO 0.23 0.28 0.72 -0.31 0.00 0.00 0.00 175.10 176.02 2vvq s TYR 7 N 1.76 3.45 -0.05 5.22 1.51 -0.11 0.16 117.35 129.29 2vvq s TYR 7 Ca 0.04 1.14 0.04 0.00 -1.01 0.00 0.00 57.07 57.28 2vvq s TYR 7 Cb -0.13 -2.88 -0.02 0.00 -0.11 0.00 0.00 41.96 38.82 2vvq s TYR 7 CO -0.07 -0.12 -0.15 -0.51 -1.11 0.00 0.00 175.55 173.58 2vvq s LEU 8 N 1.67 2.68 0.01 -1.29 1.02 0.24 -0.90 118.68 122.12 2vvq s LEU 8 Ca 0.35 -0.22 0.02 0.00 0.02 0.00 0.00 54.13 54.29 2vvq s LEU 8 Cb -0.17 -1.54 -0.01 0.00 0.02 0.00 0.00 46.19 44.49 2vvq s LEU 8 CO 0.13 0.33 -0.06 -0.83 0.02 0.00 0.00 176.35 175.95 2vvq s GLY 9 N -0.67 0.32 -0.04 -3.19 0.00 -0.60 -0.16 107.32 102.98 2vvq s GLY 9 Ca 0.10 -0.39 -0.22 0.00 0.00 0.00 0.00 44.72 44.21 2vvq s GLY 9 CO 0.01 -0.39 0.48 0.00 0.00 0.00 0.00 173.10 173.20 2vvq s ALA 10 N -0.55 -1.23 0.92 3.20 0.00 0.17 -1.23 121.76 123.03 2vvq s ALA 10 Ca -0.02 0.83 -0.07 0.00 0.00 0.00 0.00 51.96 52.70 2vvq s ALA 10 Cb -0.05 -0.04 0.11 0.00 0.00 0.00 0.00 23.12 23.14 2vvq s ALA 10 CO -0.00 -0.30 0.64 -0.40 0.00 0.00 0.00 175.76 175.69 2vvq n ASP 11 N 1.26 0.17 -0.05 0.00 5.68 -1.06 -0.41 116.55 122.14 2vvq n ASP 11 Ca -0.20 -1.31 0.10 0.00 -0.50 0.00 0.00 54.79 52.89 2vvq n ASP 11 Cb 0.56 -0.48 0.49 0.00 -1.14 0.00 0.00 41.12 40.56 2vvq n ASP 11 CO 0.00 0.00 0.00 1.12 -1.33 0.00 0.00 177.20 176.99 2vvq h HIS 12 N -1.22 0.42 0.00 2.11 2.07 -1.84 -0.82 115.15 115.88 2vvq h HIS 12 Ca -0.21 0.01 -0.02 0.00 -2.85 0.00 0.00 60.37 57.31 2vvq h HIS 12 Cb 0.60 -0.14 -0.00 0.00 2.57 0.00 0.00 27.41 30.44 2vvq h HIS 12 CO 0.00 0.22 -0.08 0.00 -3.07 0.00 0.00 177.93 175.00 2vvq h ALA 13 N 1.72 0.98 -0.11 6.11 0.00 -1.90 -2.92 119.26 123.15 2vvq h ALA 13 Ca 0.24 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2vvq h ALA 13 Cb 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2vvq h ALA 13 CO -0.06 0.10 0.00 0.41 0.00 0.00 0.00 179.25 179.70 2vvq n GLY 14 N 0.45 0.58 0.17 0.00 0.00 -0.84 -4.27 105.19 101.30 2vvq n GLY 14 Ca 0.02 -0.34 -0.09 0.00 0.00 0.00 0.00 46.02 45.60 2vvq n GLY 14 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2vvq h TYR 15 N 2.18 0.51 -0.34 1.61 3.20 -0.96 -0.46 116.97 122.71 2vvq h TYR 15 Ca 0.00 -0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.76 2vvq h TYR 15 Cb 0.55 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 2vvq h TYR 15 CO 0.07 0.42 -0.16 1.49 -1.64 0.00 0.00 178.16 178.34 2vvq h GLU 16 N 0.46 0.70 -0.52 1.82 4.81 -1.86 -2.17 114.58 117.82 2vvq h GLU 16 Ca 0.13 -0.31 -0.05 0.00 -0.13 0.00 0.00 59.36 59.00 2vvq h GLU 16 Cb 0.09 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 2vvq h GLU 16 CO -0.02 0.90 0.12 1.25 -0.73 0.00 0.00 179.01 180.53 2vvq h LEU 17 N 0.47 0.80 -0.64 1.64 5.85 -1.88 -2.76 115.31 118.79 2vvq h LEU 17 Ca 0.07 -0.24 0.13 0.00 0.84 0.00 0.00 57.88 58.68 2vvq h LEU 17 Cb 0.69 -0.21 -0.10 0.00 0.37 0.00 0.00 40.66 41.42 2vvq h LEU 17 CO 0.05 0.83 0.12 0.50 -0.34 0.00 0.00 178.44 179.59 2vvq h LYS 18 N 0.73 0.23 -0.45 1.25 3.64 -0.80 0.89 116.57 122.06 2vvq h LYS 18 Ca 0.16 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.45 2vvq h LYS 18 Cb 0.35 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 2vvq h LYS 18 CO 0.00 0.15 -0.03 1.96 -2.27 0.00 0.00 179.45 179.26 2vvq h GLN 19 N 0.24 0.75 -0.49 1.90 1.08 -1.24 0.12 115.11 117.47 2vvq h GLN 19 Ca 0.34 -0.21 -0.12 0.00 -1.45 0.00 0.00 58.65 57.22 2vvq h GLN 19 Cb 0.54 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.87 2vvq h GLN 19 CO -0.45 0.78 -0.16 0.00 -0.95 0.00 0.00 178.83 178.05 2vvq h ARG 20 N 0.69 0.94 -0.45 1.46 3.08 -1.11 -2.40 114.38 116.60 2vvq h ARG 20 Ca 0.13 -0.36 -0.11 0.00 0.07 0.00 0.00 59.98 59.71 2vvq h ARG 20 Cb 0.47 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2vvq h ARG 20 CO 0.02 1.02 -0.16 0.82 -1.07 0.00 0.00 179.97 180.61 2vvq h ILE 21 N 0.83 1.27 -0.56 2.04 2.04 -0.29 -1.55 117.51 121.29 2vvq h ILE 21 Ca 0.12 -1.30 0.07 0.00 1.00 0.00 0.00 64.86 64.75 2vvq h ILE 21 Cb 0.70 1.16 -0.06 0.00 -0.74 0.00 0.00 36.82 37.89 2vvq h ILE 21 CO 0.05 0.44 0.25 0.40 0.00 0.00 0.00 178.15 179.30 2vvq h ILE 22 N 0.74 0.88 -0.20 -0.67 2.04 -0.66 0.16 117.51 119.81 2vvq h ILE 22 Ca 0.11 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 2vvq h ILE 22 Cb 0.72 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 2vvq h ILE 22 CO 0.05 0.09 0.01 -0.08 0.00 0.00 0.00 178.15 178.22 2vvq h GLU 23 N 0.47 0.35 -0.66 2.37 4.57 -1.32 -1.63 114.58 118.73 2vvq h GLU 23 Ca 0.26 -0.11 0.05 0.00 -1.18 0.00 0.00 59.36 58.39 2vvq h GLU 23 Cb 0.24 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.75 2vvq h GLU 23 CO -0.22 0.54 0.37 1.25 -1.18 0.00 0.00 179.01 179.77 2vvq h HIS 24 N 0.11 0.69 -0.58 0.92 2.76 -0.84 -1.10 115.15 117.11 2vvq h HIS 24 Ca 0.06 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.24 2vvq h HIS 24 Cb 0.38 -0.21 -0.03 0.00 1.55 0.00 0.00 27.41 29.10 2vvq h HIS 24 CO 0.03 0.34 0.32 -0.07 -1.30 0.00 0.00 177.93 177.26 2vvq h LEU 25 N 0.70 0.73 -0.29 0.26 3.38 -0.51 -1.09 115.31 118.49 2vvq h LEU 25 Ca 0.29 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.20 2vvq h LEU 25 Cb 0.15 