#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wvb s ARG 6 N 0.00 0.64 0.10 4.33 1.81 -1.26 -5.13 118.95 119.44 1wvb s ARG 6 Ca 0.00 -0.41 -0.25 0.00 -1.72 0.00 0.00 55.73 53.36 1wvb s ARG 6 Cb 0.00 -2.09 -0.07 0.00 -0.45 0.00 0.00 34.95 32.34 1wvb s ARG 6 CO 0.00 -0.64 0.76 0.99 -0.68 0.00 0.00 175.30 175.73 1wvb s THR 7 N 1.87 4.56 -0.08 0.02 2.01 -1.26 -4.08 115.64 118.67 1wvb s THR 7 Ca -0.01 1.65 -0.05 0.00 0.31 0.00 0.00 61.69 63.59 1wvb s THR 7 Cb -0.17 -4.12 -0.04 0.00 0.01 0.00 0.00 72.50 68.18 1wvb s THR 7 CO -0.08 0.45 0.13 -0.63 -0.69 0.00 0.00 174.62 173.80 1wvb s ILE 8 N -0.61 5.32 -0.32 1.82 1.01 0.03 0.14 121.20 128.58 1wvb s ILE 8 Ca 0.37 0.03 0.02 0.00 0.00 0.00 0.00 60.65 61.07 1wvb s ILE 8 Cb -0.22 -3.36 0.10 0.00 0.01 0.00 0.00 42.46 38.99 1wvb s ILE 8 CO 0.24 0.52 0.06 -0.83 0.00 0.00 0.00 174.94 174.93 1wvb s GLY 9 N -1.30 1.60 0.16 6.18 0.00 0.30 0.46 107.32 114.73 1wvb s GLY 9 Ca 0.19 -2.16 -0.27 0.00 0.00 0.00 0.00 44.72 42.47 1wvb s GLY 9 CO 0.08 1.16 0.84 -0.42 0.00 0.00 0.00 173.10 174.77 1wvb s ILE 10 N 1.18 4.35 -0.18 0.90 -1.09 0.31 -0.11 121.20 126.56 1wvb s ILE 10 Ca 0.09 1.85 -0.05 0.00 -2.23 0.00 0.00 60.65 60.31 1wvb s ILE 10 Cb -0.18 -4.21 0.07 0.00 -1.58 0.00 0.00 42.46 36.55 1wvb s ILE 10 CO -0.14 0.47 0.10 -0.63 -1.23 0.00 0.00 174.94 173.51 1wvb s ILE 11 N -0.85 -0.10 0.27 2.92 1.01 -0.91 -0.39 121.20 123.15 1wvb s ILE 11 Ca 0.39 -0.20 -0.29 0.00 0.00 0.00 0.00 60.65 60.55 1wvb s ILE 11 Cb -0.24 -0.61 -0.09 0.00 0.01 0.00 0.00 42.46 41.53 1wvb s ILE 11 CO 0.28 -0.31 0.97 -0.83 0.00 0.00 0.00 174.94 175.05 1wvb s GLY 12 N 2.15 3.02 -0.40 6.18 0.00 0.44 -3.51 107.32 115.20 1wvb s GLY 12 Ca 0.03 0.65 0.07 0.00 0.00 0.00 0.00 44.72 45.46 1wvb s GLY 12 CO -0.11 1.18 0.46 0.00 0.00 0.00 0.00 173.10 174.63 1wvb n ALA 13 N 1.15 2.56 -0.47 3.20 0.00 -1.11 -0.74 120.51 125.09 1wvb n ALA 13 Ca -0.01 -3.30 -0.10 0.00 0.00 0.00 0.00 53.44 50.04 1wvb n ALA 13 Cb 0.47 -0.79 -0.05 0.00 0.00 0.00 0.00 19.45 19.08 1wvb n ALA 13 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1wvb n PRO 14 N 1.87 1.13 -3.83 0.00 -0.04 -1.26 -2.60 135.00 130.26 1wvb n PRO 14 Ca 0.24 -0.73 -0.36 0.00 -0.04 0.00 0.00 63.50 62.61 1wvb n PRO 14 Cb 0.51 -1.96 -0.06 0.00 -0.04 0.00 0.00 33.50 31.96 1wvb n PRO 14 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1wvb s PHE 15 N 2.81 3.59 0.00 0.54 5.36 -1.26 -4.64 117.98 124.38 1wvb s PHE 15 Ca 0.29 0.53 0.00 0.00 -0.96 0.00 0.00 56.93 56.79 1wvb s PHE 15 Cb 0.11 -1.95 0.00 0.00 -0.34 0.00 0.00 43.02 40.84 1wvb s PHE 15 CO -0.01 0.69 0.00 -1.13 -1.46 0.00 0.00 175.22 173.31 1wvb n SER 16 N 1.54 0.00 -0.46 6.13 3.41 -1.26 -2.29 113.62 120.70 1wvb n SER 16 Ca -0.16 -0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.12 1wvb n SER 16 Cb 0.54 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 1wvb n SER 16 