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 2vvq h LEU 25 CO -0.16 0.61 0.08 0.11 0.09 0.00 0.00 178.44 179.17 2vvq h LYS 26 N 0.79 0.19 -0.36 1.13 1.57 -0.93 -0.01 116.57 118.95 2vvq h LYS 26 Ca 0.21 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 59.01 2vvq h LYS 26 Cb 0.05 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 2vvq h LYS 26 CO -0.03 0.12 0.24 1.96 -0.57 0.00 0.00 179.45 181.17 2vvq h GLN 27 N 0.19 0.31 -0.58 3.15 1.08 -0.73 -2.74 115.11 115.80 2vvq h GLN 27 Ca 0.13 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.31 2vvq h GLN 27 Cb 0.12 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.48 2vvq h GLN 27 CO -0.15 0.21 0.00 0.25 -0.95 0.00 0.00 178.83 178.18 2vvq n THR 28 N -4.48 2.16 -0.38 -0.54 -2.24 -0.46 -4.94 114.28 103.40 2vvq n THR 28 Ca 0.04 -1.33 0.00 0.00 -2.27 0.00 0.00 64.05 60.49 2vvq n THR 28 Cb 0.19 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 2vvq n THR 28 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vvq n GLY 29 N 0.78 0.79 3.91 3.38 0.00 -1.03 -4.95 105.19 108.07 2vvq n GLY 29 Ca 0.26 -0.22 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 2vvq n GLY 29 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2vvq s HIS 30 N -2.00 1.95 -0.52 1.61 3.76 -0.05 -4.49 115.29 115.56 2vvq s HIS 30 Ca 0.00 -0.71 0.04 0.00 -0.15 0.00 0.00 55.06 54.24 2vvq s HIS 30 Cb 0.00 -2.04 0.13 0.00 1.11 0.00 0.00 32.58 31.78 2vvq s HIS 30 CO 0.00 -0.46 0.27 -2.00 -0.85 0.00 0.00 174.74 171.70 2vvq s GLU 31 N -4.29 1.89 0.22 1.40 2.12 0.89 -4.20 118.70 116.73 2vvq s GLU 31 Ca 0.43 -2.56 -0.30 0.00 0.36 0.00 0.00 54.97 52.90 2vvq s GLU 31 Cb -0.03 -3.16 -0.08 0.00 0.26 0.00 0.00 34.13 31.12 2vvq s GLU 31 CO 0.26 -1.13 1.01 -1.25 -0.54 0.00 0.00 175.26 173.61 2vvq s PRO 32 N -0.25 4.74 -0.19 4.30 0.04 -1.26 -0.99 135.00 141.39 2vvq s PRO 32 Ca 0.18 1.60 0.01 0.00 0.04 0.00 0.00 61.00 62.82 2vvq s PRO 32 Cb -0.25 -3.27 0.03 0.00 0.04 0.00 0.00 34.50 31.06 2vvq s PRO 32 CO -0.01 0.33 -0.14 0.42 0.04 0.00 0.00 177.00 177.64 2vvq s ILE 33 N -0.86 1.81 -0.34 0.56 1.01 0.12 -4.91 121.20 118.58 2vvq s ILE 33 Ca 0.44 -0.98 -0.25 0.00 0.00 0.00 0.00 60.65 59.86 2vvq s ILE 33 Cb -0.28 -1.77 0.01 0.00 0.01 0.00 0.00 42.46 40.44 2vvq s ILE 33 CO 0.34 0.32 0.90 -0.62 0.00 0.00 0.00 174.94 175.88 2vvq s ASP 34 N 1.35 6.71 0.00 3.58 3.68 -1.26 -0.59 116.67 130.14 2vvq s ASP 34 Ca 0.01 0.67 0.28 0.00 2.13 0.00 0.00 52.55 55.64 2vvq s ASP 34 Cb -0.15 -2.46 1.14 0.00 -1.45 0.00 0.00 42.92 40.01 2vvq s ASP 34 CO -0.10 -0.78 1.80 0.00 0.13 0.00 0.00 175.17 176.22 2vvq n GLY 36 N 1.15 1.37 3.77 0.00 0.00 -1.25 -4.85 105.19 105.37 2vvq n GLY 36 Ca 0.19 -1.91 -0.39 0.00 0.00 0.00 0.00 46.02 43.91 2vvq n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vvq s ALA 37 N -2.46 3.24 -0.54 4.61 0.00 0.45 -0.66 121.76 126.39 2vvq s ALA 37 Ca 0.00 1.15 0.24 0.00 0.00 0.00 0.00 51.96 53.35 2vvq s ALA 37 Cb 0.00 -3.45 0.22 0.00 0.00 0.00 0.00 23.12 19.89 2vvq s ALA 37 CO 0.00 -0.73 1.22 -0.07 0.00 0.00 0.00 175.76 176.18 2vvq h LEU 38 N 2.71 0.00 -8.22 0.00 3.38 -1.90 -3.47 115.31 107.81 2vvq h LEU 38 Ca -0.49 -0.19 -0.13 0.00 0.09 0.00 0.00 57.88 57.15 2vvq h LEU 38 Cb 1.24 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.86 2vvq h LEU 38 CO 0.63 0.09 -0.43 0.00 0.09 0.00 0.00 178.44 178.82 2vvq s ARG 39 N -3.22 1.09 -0.03 1.13 1.70 -1.26 -5.12 118.95 113.25 2vvq s ARG 39 Ca 0.04 -1.28 -0.30 0.00 -0.47 0.00 0.00 55.73 53.72 2vvq s ARG 39 Cb 0.13 0.33 -0.06 0.00 -0.57 0.00 0.00 34.95 34.78 2vvq s ARG 39 CO 0.75 -0.37 1.58 -0.47 -1.08 0.00 0.00 175.30 175.70 2vvq s TYR 40 N -4.00 2.30 -0.24 5.89 5.04 -1.26 -4.92 117.35 120.16 2vvq s TYR 40 Ca 0.20 0.40 -0.02 0.00 -2.44 0.00 0.00 57.07 55.21 2vvq s TYR 40 Cb 0.05 -3.85 0.08 0.00 0.35 0.00 0.00 41.96 38.59 2vvq s TYR 40 CO 0.01 -3.42 0.06 0.34 -1.34 0.00 0.00 175.55 171.20 2vvq s ASP 41 N 2.76 3.31 0.55 4.32 2.15 -1.26 -5.04 116.67 123.47 2vvq s ASP 41 Ca 0.70 -1.11 0.34 0.00 0.43 0.00 0.00 52.55 52.91 2vvq s ASP 41 Cb -0.33 -0.65 1.51 0.00 -0.30 0.00 0.00 42.92 43.15 2vvq s ASP 41 CO 0.28 -0.35 1.81 0.00 -0.17 0.00 0.00 175.17 176.74 2vvq h ALA 42 N 8.22 2.96 -0.02 3.66 0.00 -1.95 -0.59 119.26 131.53 2vvq h ALA 42 Ca -0.16 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2vvq h ALA 42 Cb 1.08 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2vvq h ALA 42 CO 0.39 -1.32 -0.15 -0.25 0.00 0.00 0.00 179.25 177.91 2vvq n ASP 43 N -4.10 2.44 -4.71 0.00 8.00 -1.26 -4.93 116.55 112.00 2vvq n ASP 43 Ca 0.22 -1.72 -0.30 0.00 0.71 0.00 0.00 54.79 53.70 2vvq n ASP 43 Cb 1.14 0.17 0.14 0.00 -0.02 0.00 0.00 41.12 42.55 2vvq n ASP 43 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 2vvq s ASP 44 N -1.94 3.54 -0.18 -2.24 1.47 -0.23 -5.01 116.67 112.09 2vvq s ASP 44 Ca 0.22 1.81 -0.00 0.00 1.18 0.00 0.00 52.55 55.76 2vvq s ASP 44 Cb 0.17 -2.43 0.01 0.00 -0.34 0.00 0.00 42.92 40.33 2vvq s ASP 44 CO 0.35 -2.64 -0.15 -1.81 0.68 0.00 0.00 175.17 171.59 2vvq s ASP 45 N -3.14 3.53 0.32 2.11 1.01 -1.26 -4.69 116.67 114.55 2vvq s ASP 45 Ca 0.64 -0.54 0.01 0.00 0.71 0.00 0.00 52.55 53.37 2vvq s ASP 45 Cb -0.19 -1.56 0.56 0.00 