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1wvb n LYS 17 N 0.00 0.66 -0.09 4.33 5.02 -1.26 -2.19 118.16 124.64 1wvb n LYS 17 Ca 0.00 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.40 1wvb n LYS 17 Cb 0.08 -1.30 0.14 0.00 -0.02 0.00 0.00 35.03 33.93 1wvb n LYS 17 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wvb n GLY 18 N 0.17 1.20 3.79 0.72 0.00 -1.26 -4.64 105.19 105.16 1wvb n GLY 18 Ca 0.00 -0.65 -0.04 0.00 0.00 0.00 0.00 46.02 45.33 1wvb n GLY 18 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1wvb s GLN 19 N -1.60 1.32 0.04 1.61 1.03 -0.93 0.49 119.66 121.62 1wvb s GLN 19 Ca 0.30 -0.77 -0.27 0.00 0.04 0.00 0.00 55.36 54.67 1wvb s GLN 19 Cb 0.19 0.42 -0.17 0.00 0.03 0.00 0.00 33.01 33.49 1wvb s GLN 19 CO 0.28 -0.61 1.42 -1.00 -2.54 0.00 0.00 175.29 172.84 1wvb h PRO 20 N 2.00 -0.46 -6.29 9.60 0.13 -1.94 -3.44 132.00 131.59 1wvb h PRO 20 Ca -0.25 0.03 -0.57 0.00 -0.87 0.00 0.00 66.00 64.34 1wvb h PRO 20 Cb 1.23 0.11 -0.05 0.00 0.13 0.00 0.00 31.00 32.42 1wvb h PRO 20 CO 0.28 -0.20 0.96 1.03 -0.23 0.00 0.00 178.00 179.85 1wvb s ARG 21 N -5.26 3.99 0.26 0.86 3.00 -1.26 -4.94 118.95 115.60 1wvb s ARG 21 Ca -0.15 1.37 0.01 0.00 0.00 0.00 0.00 55.73 56.97 1wvb s ARG 21 Cb 0.03 -3.86 0.34 0.00 0.00 0.00 0.00 34.95 31.47 1wvb s ARG 21 CO 0.58 -1.02 1.67 0.78 0.00 0.00 0.00 175.30 177.31 1wvb h GLY 22 N 10.63 0.53 -1.51 -3.53 0.00 -1.85 -3.34 103.07 103.98 1wvb h GLY 22 Ca -0.27 -0.47 0.46 0.00 0.00 0.00 0.00 47.33 47.05 1wvb h GLY 22 CO 1.02 0.43 1.06 0.61 0.00 0.00 0.00 176.54 179.66 1wvb n GLY 23 N -0.23 -0.80 0.18 4.60 0.00 -1.26 -1.34 105.19 106.34 1wvb n GLY 23 Ca -0.01 0.60 0.06 0.00 0.00 0.00 0.00 46.02 46.67 1wvb n GLY 23 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1wvb h VAL 24 N 0.00 0.00 0.00 1.61 -1.51 -1.75 1.12 116.25 115.72 1wvb h VAL 24 Ca 0.78 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 66.25 1wvb h VAL 24 Cb 2.95 0.25 0.00 0.00 -2.13 0.00 0.00 31.29 32.35 1wvb h VAL 24 CO -0.13 0.00 0.00 -0.33 -1.23 0.00 0.00 177.57 175.88 1wvb h GLU 25 N 0.00 0.00 0.00 5.19 5.08 -1.41 -2.89 114.58 120.55 1wvb h GLU 25 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1wvb h GLU 25 Cb 0.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.08 1wvb h GLU 25 CO 0.00 0.00 0.00 0.93 -1.00 0.00 0.00 179.01 178.94 1wvb h GLU 26 N 0.00 0.00 -0.33 2.33 5.08 0.11 -3.37 114.58 118.39 1wvb h GLU 26 Ca 0.00 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1wvb h GLU 26 Cb 0.54 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.74 1wvb h GLU 26 CO 0.00 0.00 -0.28 0.78 -1.00 0.00 0.00 179.01 178.51 1wvb h GLY 27 N 2.14 -1.63 0.01 -3.84 0.00 -1.68 0.63 103.07 98.70 1wvb h GLY 27 Ca 0.00 0.88 0.15 0.00 0.00 0.00 0.00 47.33 48.36 1wvb h GLY 27 CO 0.00 -0.47 0.21 -2.55 0.00 0.00 0.00 176.54 173.73 1wvb h PRO 28 N -0.11 0.30 0.06 4.80 0.11 -1.76 0.37 132.00 135.78 1wvb h PRO 28 Ca 0.06 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.14 1wvb h PRO 28 Cb 0.25 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.29 1wvb h PRO 28 CO -0.37 0.20 -0.06 1.15 -0.21 0.00 0.00 178.00 178.71 1wvb h THR 29 N 0.31 0.00 -0.63 -1.15 2.02 -1.62 0.12 112.91 111.96 1wvb h THR 29 Ca 0.41 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.69 1wvb h THR 29 Cb 0.67 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.00 1wvb h THR 29 CO -0.47 0.00 0.22 0.58 0.37 0.00 0.00 175.52 176.21 1wvb h VAL 30 N -0.12 0.72 0.10 3.16 2.07 -0.59 0.87 116.25 122.47 1wvb h VAL 30 Ca -0.01 -0.13 0.02 0.00 0.82 0.00 0.00 66.70 67.40 1wvb h VAL 30 Cb 0.10 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.14 1wvb h VAL 30 CO -0.00 0.07 -0.31 -0.07 0.02 0.00 0.00 177.57 177.28 1wvb h LEU 31 N 0.38 -0.89 -0.02 2.57 3.38 -0.20 -0.57 115.31 119.97 1wvb h LEU 31 Ca 0.33 0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.42 1wvb h LEU 31 Cb 0.44 0.34 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 1wvb h LEU 31 CO -0.35 -0.39 -0.08 0.03 0.09 0.00 0.00 178.44 177.75 1wvb h ARG 32 N -0.52 -0.12 0.00 1.13 3.08 0.09 -2.30 114.38 115.75 1wvb h ARG 32 Ca 0.04 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1wvb h ARG 32 Cb 0.56 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.63 1wvb h ARG 32 CO -0.19 -0.08 0.00 -0.22 -1.07 0.00 0.00 179.97 178.41 1wvb h LYS 33 N -0.12 0.00 0.00 0.04 3.64 -0.64 -0.49 116.57 119.00 1wvb h LYS 33 Ca 0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1wvb h LYS 33 Cb 0.17 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1wvb h LYS 33 CO -0.09 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.09 1wvb n ALA 34 N -1.80 2.54 -0.82 5.00 0.00 -0.24 -4.88 120.51 120.31 1wvb n ALA 34 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1wvb n ALA 34 Cb 0.12 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.07 1wvb n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wvb n GLY 35 N 1.15 1.27 0.29 0.00 0.00 -0.20 -5.02 105.19 102.68 1wvb n GLY 35 Ca 0.18 -0.32 -0.07 0.00 0.00 0.00 0.00 46.02 45.80 1wvb n GLY 35 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1wvb h LEU 36 N 0.00 0.93 0.37 0.99 5.85 -1.59 -2.76 115.31 119.09 1wvb h LEU 36 Ca 0.00 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.51 1wvb h LEU 36 Cb 0.39 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.18 1wvb h LEU 36 CO 0.00 0.87 -0.18 -0.07 -0.34 0.00 0.00 178.44 178.73 1wvb h LEU 37 N 0.93 -0.42 -0.95 2.25 3.38 -1.90 -2.26 115.31 116.34 1wvb h LEU 37 Ca 0.21 -0.08 0.07 0.00 0.09 0.00 0.00 57.88 58.18 1wvb h LEU 37 Cb 0.26 0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.06 1wvb h LEU 37 CO -0.01 -0.17 0.60 -0.33 0.09 0.00 0.00 178.44 178.62 1wvb h GLU 38 N -0.66 1.05 -0.42 1.13 3.07 -1.95 -0.15 114.58 116.65 1wvb h GLU 38 Ca -0.05 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.36 