1.01 0.00 0.00 42.92 42.74 2vvq s ASP 45 CO 0.57 0.02 1.94 0.10 0.21 0.00 0.00 175.17 178.02 2vvq h TYR 46 N 7.77 0.97 -0.51 4.23 -0.00 -1.95 -3.35 116.97 124.14 2vvq h TYR 46 Ca -0.41 0.02 0.10 0.00 0.00 0.00 0.00 58.73 58.45 2vvq h TYR 46 Cb 1.16 -0.32 -0.09 0.00 0.00 0.00 0.00 36.73 37.48 2vvq h TYR 46 CO 0.51 0.55 -0.06 -1.35 -0.00 0.00 0.00 178.16 177.80 2vvq h PRO 47 N 0.99 0.05 -0.77 0.10 0.11 -1.96 -2.52 132.00 128.00 2vvq h PRO 47 Ca 0.34 -0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.53 2vvq h PRO 47 Cb 0.10 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 31.13 2vvq h PRO 47 CO -0.11 0.03 0.43 0.00 -0.21 0.00 0.00 178.00 178.15 2vvq h ALA 48 N 1.48 1.07 -0.49 -0.75 0.00 -2.00 0.68 119.26 119.26 2vvq h ALA 48 Ca 0.25 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.09 2vvq h ALA 48 Cb 0.39 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2vvq h ALA 48 CO -0.48 0.08 -0.11 0.74 0.00 0.00 0.00 179.25 179.48 2vvq h PHE 49 N 0.75 1.00 -0.02 0.00 -1.00 -1.69 -1.14 116.94 114.83 2vvq h PHE 49 Ca 0.36 -0.19 -0.19 0.00 2.81 0.00 0.00 57.97 60.76 2vvq h PHE 49 Cb 0.30 -0.25 0.01 0.00 3.61 0.00 0.00 35.95 39.62 2vvq h PHE 49 CO -0.07 0.95 -0.72 0.00 -1.61 0.00 0.00 178.31 176.86 2vvq h ILE 51 N 0.10 1.22 -0.03 0.00 2.04 -0.89 0.04 117.51 120.00 2vvq h ILE 51 Ca -0.08 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.28 2vvq h ILE 51 Cb 1.40 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.61 2vvq h ILE 51 CO 0.14 0.23 0.02 0.00 0.00 0.00 0.00 178.15 178.54 2vvq h ALA 52 N 1.25 0.04 -0.52 1.87 0.00 -1.15 0.23 119.26 120.98 2vvq h ALA 52 Ca 0.28 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 2vvq h ALA 52 Cb -0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2vvq h ALA 52 CO -0.05 -0.45 0.11 0.00 0.00 0.00 0.00 179.25 178.85 2vvq h ALA 53 N 0.99 0.68 -0.25 0.00 0.00 -1.14 -1.49 119.26 118.05 2vvq h ALA 53 Ca 0.01 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 2vvq h ALA 53 Cb 0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2vvq h ALA 53 CO -0.00 0.40 -0.10 0.00 0.00 0.00 0.00 179.25 179.55 2vvq h ALA 54 N 0.99 0.35 -0.44 0.00 0.00 -0.82 -0.94 119.26 118.40 2vvq h ALA 54 Ca 0.16 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.80 2vvq h ALA 54 Cb 0.36 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2vvq h ALA 54 CO 0.01 0.19 0.25 1.15 0.00 0.00 0.00 179.25 180.84 2vvq h THR 55 N 0.25 1.01 -0.22 0.00 2.02 -0.45 -1.30 112.91 114.21 2vvq h THR 55 Ca 0.06 -0.17 -0.09 0.00 0.77 0.00 0.00 66.41 66.98 2vvq h THR 55 Cb 0.59 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 2vvq h THR 55 CO 0.03 0.09 -0.26 0.03 0.37 0.00 0.00 175.52 175.78 2vvq h ARG 56 N 0.49 0.43 0.04 6.66 3.08 -1.19 -2.07 114.38 121.82 2vvq h ARG 56 Ca 0.18 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 2vvq h ARG 56 Cb 0.05 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2vvq h ARG 56 CO -0.10 0.66 -0.02 1.15 -1.07 0.00 0.00 179.97 180.58 2vvq h THR 57 N 0.38 1.21 -0.54 2.04 2.02 -0.73 -2.02 112.91 115.27 2vvq h THR 57 Ca 0.06 -0.82 0.00 0.00 0.77 0.00 0.00 66.41 66.42 2vvq h THR 57 Cb 0.66 1.75 -0.03 0.00 -1.74 0.00 0.00 68.15 68.79 2vvq h THR 57 CO 0.05 0.21 0.34 0.58 0.37 0.00 0.00 175.52 177.06 2vvq h VAL 58 N -0.41 1.15 0.00 3.16 2.07 -1.15 -2.34 116.25 118.73 2vvq h VAL 58 Ca -0.01 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.21 2vvq h VAL 58 Cb 0.38 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2vvq h VAL 58 CO 0.01 0.15 0.00 0.00 0.02 0.00 0.00 177.57 177.75 2vvq n ALA 59 N -2.45 2.20 -3.84 1.67 0.00 -0.79 -4.26 120.51 113.04 2vvq n ALA 59 Ca 0.05 -0.06 -0.28 0.00 0.00 0.00 0.00 53.44 53.15 2vvq n ALA 59 Cb 0.06 -1.44 -0.12 0.00 0.00 0.00 0.00 19.45 17.95 2vvq n ALA 59 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2vvq s ASP 60 N -3.54 4.35 0.47 0.00 2.15 -0.78 -5.08 116.67 114.25 2vvq s ASP 60 Ca 0.12 -3.61 -0.24 0.00 0.43 0.00 0.00 52.55 49.25 2vvq s ASP 60 Cb 0.15 -1.48 -0.07 0.00 -0.30 0.00 0.00 42.92 41.22 2vvq s ASP 60 CO 0.51 -0.12 1.30 -2.84 -0.17 0.00 0.00 175.17 173.85 2vvq s PRO 61 N -1.07 3.60 0.00 4.34 0.02 -1.26 -1.65 135.00 138.98 2vvq s PRO 61 Ca 0.24 2.11 0.00 0.00 0.02 0.00 0.00 61.00 63.37 2vvq s PRO 61 Cb -0.07 -2.48 0.00 0.00 0.02 0.00 0.00 34.50 31.97 2vvq s PRO 61 CO -0.14 -0.78 0.00 0.41 -0.33 0.00 0.00 177.00 176.16 2vvq n GLY 62 N 0.62 2.99 3.84 0.52 0.00 -1.26 -5.05 105.19 106.85 2vvq n GLY 62 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 2vvq n GLY 62 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vvq s SER 63 N -1.23 4.84 0.32 1.61 1.04 -0.66 -4.72 113.70 114.90 2vvq s SER 63 Ca 0.00 1.19 0.04 0.00 0.48 0.00 0.00 55.95 57.66 2vvq s SER 63 Cb 0.00 -1.92 -0.06 0.00 0.10 0.00 0.00 66.02 64.13 2vvq s SER 63 CO 0.00 -1.73 0.05 -0.76 0.98 0.00 0.00 173.24 171.78 2vvq s LEU 64 N -5.60 2.23 0.04 2.42 1.43 -0.41 -4.91 118.68 113.87 2vvq s LEU 64 Ca 0.60 -1.37 -0.00 0.00 -1.03 0.00 0.00 54.13 52.33 2vvq s LEU 64 Cb -0.13 -0.42 -0.03 0.00 0.03 0.00 0.00 46.19 45.65 2vvq s LEU 64 CO 0.53 -0.59 -0.04 -0.83 0.23 0.00 0.00 176.35 175.65 2vvq s GLY 65 N -3.49 0.39 -0.04 -3.19 0.00 0.15 -0.93 107.32 100.20 2vvq s GLY 65 Ca 0.36 -0.89 -0.00 0.00 0.00 0.00 0.00 44.72 44.19 2vvq s GLY 65 CO 0.15 -0.97 -0.00 -0.42 0.00 0.00 0.00 173.10 171.86 2vvq s ILE 66 N -2.51 0.25 -0.02 0.90 1.01 -0.08 -1.91 121.20 118.84 2vvq s ILE 66 Ca -0.05 0.09 0.08 0.00 0.00 0.00 0.00 60.65 60.77 2vvq s ILE 66 Cb -0.02 -0.36 -0.02 0.00 0.01 0.00 0.00 42.46 42.07 2vvq s ILE 66 CO -0.04 0.18 -0.25 0.68 0.00 0.00 0.00 174.94 175.51 2vvq s VAL 67 N 1.31 1.98 -0.01 2.92 -7.23 -0.20 -1.55 120.40 117.62 2vvq s VAL 67 Ca -0.06 -1.07 0.03 0.00 -1.81 0.00 0.00 61.98 59.07 2vvq s VAL 67 Cb -0.13 -1.64 -0.01 0.00 0.56 0.00 0.00 36.38 35.16 2vvq s VAL 67 CO -0.02 0.56 -0.10 -0.76 -0.31 0.00 0.00 175.10 174.47 2vvq s LEU 68 N -0.59 2.00 0.00 1.32 2.01 -0.37 -1.07 118.68 121.98 2vvq s LEU 68 Ca 0.10 -0.18 0.00 0.00 0.01 0.00 0.00 54.13 54.06 2vvq s LEU 68 Cb -0.10 -0.51 0.00 0.00 0.01 0.00 0.00 46.19 45.59 2vvq s LEU 68 CO -0.01 0.12 0.00 0.61 1.01 0.00 0.00 176.35 178.08 2vvq n GLY 69 N 2.88 4.29 0.35 -3.19 0.00 -1.16 -2.55 105.19 105.80 2vvq n GLY 69 Ca -0.14 -1.01 -0.13 0.00 0.00 0.00 0.00 46.02 44.73 2vvq n GLY 69 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2vvq h GLY 70 N 0.00 -0.92 0.71 -0.02 0.00 -1.87 0.20 103.07 101.18 2vvq h GLY 70 Ca 0.00 0.34 -0.10 0.00 0.00 0.00 0.00 47.33 47.57 2vvq h GLY 70 CO 0.00 -0.33 -1.47 -1.14 0.00 0.00 0.00 176.54 173.59 2vvq n SER 71 N -4.50 0.62 0.00 0.19 3.41 -1.26 -1.26 113.62 110.82 2vvq n SER 71 Ca -0.11 0.26 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 2vvq n SER 71 Cb 0.35 0.69 0.00 0.00 -0.26 0.00 0.00 64.21 64.98 2vvq n SER 71 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vvq n GLY 72 N 1.33 1.34 0.18 5.00 0.00 -1.25 -2.60 105.19 109.19 2vvq n GLY 72 Ca -0.07 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 2vvq n GLY 72 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2vvq h ASN 73 N 0.00 0.69 -0.68 1.61 2.35 -1.94 -1.87 115.58 115.75 2vvq h ASN 73 Ca 0.00 -0.65 0.09 0.00 -0.55 0.00 0.00 56.30 55.19 2vvq h ASN 73 Cb 0.00 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.12 2vvq h ASN 73 CO 0.00 1.23 0.45 1.23 -1.65 0.00 0.00 177.43 178.69 2vvq h GLY 74 N 0.20 0.78 0.83 2.83 0.00 -1.99 -1.71 103.07 104.01 2vvq h GLY 74 Ca -0.05 -0.23 -0.17 0.00 0.00 0.00 0.00 47.33 46.88 2vvq h GLY 74 CO 0.12 0.14 -0.69 0.83 0.00 0.00 0.00 176.54 176.94 2vvq h GLU 75 N 0.56 0.44 -0.51 4.80 3.07 -1.89 -1.38 114.58 119.66 2vvq h GLU 75 Ca 0.31 -0.49 -0.08 0.00 -0.50 0.00 0.00 59.36 58.60 2vvq h GLU 75 Cb 0.47 0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 28.51 2vvq h GLU 75 CO -0.10 1.15 0.01 -0.56 -1.40 0.00 0.00 179.01 178.11 2vvq h GLN 76 N -0.06 0.86 -0.22 2.33 -0.00 -1.25 -1.21 115.11 115.56 2vvq h GLN 76 Ca -0.09 -0.24 0.02 0.00 -0.00 0.00 0.00 58.65 58.34 2vvq h GLN 76 Cb 1.40 -0.10 -0.02 0.00 -0.00 0.00 0.00 27.48 28.77 2vvq h GLN 76 CO 0.13 0.85 0.09 0.82 -0.00 0.00 0.00 178.83 180.73 2vvq h ILE 77 N 0.80 0.97 -0.57 1.86 2.04 -1.23 0.07 117.51 121.45 2vvq h ILE 77 Ca 0.15 -0.07 -0.07 0.00 1.00 0.00 0.00 64.86 65.88 2vvq h ILE 77 Cb 0.47 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 2vvq h ILE 77 CO 0.02 0.04 0.10 0.00 0.00 0.00 0.00 178.15 178.31 2vvq h ALA 78 N 1.12 0.76 -0.55 1.87 0.00 -1.17 -2.94 119.26 118.36 2vvq h ALA 78 Ca 0.09 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2vvq h ALA 78 Cb 0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2vvq h ALA 78 CO -0.08 0.50 0.05 0.00 0.00 0.00 0.00 179.25 179.72 2vvq h ALA 79 N 1.01 1.06 0.00 0.00 0.00 -0.94 -2.69 119.26 117.70 2vvq h ALA 79 Ca 0.17 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2vvq h ALA 79 Cb 0.40 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2vvq h ALA 79 CO 0.01 0.60 0.00 0.09 0.00 0.00 0.00 179.25 179.95 2vvq n ASN 80 N -4.22 0.65 0.17 0.00 3.02 -0.01 -1.69 115.26 113.18 2vvq n ASN 80 Ca 0.03 0.70 0.13 0.00 -0.03 0.00 0.00 54.58 55.41 2vvq n ASN 80 Cb 0.29 -0.82 0.36 0.00 -0.61 0.00 0.00 39.78 38.99 2vvq n ASN 80 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 2vvq h LYS 81 N 0.00 0.00 -6.35 3.52 1.79 -1.31 -3.45 116.57 110.77 2vvq h LYS 81 Ca 0.00 0.00 -0.55 0.00 -2.18 0.00 0.00 60.65 57.92 2vvq h LYS 81 Cb 0.25 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.90 2vvq h LYS 81 CO 0.00 0.00 0.80 0.08 -1.08 0.00 0.00 179.45 179.25 2vvq s VAL 82 N -3.23 3.87 0.11 0.50 1.01 -0.68 -4.96 120.40 117.02 2vvq s VAL 82 Ca 0.07 1.23 -0.34 0.00 0.00 0.00 0.00 61.98 62.95 2vvq s VAL 82 Cb 0.09 -3.79 -0.13 0.00 0.00 0.00 0.00 36.38 32.54 2vvq s VAL 82 CO 0.60 -0.01 1.64 -2.65 0.00 0.00 0.00 175.10 174.68 2vvq n PRO 83 N 5.37 2.17 0.00 2.72 -0.02 -1.26 -1.80 135.00 142.18 2vvq n PRO 83 Ca 0.13 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 2vvq n PRO 83 Cb 0.44 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 2vvq n PRO 83 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vvq n GLY 84 N 3.61 1.84 3.77 -1.23 0.00 -1.26 -4.96 105.19 106.96 2vvq n GLY 84 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 2vvq n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vvq s ALA 