58.72 1wvb h GLU 38 Cb 0.47 -0.24 -0.02 0.00 -0.84 0.00 0.00 28.75 28.13 1wvb h GLU 38 CO 0.08 0.69 0.18 0.87 -1.40 0.00 0.00 179.01 179.43 1wvb h LYS 39 N 1.08 0.62 -0.27 2.33 1.57 -1.44 0.46 116.57 120.92 1wvb h LYS 39 Ca 0.42 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 1wvb h LYS 39 Cb 0.21 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1wvb h LYS 39 CO -0.19 0.57 0.17 -0.07 -0.57 0.00 0.00 179.45 179.37 1wvb h LEU 40 N 0.54 0.31 -0.80 2.94 3.38 -0.95 -2.44 115.31 118.29 1wvb h LEU 40 Ca 0.14 -0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.15 1wvb h LEU 40 Cb 0.18 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 1wvb h LEU 40 CO -0.01 0.24 0.48 0.11 0.09 0.00 0.00 178.44 179.35 1wvb h LYS 41 N 0.35 0.83 -0.23 1.13 1.57 -0.43 0.84 116.57 120.62 1wvb h LYS 41 Ca 0.10 -0.05 0.07 0.00 -1.87 0.00 0.00 60.65 58.89 1wvb h LYS 41 Cb -0.02 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 1wvb h LYS 41 CO -0.02 0.55 0.43 0.93 -0.57 0.00 0.00 179.45 180.77 1wvb h GLU 42 N 0.86 0.00 0.00 3.15 5.08 0.41 -3.40 114.58 120.68 1wvb h GLU 42 Ca 0.35 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 1wvb h GLU 42 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1wvb h GLU 42 CO -0.19 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 178.86 1wvb n GLN 43 N -3.31 1.54 -3.37 2.33 6.02 0.29 -5.04 117.38 115.84 1wvb n GLN 43 Ca 0.03 0.00 -0.45 0.00 -0.01 0.00 0.00 57.00 56.58 1wvb n GLN 43 Cb 0.55 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 31.73 1wvb n GLN 43 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 1wvb s GLU 44 N -0.19 2.99 -0.30 -1.09 -1.05 -1.26 -5.01 118.70 112.80 1wvb s GLU 44 Ca 0.00 -1.40 -0.25 0.00 -0.15 0.00 0.00 54.97 53.17 1wvb s GLU 44 Cb 0.00 -4.16 0.19 0.00 -0.44 0.00 0.00 34.13 29.72 1wvb s GLU 44 CO 0.00 -1.09 1.42 0.00 0.95 0.00 0.00 175.26 176.54 1wvb s ASP 46 N 0.05 6.30 -0.09 0.00 1.01 -1.26 -4.70 116.67 117.98 1wvb s ASP 46 Ca 0.07 -1.56 -0.30 0.00 0.71 0.00 0.00 52.55 51.48 1wvb s ASP 46 Cb -0.05 -2.33 -0.02 0.00 1.01 0.00 0.00 42.92 41.53 1wvb s ASP 46 CO -0.15 -1.12 1.08 -0.69 0.21 0.00 0.00 175.17 174.50 1wvb s VAL 47 N 2.72 4.57 -0.35 -1.27 1.01 -1.26 -0.79 120.40 125.02 1wvb s VAL 47 Ca 0.17 1.86 -0.03 0.00 0.00 0.00 0.00 61.98 63.98 1wvb s VAL 47 Cb -0.19 -4.20 0.07 0.00 0.00 0.00 0.00 36.38 32.07 1wvb s VAL 47 CO 0.03 -0.00 0.10 -0.54 0.00 0.00 0.00 175.10 174.69 1wvb s LYS 48 N 2.13 2.32 -1.10 2.72 -0.14 0.17 -4.93 119.74 120.92 1wvb s LYS 48 Ca 0.51 -1.45 -0.16 0.00 -1.36 0.00 0.00 55.97 53.51 1wvb s LYS 48 Cb -0.21 -3.40 0.15 0.00 -1.68 0.00 0.00 37.83 32.70 1wvb s LYS 48 CO 0.19 -0.80 1.32 0.34 -0.76 0.00 0.00 175.35 175.65 1wvb s ASP 49 N 1.51 6.88 0.00 2.83 -1.08 -1.26 0.12 116.67 125.67 1wvb s ASP 49 Ca 0.01 -2.58 0.00 0.00 -0.52 0.00 0.00 52.55 49.45 1wvb s ASP 49 Cb -0.21 -2.41 0.03 0.00 -1.46 0.00 0.00 42.92 38.87 1wvb s ASP 49 CO -0.01 -0.89 0.44 -1.22 0.52 0.00 0.00 175.17 174.00 1wvb n TYR 50 N 6.13 0.00 -3.48 -5.34 4.02 0.48 -4.94 117.16 114.03 1wvb n TYR 50 Ca 0.32 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 58.23 1wvb n TYR 50 Cb 0.45 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.77 1wvb n TYR 50 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1wvb n GLY 51 N -0.09 -1.77 3.64 2.72 0.00 -1.24 -4.81 105.19 103.64 1wvb n GLY 51 Ca 0.00 -1.30 -0.38 0.00 0.00 0.00 0.00 46.02 44.35 1wvb n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wvb s ASP 52 N -3.99 6.20 0.16 1.61 1.11 -1.26 0.16 116.67 120.66 1wvb s ASP 52 Ca 0.00 0.21 -0.32 0.00 0.18 0.00 0.00 52.55 52.63 1wvb s ASP 52 Cb 0.00 -2.15 -0.10 0.00 1.07 0.00 0.00 42.92 41.74 1wvb s ASP 52 CO 0.00 -0.03 1.55 -0.76 1.18 0.00 0.00 175.17 177.11 1wvb s LEU 53 N 1.39 4.37 -0.16 1.23 1.43 0.08 -4.87 118.68 122.16 1wvb s LEU 53 Ca 0.11 2.58 -0.26 0.00 -1.03 0.00 0.00 54.13 55.54 1wvb s LEU 53 Cb -0.15 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.47 1wvb s LEU 53 CO 0.07 -0.81 0.87 -2.16 0.23 0.00 0.00 176.35 174.56 1wvb s PRO 54 N 1.14 4.32 -0.23 1.29 0.04 -1.26 -4.67 135.00 135.63 1wvb s PRO 54 Ca 0.69 1.10 -0.06 0.00 0.04 0.00 0.00 61.00 62.77 1wvb s PRO 54 Cb -0.43 -3.57 -0.03 0.00 0.04 0.00 0.00 34.50 30.51 1wvb s PRO 54 CO 0.31 -0.34 0.04 -0.06 0.04 0.00 0.00 177.00 177.00 1wvb s PHE 55 N 2.16 3.07 -0.26 0.56 0.08 -1.26 -5.07 117.98 117.26 1wvb s PHE 55 Ca 0.40 -0.47 -0.20 0.00 0.12 0.00 0.00 56.93 56.79 1wvb s PHE 55 Cb -0.17 -2.18 -0.02 0.00 -0.57 0.00 0.00 43.02 40.08 1wvb s PHE 55 CO 0.13 -0.34 0.61 0.00 -0.10 0.00 0.00 175.22 175.52 1wvb s ALA 56 N 1.42 3.60 0.42 5.36 0.00 -1.26 -5.02 121.76 126.28 1wvb s ALA 56 Ca 0.05 -0.49 -0.26 0.00 0.00 0.00 0.00 51.96 51.26 1wvb s ALA 56 Cb -0.15 -3.01 -0.10 0.00 0.00 0.00 0.00 23.12 19.87 1wvb s ALA 56 CO 0.02 -0.82 1.39 -3.47 0.00 0.00 0.00 175.76 172.89 1wvb n ASP 57 N 5.69 3.17 -4.50 0.00 4.64 -1.26 -4.91 116.55 119.38 1wvb n ASP 57 Ca -0.01 1.15 -0.43 0.00 -1.38 0.00 0.00 54.79 54.11 1wvb n ASP 57 Cb 0.49 -1.57 -0.04 0.00 -1.04 0.00 0.00 41.12 38.96 1wvb n ASP 57 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1wvb s ILE 58 N -1.17 4.35 0.21 5.18 1.01 -1.26 -4.95 121.20 124.58 1wvb s ILE 58 Ca 0.59 0.04 -0.20 0.00 0.00 0.00 0.00 60.65 61.08 1wvb s ILE 58 Cb -0.48 -4.60 0.17 0.00 0.01 0.00 0.00 42.46 37.56 1wvb s ILE 58 CO 0.59 -1.25 1.55 1.55 0.00 0.00 0.00 174.94 177.39 1wvb h PRO 59 N 9.42 -0.03 -3.15 2.79 0.13 -2.05 -3.14 132.00 135.96 1wvb h PRO 59 Ca -0.27 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 64.15 1wvb h PRO 59 Cb 1.07 0.01 -0.35 0.00 0.13 0.00 0.00 31.00 31.86 1wvb h PRO 59 CO 1.12 -0.02 -0.02 0.09 -0.23 0.00 0.00 178.00 178.95 1wvb n ASN 60 N -5.43 4.48 -3.61 1.44 3.02 -1.26 -4.95 115.26 108.95 1wvb n ASN 60 Ca 0.08 -3.20 -0.35 