85 N -2.43 3.43 -0.22 4.61 0.00 -0.74 -4.98 121.76 121.43 2vvq s ALA 85 Ca 0.00 0.40 -0.00 0.00 0.00 0.00 0.00 51.96 52.35 2vvq s ALA 85 Cb 0.00 -3.00 0.06 0.00 0.00 0.00 0.00 23.12 20.18 2vvq s ALA 85 CO 0.00 0.27 -0.04 1.03 0.00 0.00 0.00 175.76 177.02 2vvq s ARG 86 N -1.08 1.41 -0.28 0.00 0.52 -1.26 -4.77 118.95 113.50 2vvq s ARG 86 Ca 0.37 -0.81 0.01 0.00 -0.52 0.00 0.00 55.73 54.78 2vvq s ARG 86 Cb -0.23 -2.41 0.06 0.00 0.52 0.00 0.00 34.95 32.88 2vvq s ARG 86 CO 0.27 -0.58 -0.07 0.00 0.02 0.00 0.00 175.30 174.94 2vvq s ALA 88 N 1.16 3.20 -0.26 0.00 0.00 -0.84 -4.85 121.76 120.17 2vvq s ALA 88 Ca -0.08 -0.19 -0.15 0.00 0.00 0.00 0.00 51.96 51.54 2vvq s ALA 88 Cb -0.20 -2.91 -0.04 0.00 0.00 0.00 0.00 23.12 19.97 2vvq s ALA 88 CO -0.03 -0.49 0.40 -1.17 0.00 0.00 0.00 175.76 174.47 2vvq s LEU 89 N -4.82 4.05 -0.35 0.00 2.96 -1.26 -0.17 118.68 119.08 2vvq s LEU 89 Ca 0.53 0.34 -0.11 0.00 -0.22 0.00 0.00 54.13 54.67 2vvq s LEU 89 Cb -0.11 -2.47 0.00 0.00 0.50 0.00 0.00 46.19 44.11 2vvq s LEU 89 CO 0.47 -0.20 0.21 0.00 -1.32 0.00 0.00 176.35 175.51 2vvq s ALA 90 N 2.08 3.36 0.00 5.97 0.00 -0.22 -4.83 121.76 128.11 2vvq s ALA 90 Ca 0.16 -1.51 0.00 0.00 0.00 0.00 0.00 51.96 50.61 2vvq s ALA 90 Cb -0.16 -2.56 0.00 0.00 0.00 0.00 0.00 23.12 20.40 2vvq s ALA 90 CO 0.10 -1.11 0.90 -2.67 0.00 0.00 0.00 175.76 172.98 2vvq n TRP 91 N 5.04 0.00 -3.67 0.00 4.27 -1.26 -4.55 117.44 117.26 2vvq n TRP 91 Ca -0.13 -0.40 -0.07 0.00 -3.89 0.00 0.00 57.50 53.02 2vvq n TRP 91 Cb 0.48 -0.04 -0.02 0.00 -1.36 0.00 0.00 31.31 30.37 2vvq n TRP 91 CO 0.00 0.00 0.00 -1.54 -2.29 0.00 0.00 177.69 173.86 2vvq s SER 92 N -0.80 -0.31 0.18 -0.67 1.04 -1.26 -5.02 113.70 106.86 2vvq s SER 92 Ca 0.00 -0.30 -0.13 0.00 0.48 0.00 0.00 55.95 55.99 2vvq s SER 92 Cb 0.00 0.55 0.07 0.00 0.10 0.00 0.00 66.02 66.75 2vvq s SER 92 CO 0.00 -0.98 1.82 0.58 0.98 0.00 0.00 173.24 175.64 2vvq h VAL 93 N 2.00 1.16 -0.37 5.02 2.07 -1.91 -2.14 116.25 122.08 2vvq h VAL 93 Ca -0.24 -0.35 0.03 0.00 0.82 0.00 0.00 66.70 66.96 2vvq h VAL 93 Cb 1.25 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 2vvq h VAL 93 CO 0.28 0.16 0.16 -0.61 0.02 0.00 0.00 177.57 177.59 2vvq h GLN 94 N 0.76 0.32 -0.17 1.57 4.15 -1.97 -0.33 115.11 119.44 2vvq h GLN 94 Ca 0.20 -0.02 -0.14 0.00 0.77 0.00 0.00 58.65 59.46 2vvq h GLN 94 Cb -0.03 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.57 2vvq h GLN 94 CO -0.04 0.21 -0.48 1.79 -1.93 0.00 0.00 178.83 178.38 2vvq h THR 95 N 0.33 1.32 -0.34 2.39 1.35 -1.92 0.23 112.91 116.29 2vvq h THR 95 Ca 0.16 -1.70 -0.01 0.00 -0.55 0.00 0.00 66.41 64.31 2vvq h THR 95 Cb 0.10 1.72 -0.02 0.00 -1.73 0.00 0.00 68.15 68.22 2vvq h THR 95 CO -0.14 0.52 0.17 0.00 -0.25 0.00 0.00 175.52 175.83 2vvq h ALA 96 N 1.12 0.43 -0.01 6.62 0.00 -1.23 -1.06 119.26 125.13 2vvq h ALA 96 Ca 0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2vvq h ALA 96 Cb 0.98 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 2vvq h ALA 96 CO 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.32 2vvq h ALA 97 N 1.03 0.01 -0.27 0.00 0.00 -0.80 -3.04 119.26 116.18 2vvq h ALA 97 Ca 0.12 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2vvq h ALA 97 Cb 0.09 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2vvq h ALA 97 CO -0.02 -0.44 -0.05 -0.07 0.00 0.00 0.00 179.25 178.68 2vvq h LEU 98 N -0.10 0.40 -0.64 0.00 3.38 -0.96 -0.31 115.31 117.08 2vvq h LEU 98 Ca 0.00 -0.08 0.04 0.00 0.09 0.00 0.00 57.88 57.93 2vvq h LEU 98 Cb 0.11 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.71 2vvq h LEU 98 CO -0.00 0.50 0.38 0.00 0.09 0.00 0.00 178.44 179.41 2vvq h ALA 99 N 1.55 0.84 0.23 1.53 0.00 -1.08 0.30 119.26 122.64 2vvq h ALA 99 Ca 0.09 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2vvq h ALA 99 Cb 0.35 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2vvq h ALA 99 CO 0.01 0.10 -0.11 0.00 0.00 0.00 0.00 179.25 179.25 2vvq h ARG 100 N 0.73 -0.30 -0.46 0.00 2.47 -1.41 0.01 114.38 115.41 2vvq h ARG 100 Ca 0.27 0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 59.01 2vvq h ARG 100 Cb 0.09 0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.45 2vvq h ARG 100 CO -0.13 0.07 0.27 1.49 0.56 0.00 0.00 179.97 182.23 2vvq h GLU 101 N -0.85 0.64 0.03 0.04 4.81 -0.93 -2.30 114.58 116.02 2vvq h GLU 101 Ca -0.03 -0.07 -0.38 0.00 -0.13 0.00 0.00 59.36 58.75 2vvq h GLU 101 Cb 0.51 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.71 2vvq h GLU 101 CO 0.05 0.49 -2.22 0.72 -0.73 0.00 0.00 179.01 177.32 2vvq n HIS 102 N -4.70 0.43 1.06 0.92 8.25 0.08 -2.62 115.22 118.65 2vvq n HIS 102 Ca 0.01 0.12 0.12 0.00 -0.26 0.00 0.00 57.72 57.72 2vvq n HIS 102 Cb 0.07 -1.05 0.12 0.00 1.12 0.00 0.00 29.99 30.24 2vvq n HIS 102 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2vvq n ASN 103 N -3.74 2.39 -4.42 0.41 5.03 -1.00 -4.77 115.26 109.17 2vvq n ASN 103 Ca -0.43 -1.71 -0.39 0.00 0.87 0.00 0.00 54.58 52.92 2vvq n ASN 103 Cb 0.93 0.18 -0.07 0.00 -1.02 0.00 0.00 39.78 39.80 2vvq n ASN 103 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 2vvq n ASN 104 N 0.63 -1.61 -4.66 6.41 5.15 -0.84 -4.84 115.26 115.50 2vvq n ASN 104 Ca 0.13 -1.19 -0.42 0.00 -0.60 0.00 0.00 54.58 52.49 2vvq n ASN 104 Cb 0.52 -1.91 -0.03 0.00 -0.53 0.00 0.00 39.78 37.83 2vvq n ASN 104 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2vvq s ALA 105 N -3.48 3.62 -0.50 5.20 0.00 -0.07 -4.88 121.76 121.66 2vvq s ALA 105 Ca 0.64 1.00 0.25 0.00 0.00 0.00 0.00 51.96 53.86 2vvq s ALA 105 Cb -0.37 -3.75 0.70 0.00 0.00 0.00 0.00 23.12 19.70 2vvq s ALA 105 CO 1.00 -1.37 1.73 1.96 0.00 0.00 0.00 175.76 179.07 2vvq h GLN 106 N 9.48 0.00 -5.02 0.00 7.50 -1.80 -3.42 115.11 121.85 2vvq h GLN 106 Ca -0.41 0.00 -0.35 0.00 0.50 0.00 0.00 58.65 58.40 2vvq h GLN 106 Cb 1.19 0.00 -0.20 0.00 0.05 0.00 0.00 27.48 28.51 2vvq h GLN 106 CO 0.95 0.00 -0.75 -0.51 -1.50 0.00 0.00 178.83 177.02 2vvq s LEU 107 N -5.40 2.31 0.08 1.46 1.02 -1.08 0.31 118.68 117.38 2vvq s LEU 107 Ca 0.07 -0.65 0.08 0.00 0.02 0.00 0.00 54.13 53.65 2vvq s LEU 107 Cb 0.09 -0.36 -0.03 0.00 0.02 0.00 0.00 46.19 45.91 2vvq s LEU 107 CO 0.60 -0.16 -0.20 0.27 0.02 0.00 0.00 176.35 176.88 2vvq s ILE 108 N -1.63 1.64 0.03 -0.59 -4.36 -0.80 -1.98 121.20 113.51 2vvq s ILE 108 Ca -0.02 -1.38 -0.13 0.00 -0.26 0.00 0.00 60.65 58.86 2vvq s ILE 108 Cb -0.08 -1.47 -0.06 0.00 1.25 0.00 0.00 42.46 42.10 2vvq s ILE 108 CO 0.01 0.03 0.40 -0.83 0.24 0.00 0.00 174.94 174.79 2vvq s GLY 109 N -1.60 2.42 -0.01 6.27 0.00 0.76 -1.03 107.32 114.13 2vvq s GLY 109 Ca 0.06 -0.28 0.04 0.00 0.00 0.00 0.00 44.72 44.54 2vvq s GLY 109 CO 0.03 0.03 -0.14 -0.42 0.00 0.00 0.00 173.10 172.60 2vvq s ILE 110 N -1.20 1.09 -0.32 0.90 1.01 -0.24 -1.06 121.20 121.39 2vvq s ILE 110 Ca 0.27 -0.58 -0.25 0.00 0.00 0.00 0.00 60.65 60.09 2vvq s ILE 110 Cb -0.16 -0.91 0.01 0.00 0.01 0.00 0.00 42.46 41.41 2vvq s ILE 110 CO 0.15 0.31 0.85 -0.83 0.00 0.00 0.00 174.94 175.41 2vvq s GLY 111 N -0.26 1.67 0.43 6.18 0.00 -1.07 -2.97 107.32 111.30 2vvq s GLY 111 Ca 0.04 -0.39 0.30 0.00 0.00 0.00 0.00 44.72 44.67 2vvq s GLY 111 CO -0.00 1.86 1.89 -1.33 0.00 0.00 0.00 173.10 175.52 2vvq h GLY 112 N 9.64 0.00 -2.22 0.20 0.00 -0.16 -2.61 103.07 107.92 2vvq h GLY 112 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2vvq h GLY 112 CO 0.92 0.00 0.00 0.54 0.00 0.00 0.00 176.54 178.00 2vvq n ARG 113 N -2.70 2.44 -0.00 4.80 1.74 -0.39 -4.58 116.66 117.96 2vvq n ARG 113 Ca 0.01 -2.21 0.05 0.00 -0.77 0.00 0.00 57.85 54.93 2vvq n ARG 113 Cb 0.24 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.11 2vvq n ARG 113 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 2vvq n MET 114 N 1.34 0.74 -4.16 5.56 2.81 -0.98 -5.03 117.12 117.39 2vvq n MET 114 Ca 0.20 -0.08 -0.12 0.00 -1.81 0.00 0.00 57.70 55.89 2vvq n MET 114 Cb 0.55 -1.19 -0.10 0.00 -0.71 0.00 0.00 33.22 31.76 2vvq n MET 114 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 2vvq s HIS 115 N -2.58 0.94 0.87 2.03 3.76 -1.25 -5.09 115.29 113.97 2vvq s HIS 115 Ca -0.03 -0.77 -0.11 0.00 -0.15 0.00 0.00 55.06 54.00 2vvq s HIS 115 Cb 0.06 -0.53 0.11 0.00 1.11 0.00 0.00 32.58 33.34 2vvq s HIS 115 CO 0.40 -0.08 1.09 0.95 -0.85 0.00 0.00 174.74 176.25 2vvq s THR 116 N -2.96 2.79 0.12 1.30 -4.23 -1.26 -4.88 115.64 106.51 2vvq s THR 116 Ca 0.07 0.26 -0.20 0.00 -1.18 0.00 0.00 61.69 60.64 2vvq s THR 116 Cb 0.01 -2.77 -0.07 0.00 1.34 0.00 0.00 72.50 71.01 2vvq s THR 116 CO -0.02 -0.33 1.78 0.58 -0.54 0.00 0.00 174.62 176.08 2vvq h VAL 117 N -1.44 1.05 -0.70 2.29 2.07 -1.99 -1.41 116.25 116.13 2vvq h VAL 117 Ca -0.48 -0.10 0.12 0.00 0.82 0.00 0.00 66.70 67.06 2vvq h VAL 117 Cb 1.28 0.76 -0.09 0.00 -1.52 0.00 0.00 31.29 31.71 2vvq h VAL 117 CO 0.55 0.05 0.25 0.00 0.02 0.00 0.00 177.57 178.44 2vvq h ALA 118 N 1.07 0.93 -0.63 1.67 0.00 -1.99 -0.16 119.26 120.15 2vvq h ALA 118 Ca 0.07 0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 2vvq h ALA 118 Cb -0.03 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2vvq h ALA 118 CO -0.02 -0.22 0.14 0.93 0.00 0.00 0.00 179.25 180.09 2vvq h GLU 119 N 0.41 1.01 -0.17 0.00 5.08 -1.87 -2.16 114.58 116.88 2vvq h GLU 119 Ca 0.37 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 2vvq h GLU 119 Cb 0.54 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2vvq h GLU 119 CO -0.38 0.92 0.03 0.00 -1.00 0.00 0.00 179.01 178.58 2vvq h ALA 120 N 1.05 0.22 -0.57 3.43 0.00 -0.29 -1.42 119.26 121.67 2vvq h ALA 120 Ca 0.20 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2vvq h ALA 120 Cb 0.37 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2vvq h ALA 120 CO 0.00 -0.12 0.21 -0.07 0.00 0.00 0.00 179.25 179.27 2vvq h LEU 121 N 0.06 0.77 -0.75 0.00 3.38 -1.05 -0.25 115.31 117.47 2vvq h LEU 121 Ca 0.05 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2vvq h LEU 121 Cb 0.29 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 2vvq h LEU 121 CO 0.00 0.71 0.44 0.00 0.09 0.00 0.00 178.44 179.69 2vvq h ALA 122 N 1.40 0.95 -0.31 1.53 0.00 -1.22 0.97 119.26 122.58 2vvq h ALA 122 Ca 0.19 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2vvq h ALA 122 Cb 0.20 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2vvq h ALA 122 CO -0.01 0.43 0.18 0.82 0.00 0.00 0.00 179.25 180.66 2vvq h ILE 123 N 1.02 1.12 -0.63 0.00 2.04 -0.52 -2.09 117.51 118.46 2vvq h