0.00 -0.03 0.00 0.00 54.58 51.09 1wvb n ASN 60 Cb 0.37 -1.05 -0.03 0.00 -0.61 0.00 0.00 39.78 38.46 1wvb n ASN 60 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1wvb n ASP 61 N 2.04 5.26 -4.77 6.41 2.03 -1.19 -5.05 116.55 121.28 1wvb n ASP 61 Ca 0.23 -3.49 -0.40 0.00 0.52 0.00 0.00 54.79 51.65 1wvb n ASP 61 Cb 0.37 -0.94 -0.02 0.00 -0.72 0.00 0.00 41.12 39.81 1wvb n ASP 61 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1wvb s SER 62 N -2.22 6.82 0.75 1.67 1.04 -1.26 -4.16 113.70 116.33 1wvb s SER 62 Ca 0.37 2.59 -0.16 0.00 0.48 0.00 0.00 55.95 59.24 1wvb s SER 62 Cb 0.13 -2.64 -0.01 0.00 0.10 0.00 0.00 66.02 63.60 1wvb s SER 62 CO 0.01 -0.49 0.73 -2.65 0.98 0.00 0.00 173.24 171.82 1wvb n PRO 63 N 0.79 0.32 -3.57 4.02 -0.02 -1.26 -4.75 135.00 130.52 1wvb n PRO 63 Ca 0.00 0.16 -0.41 0.00 -2.02 0.00 0.00 63.50 61.23 1wvb n PRO 63 Cb 0.43 -2.02 -0.09 0.00 -0.02 0.00 0.00 33.50 31.79 1wvb n PRO 63 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1wvb s PHE 64 N -1.93 3.36 0.00 6.00 5.36 -0.56 -4.90 117.98 125.30 1wvb s PHE 64 Ca 0.68 -1.59 0.00 0.00 -0.96 0.00 0.00 56.93 55.06 1wvb s PHE 64 Cb -0.33 -3.13 0.00 0.00 -0.34 0.00 0.00 43.02 39.22 1wvb s PHE 64 CO 0.55 -0.89 0.00 1.04 -1.46 0.00 0.00 175.22 174.47 1wvb n GLN 65 N 4.94 0.00 0.00 10.12 6.02 -1.26 -0.06 117.38 137.14 1wvb n GLN 65 Ca -0.10 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 56.96 1wvb n GLN 65 Cb 0.42 0.00 0.06 0.00 1.02 0.00 0.00 30.24 31.74 1wvb n GLN 65 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.06 177.56 1wvb n ILE 66 N 0.00 0.00 -2.82 5.09 3.06 -1.26 -4.94 119.36 118.49 1wvb n ILE 66 Ca 0.00 -0.50 -0.43 0.00 -2.50 0.00 0.00 62.75 59.32 1wvb n ILE 66 Cb 0.00 1.29 -0.04 0.00 0.54 0.00 0.00 39.64 41.43 1wvb n ILE 66 CO 0.00 0.00 0.00 -0.69 -2.50 0.00 0.00 176.55 173.36 1wvb s VAL 67 N -1.17 4.41 0.45 9.51 1.01 0.92 -4.64 120.40 130.89 1wvb s VAL 67 Ca 0.16 0.48 -0.21 0.00 0.00 0.00 0.00 61.98 62.42 1wvb s VAL 67 Cb 0.12 -4.50 -0.10 0.00 0.00 0.00 0.00 36.38 31.89 1wvb s VAL 67 CO 0.18 -1.01 0.98 -0.54 0.00 0.00 0.00 175.10 174.70 1wvb s LYS 68 N 3.91 4.08 -1.52 2.72 1.02 -1.23 -1.50 119.74 127.22 1wvb s LYS 68 Ca 0.33 1.19 -0.05 0.00 0.02 0.00 0.00 55.97 57.47 1wvb s LYS 68 Cb -0.11 -2.15 0.04 0.00 -0.52 0.00 0.00 37.83 35.09 1wvb s LYS 68 CO 0.22 -0.17 0.40 0.09 -0.92 0.00 0.00 175.35 174.97 1wvb n ASN 69 N -0.79 -0.69 0.07 2.83 3.02 -1.26 -4.73 115.26 113.72 1wvb n ASN 69 Ca 0.08 -1.08 -0.13 0.00 -0.03 0.00 0.00 54.58 53.42 1wvb n ASN 69 Cb 0.54 -2.61 -0.08 0.00 -0.61 0.00 0.00 39.78 37.01 1wvb n ASN 69 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1wvb h PRO 70 N -1.72 -0.13 -0.37 3.52 0.13 -1.83 -0.47 132.00 131.13 1wvb h PRO 70 Ca -0.63 0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 64.45 1wvb h PRO 70 Cb 1.38 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.53 1wvb h PRO 70 CO 0.69 0.03 -0.01 0.00 -0.23 0.00 0.00 178.00 178.48 1wvb h ARG 71 N -0.26 0.65 -0.92 0.86 3.08 -1.88 0.61 114.38 116.52 1wvb h ARG 71 Ca -0.01 -0.21 0.09 0.00 0.07 0.00 0.00 59.98 59.91 1wvb h ARG 71 Cb 0.21 -0.06 -0.07 0.00 0.08 0.00 0.00 29.97 30.13 1wvb h ARG 71 CO 0.02 0.76 0.57 0.77 -1.07 0.00 0.00 179.97 181.03 1wvb h SER 72 N 0.47 0.86 0.01 7.04 0.02 -1.89 -1.06 113.55 119.00 1wvb h SER 72 Ca 0.10 0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1wvb h SER 72 Cb 0.47 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1wvb h SER 72 CO 0.02 0.51 -0.00 0.58 -1.14 0.00 0.00 176.83 176.80 1wvb h VAL 73 N 0.97 1.60 -0.07 2.27 2.07 -0.75 -3.18 116.25 119.16 1wvb h VAL 73 Ca 0.43 -1.91 0.02 0.00 0.82 0.00 0.00 66.70 66.06 1wvb h VAL 73 Cb 0.32 2.88 -0.00 0.00 -1.52 0.00 0.00 31.29 32.96 1wvb h VAL 73 CO -0.22 0.49 0.07 1.23 0.02 0.00 0.00 177.57 179.15 1wvb h GLY 74 N -0.84 0.00 1.39 2.17 0.00 0.41 -2.18 103.07 104.03 1wvb h GLY 74 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.04 1wvb h GLY 74 CO 0.00 0.00 -1.42 1.70 0.00 0.00 0.00 176.54 176.82 1wvb h LYS 75 N 0.00 0.21 -0.46 4.80 1.63 -1.31 -1.88 116.57 119.56 1wvb h LYS 75 Ca 0.03 -0.35 -0.02 0.00 -0.85 0.00 0.00 60.65 59.46 1wvb h LYS 75 Cb 0.17 0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.91 1wvb h LYS 75 CO -0.00 1.08 0.22 0.00 -3.45 0.00 0.00 179.45 177.29 1wvb h ALA 76 N 0.61 1.52 0.00 5.00 0.00 -1.38 1.30 119.26 126.30 1wvb h ALA 76 Ca -0.19 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 54.45 1wvb h ALA 76 Cb 1.98 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.55 1wvb h ALA 76 CO 0.16 0.38 -0.80 0.77 0.00 0.00 0.00 179.25 179.76 1wvb h SER 77 N 0.64 0.00 -0.00 0.00 0.02 -1.45 -1.38 113.55 111.37 1wvb h SER 77 Ca 0.16 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 1wvb h SER 77 Cb 0.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.62 1wvb h SER 77 CO -0.02 0.80 -0.03 -0.08 -1.14 0.00 0.00 176.83 176.36 1wvb h GLU 78 N 0.00 0.02 0.07 3.45 4.81 -0.11 0.17 114.58 123.00 1wvb h GLU 78 Ca -0.01 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1wvb h GLU 78 Cb 1.57 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.92 1wvb h GLU 78 CO 0.10 0.76 -0.35 1.96 -0.73 0.00 0.00 179.01 180.75 1wvb h GLN 79 N -0.70 -0.47 -1.00 1.92 4.20 0.15 -1.16 115.11 118.05 1wvb h GLN 79 Ca -0.00 0.03 0.24 0.00 0.06 0.00 0.00 58.65 58.98 1wvb h GLN 79 Cb 0.76 0.11 -0.09 0.00 0.30 0.00 0.00 27.48 28.56 1wvb h GLN 79 CO 0.01 -0.32 0.64 1.25 -0.67 0.00 0.00 178.83 179.74 1wvb h LEU 80 N -0.49 0.49 0.05 1.46 5.85 -1.32 -0.79 115.31 120.56 1wvb h LEU 80 Ca -0.00 0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.80 1wvb h LEU 80 Cb 0.50 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 1wvb h LEU 80 CO -0.20 0.14 -0.07 0.00 -0.34 0.00 0.00 178.44 177.96 1wvb h ALA 81 N 1.62 -0.12 -0.04 1.25 0.00 0.54 -1.03 