ILE 123 Ca 0.27 -0.31 0.01 0.00 1.00 0.00 0.00 64.86 65.83 2vvq h ILE 123 Cb -0.02 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 2vvq h ILE 123 CO -0.05 0.12 0.41 0.58 0.00 0.00 0.00 178.15 179.22 2vvq h VAL 124 N 0.39 1.15 -0.46 1.67 2.07 -0.71 -1.89 116.25 118.47 2vvq h VAL 124 Ca 0.11 -0.29 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 2vvq h VAL 124 Cb 0.04 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.03 2vvq h VAL 124 CO -0.02 0.15 0.28 0.44 0.02 0.00 0.00 177.57 178.45 2vvq h ASP 125 N 0.83 0.55 -0.63 0.57 3.32 -0.63 -1.09 116.42 119.35 2vvq h ASP 125 Ca 0.23 -0.05 0.01 0.00 0.02 0.00 0.00 57.03 57.24 2vvq h ASP 125 Cb -0.08 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 2vvq h ASP 125 CO -0.06 0.44 0.42 0.00 -1.72 0.00 0.00 179.24 178.32 2vvq h ALA 126 N 1.14 0.80 -0.47 3.45 0.00 -1.15 -1.98 119.26 121.05 2vvq h ALA 126 Ca 0.17 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2vvq h ALA 126 Cb -0.01 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2vvq h ALA 126 CO -0.03 0.23 0.22 0.35 0.00 0.00 0.00 179.25 180.02 2vvq h PHE 127 N 0.85 0.68 0.00 0.00 3.57 -0.90 -1.04 116.94 120.11 2vvq h PHE 127 Ca 0.23 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.69 2vvq h PHE 127 Cb -0.10 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.43 2vvq h PHE 127 CO -0.03 0.55 -0.07 1.33 -2.23 0.00 0.00 178.31 177.86 2vvq n VAL 128 N -4.62 0.18 0.12 1.41 0.24 -0.45 -3.89 118.33 111.31 2vvq n VAL 128 Ca 0.01 -0.09 0.05 0.00 -2.04 0.00 0.00 64.34 62.27 2vvq n VAL 128 Cb 0.12 -0.44 -0.07 0.00 -1.47 0.00 0.00 33.84 31.98 2vvq n VAL 128 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2vvq n THR 129 N -1.74 0.00 -2.66 3.34 -2.24 -0.76 -4.90 114.28 105.32 2vvq n THR 129 Ca 0.06 -0.23 -0.43 0.00 -2.27 0.00 0.00 64.05 61.18 2vvq n THR 129 Cb 0.37 0.49 -0.02 0.00 -2.10 0.00 0.00 70.33 69.07 2vvq n THR 129 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2vvq s THR 130 N -2.43 4.68 0.51 4.28 2.01 -0.41 -5.01 115.64 119.27 2vvq s THR 130 Ca -0.01 2.02 -0.19 0.00 0.31 0.00 0.00 61.69 63.82 2vvq s THR 130 Cb 0.06 -4.31 -0.08 0.00 0.01 0.00 0.00 72.50 68.19 2vvq s THR 130 CO 0.39 -0.17 1.02 -2.16 -0.69 0.00 0.00 174.62 173.01 2vvq s PRO 131 N 3.13 3.77 0.04 4.92 0.04 -1.26 -4.73 135.00 140.91 2vvq s PRO 131 Ca 0.44 1.25 -0.34 0.00 0.04 0.00 0.00 61.00 62.39 2vvq s PRO 131 Cb -0.15 -2.10 -0.13 0.00 0.04 0.00 0.00 34.50 32.16 2vvq s PRO 131 CO 0.07 -0.44 1.72 1.87 0.04 0.00 0.00 177.00 180.25 2vvq n TRP 132 N -1.23 2.28 0.20 0.56 -0.00 -1.26 -3.71 117.44 114.29 2vvq n TRP 132 Ca 0.09 0.15 0.06 0.00 -0.00 0.00 0.00 57.50 57.80 2vvq n TRP 132 Cb 0.53 -2.60 0.39 0.00 -0.00 0.00 0.00 31.31 29.64 2vvq n TRP 132 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 177.69 178.35 2vvq h SER 133 N 7.46 0.00 -0.45 5.87 4.64 -1.70 -3.47 113.55 125.90 2vvq h SER 133 Ca -0.47 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.66 2vvq h SER 133 Cb 1.26 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.28 2vvq h SER 133 CO 0.91 0.34 -0.18 0.29 -0.87 0.00 0.00 176.83 177.32 2vvq n LYS 134 N -3.59 -1.50 -1.97 4.77 5.02 -1.26 -4.99 118.16 114.64 2vvq n LYS 134 Ca -0.01 0.80 -0.39 0.00 -2.02 0.00 0.00 58.31 56.70 2vvq n LYS 134 Cb 0.46 -5.09 0.01 0.00 -0.02 0.00 0.00 35.03 30.38 2vvq n LYS 134 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2vvq s ALA 135 N -1.93 3.18 0.21 7.82 0.00 -1.26 -4.83 121.76 124.95 2vvq s ALA 135 Ca 0.00 1.28 -0.10 0.00 0.00 0.00 0.00 51.96 53.14 2vvq s ALA 135 Cb 0.00 -3.51 0.29 0.00 0.00 0.00 0.00 23.12 19.89 2vvq s ALA 135 CO 0.00 -0.97 1.69 0.37 0.00 0.00 0.00 175.76 176.85 2vvq h GLN 136 N 2.39 0.21 -0.26 0.00 4.15 -1.99 -1.88 115.11 117.73 2vvq h GLN 136 Ca -0.50 -0.01 -0.10 0.00 0.77 0.00 0.00 58.65 58.80 2vvq h GLN 136 Cb 1.26 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.89 2vvq h GLN 136 CO 0.61 0.14 -0.28 0.07 -1.93 0.00 0.00 178.83 177.44 2vvq h ARG 137 N 0.21 0.51 -0.32 1.69 0.11 -1.99 -0.86 114.38 113.73 2vvq h ARG 137 Ca 0.31 -0.21 -0.14 0.00 0.10 0.00 0.00 59.98 60.04 2vvq h ARG 137 Cb 0.48 -0.02 -0.00 0.00 1.11 0.00 0.00 29.97 31.53 2vvq h ARG 137 CO -0.43 0.74 -0.36 0.45 0.10 0.00 0.00 179.97 180.48 2vvq h HIS 138 N 0.44 0.98 -0.51 4.08 3.86 -1.70 -1.66 115.15 120.64 2vvq h HIS 138 Ca 0.06 -0.30 -0.07 0.00 -1.16 0.00 0.00 60.37 58.90 2vvq h HIS 138 Cb 0.72 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.96 2vvq h HIS 138 CO 0.03 1.09 0.05 0.37 0.86 0.00 0.00 177.93 180.32 2vvq h GLN 139 N 0.59 0.83 -0.16 2.45 5.75 -1.10 -0.39 115.11 123.08 2vvq h GLN 139 Ca 0.05 -0.21 -0.01 0.00 -0.15 0.00 0.00 58.65 58.33 2vvq h GLN 139 Cb 0.94 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.38 2vvq h GLN 139 CO 0.09 0.80 0.06 -0.09 -2.65 0.00 0.00 178.83 177.04 2vvq h ARG 140 N 0.78 0.24 -0.55 1.69 2.43 -0.93 -0.15 114.38 117.88 2vvq h ARG 140 Ca 0.16 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.27 2vvq h ARG 140 Cb 0.41 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.89 2vvq h ARG 140 CO 0.01 0.32 0.27 0.00 -1.51 0.00 0.00 179.97 179.06 2vvq h ARG 141 N 0.10 0.79 -0.86 0.20 3.08 -1.11 -1.01 114.38 115.57 2vvq h ARG 141 Ca 0.05 -0.12 0.01 0.00 0.07 0.00 0.00 59.98 59.99 2vvq h ARG 141 Cb 0.17 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.03 2vvq h ARG 141 CO -0.00 0.65 0.56 0.82 -1.07 0.00 0.00 179.97 180.93 2vvq h ILE 142 N 0.74 1.22 -0.77 2.04 2.04 -0.85 -2.21 117.51 119.73 2vvq h ILE 142 Ca 0.19 -0.42 -0.05 0.00 1.00 0.00 0.00 64.86 65.58 2vvq h ILE 142 Cb 0.12 -0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.13 2vvq h ILE 142 CO -0.02 0.22 0.29 0.44 0.00 0.00 0.00 178.15 179.08 2vvq h ASP 143 N 1.17 1.07 -0.28 1.72 3.32 -0.72 0.24 116.42 122.93 2vvq h ASP 143 Ca 0.31 -0.18 0.01 0.00 0.02 0.00 0.00 57.03 57.19 2vvq h ASP 143 Cb -0.12 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.13 2vvq h ASP 143 CO -0.07 0.96 0.18 0.40 -1.72 0.00 0.00 179.24 178.99 2vvq h ILE 144 N 1.11 1.05 -0.66 0.35 2.04 -0.86 -0.80 117.51 119.75 2vvq h ILE 144 Ca 0.25 -0.12 -0.04 0.00 1.00 0.00 0.00 64.86 65.95 2vvq h ILE 144 Cb 0.23 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 2vvq h ILE 144 CO -0.02 0.07 0.25 0.25 0.00 0.00 0.00 178.15 178.70 2vvq h LEU 145 N 0.36 0.91 -0.78 1.44 5.85 -1.18 -1.95 115.31 119.97 2vvq h LEU 145 Ca 0.11 -0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.69 2vvq h LEU 145 Cb -0.02 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.72 2vvq h LEU 145 CO -0.04 0.84 0.49 0.00 -0.34 0.00 0.00 178.44 179.39 2vvq h ALA 146 N 1.11 1.03 -0.58 1.25 0.00 -0.77 -0.30 119.26 120.98 2vvq h ALA 146 Ca 0.22 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 2vvq h ALA 146 Cb 0.22 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2vvq h ALA 146 CO -0.02 0.28 0.15 1.49 0.00 0.00 0.00 179.25 181.15 2vvq h GLU 147 N 0.94 0.92 -0.76 0.00 4.57 -0.89 -1.00 114.58 118.36 2vvq h GLU 147 Ca 0.32 -0.22 0.01 0.00 -1.18 0.00 0.00 59.36 58.29 2vvq h GLU 147 Cb 0.05 -0.12 -0.04 0.00 -0.16 0.00 0.00 28.75 28.47 2vvq h GLU 147 CO -0.12 0.85 0.50 -0.92 -1.18 0.00 0.00 179.01 178.14 2vvq h TYR 148 N 0.83 0.96 -0.10 0.92 5.03 -0.95 -2.12 116.97 121.54 2vvq h TYR 148 Ca 0.18 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.48 2vvq h TYR 148 Cb 0.33 -0.32 -0.01 0.00 1.55 0.00 0.00 36.73 38.28 2vvq h TYR 148 CO 0.02 0.60 -0.11 1.49 -1.32 0.00 0.00 178.16 178.84 2vvq h GLU 149 N 1.03 0.14 -0.28 1.82 4.81 -0.78 1.27 114.58 122.60 2vvq h GLU 149 Ca 0.28 -0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 59.34 2vvq h GLU 149 Cb -0.11 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.24 2vvq h GLU 149 CO -0.06 0.27 -0.37 -0.09 -0.73 0.00 0.00 179.01 178.02 2vvq h ARG 150 N 0.14 0.74 0.00 1.92 2.43 -0.55 -3.37 114.38 115.68 2vvq h ARG 150 Ca 0.03 -0.43 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 2vvq h ARG 150 Cb 0.29 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 2vvq h ARG 150 CO 0.02 1.05 -1.26 0.25 -1.51 0.00 0.00 179.97 178.51 2vvq n THR 151 N -4.19 0.00 -2.33 0.20 -2.24 -0.90 -5.00 114.28 99.82 2vvq n THR 151 Ca -0.04 -0.23 -0.11 0.00 -2.27 0.00 0.00 64.05 61.40 2vvq n THR 151 Cb 0.53 0.40 -0.01 0.00 -2.10 0.00 0.00 70.33 69.15 2vvq n THR 151 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2vvq n HIS 152 N -1.73 -1.38 -3.37 4.78 8.25 0.44 -4.97 115.22 117.24 2vvq n HIS 152 Ca -0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.04 2vvq n HIS 152 Cb 0.23 -2.51 -0.09 0.00 1.12 0.00 0.00 29.99 28.73 2vvq n HIS 152 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2vvq s GLU 153 N -4.80 3.45 0.06 -0.41 2.02 -1.26 -5.05 118.70 112.72 2vvq s GLU 153 Ca 0.00 -0.49 -0.33 0.00 0.02 0.00 0.00 54.97 54.17 2vvq s GLU 153 Cb 0.00 -3.85 -0.12 0.00 0.10 0.00 0.00 34.13 30.27 2vvq s GLU 153 CO 0.00 -0.61 1.79 0.00 0.02 0.00 0.00 175.26 176.46 2vvq n ALA 154 N 5.45 1.52 -1.70 5.21 0.00 -1.26 -4.72 120.51 125.01 2vvq n ALA 154 Ca -0.08 0.34 -0.34 0.00 0.00 0.00 0.00 53.44 53.36 2vvq n ALA 154 Cb 0.49 -2.50 0.00 0.00 0.00 0.00 0.00 19.45 17.44 2vvq n ALA 154 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2vvq s PRO 155 N 2.74 3.39 0.49 0.00 0.04 -1.26 -4.97 135.00 135.43 2vvq s PRO 155 Ca 0.85 1.34 -0.23 0.00 0.04 0.00 0.00 61.00 63.00 2vvq s PRO 155 Cb -0.60 -2.03 -0.06 0.00 0.04 0.00 0.00 34.50 31.84 2vvq s PRO 155 CO 0.42 -0.77 1.26 -1.25 0.04 0.00 0.00 177.00 176.70 2vvq s PRO 156 N -3.70 3.53 0.12 0.56 0.04 -1.26 -5.02 135.00 129.28 2vvq s PRO 156 Ca 0.67 2.00 -0.15 0.00 0.04 0.00 0.00 61.00 63.56 2vvq s PRO 156 Cb -0.18 -2.38 -0.07 0.00 0.04 0.00 0.00 34.50 31.91 2vvq s PRO 156 CO 0.31 -0.80 0.54 0.14 0.04 0.00 0.00 177.00 177.23 2vvq s VAL 157 N -1.42 4.86 0.43 -0.36 -7.23 -1.26 -5.07 120.40 110.35 2vvq s VAL 157 Ca 0.66 0.87 -0.22 0.00 -1.81 0.00 0.00 61.98 61.48 2vvq s VAL 157 Cb -0.34 -3.75 -0.12 0.00 0.56 0.00 0.00 36.38 32.72 2vvq s VAL 157 CO 0.41 0.31 0.61 -2.65 -0.31 0.00 0.00 175.10 173.48 2vvq n PRO 158 N 1.00 0.67 0.00 4.82 -0.02 -1.26 -5.34 135.00 134.87 2vvq n PRO 158 Ca -0.07 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 2vvq n PRO 158 Cb 0.52 -1.60 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 2vvq n PRO 158 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89