119.26 121.48 1wvb h ALA 81 Ca 0.56 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1wvb h ALA 81 Cb 1.32 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1wvb h ALA 81 CO -0.28 -0.58 0.00 0.41 0.00 0.00 0.00 179.25 178.79 1wvb n GLY 82 N -1.19 -2.71 0.31 0.00 0.00 -0.33 -2.89 105.19 98.39 1wvb n GLY 82 Ca -0.07 0.22 -0.00 0.00 0.00 0.00 0.00 46.02 46.17 1wvb n GLY 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wvb n LYS 83 N -2.35 -0.17 0.29 1.61 4.01 -1.07 0.14 118.16 120.62 1wvb n LYS 83 Ca 0.00 1.24 0.18 0.00 -0.51 0.00 0.00 58.31 59.22 1wvb n LYS 83 Cb 0.00 -1.83 0.95 0.00 -0.51 0.00 0.00 35.03 33.63 1wvb n LYS 83 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 1wvb h VAL 84 N 0.00 0.18 0.00 -0.18 2.07 -1.06 0.49 116.25 117.76 1wvb h VAL 84 Ca 0.29 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.63 1wvb h VAL 84 Cb 0.49 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 1wvb h VAL 84 CO -0.80 0.00 -1.05 0.00 0.02 0.00 0.00 177.57 175.74 1wvb h ALA 85 N 1.70 0.58 -0.33 1.67 0.00 -0.16 -2.92 119.26 119.79 1wvb h ALA 85 Ca 0.03 -0.86 -0.15 0.00 0.00 0.00 0.00 54.91 53.94 1wvb h ALA 85 Cb 0.40 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1wvb h ALA 85 CO -0.00 1.06 -0.38 1.49 0.00 0.00 0.00 179.25 181.42 1wvb h GLU 86 N 0.00 0.78 -0.08 0.00 4.57 0.16 0.23 114.58 120.24 1wvb h GLU 86 Ca -0.08 -0.40 -0.23 0.00 -1.18 0.00 0.00 59.36 57.47 1wvb h GLU 86 Cb 1.66 0.01 0.01 0.00 -0.16 0.00 0.00 28.75 30.27 1wvb h GLU 86 CO 0.09 1.03 -0.85 -0.39 -1.18 0.00 0.00 179.01 177.70 1wvb h VAL 87 N 0.64 1.31 0.00 0.32 -1.51 -1.52 0.63 116.25 116.12 1wvb h VAL 87 Ca 0.06 -2.13 0.00 0.00 -1.23 0.00 0.00 66.70 63.40 1wvb h VAL 87 Cb 0.93 2.15 0.00 0.00 -2.13 0.00 0.00 31.29 32.25 1wvb h VAL 87 CO 0.09 0.66 0.00 1.17 -1.23 0.00 0.00 177.57 178.26 1wvb n LYS 88 N -3.87 0.20 0.11 5.19 3.00 -1.10 -0.93 118.16 120.75 1wvb n LYS 88 Ca -0.08 0.42 -0.20 0.00 -0.00 0.00 0.00 58.31 58.46 1wvb n LYS 88 Cb 0.78 -1.88 -0.15 0.00 0.00 0.00 0.00 35.03 33.79 1wvb n LYS 88 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 1wvb h LYS 89 N 0.00 0.37 -0.92 1.64 3.64 0.07 -3.13 116.57 118.23 1wvb h LYS 89 Ca 0.00 -0.63 -0.09 0.00 -1.27 0.00 0.00 60.65 58.66 1wvb h LYS 89 Cb 0.38 0.24 -0.06 0.00 -0.41 0.00 0.00 32.23 32.38 1wvb h LYS 89 CO 0.00 1.28 0.12 0.09 -2.27 0.00 0.00 179.45 178.67 1wvb n ASN 90 N -3.58 2.99 -3.76 4.20 3.02 0.16 -4.86 115.26 113.43 1wvb n ASN 90 Ca -0.14 -2.46 -0.27 0.00 -0.03 0.00 0.00 54.58 51.68 1wvb n ASN 90 Cb 1.06 -0.59 0.02 0.00 -0.61 0.00 0.00 39.78 39.66 1wvb n ASN 90 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wvb n GLY 91 N 0.07 -0.60 3.13 7.41 0.00 -1.15 -4.99 105.19 109.05 1wvb n GLY 91 Ca 0.16 0.29 -0.11 0.00 0.00 0.00 0.00 46.02 46.36 1wvb n GLY 91 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wvb s ARG 92 N -6.12 0.71 0.15 1.61 0.52 -0.11 -4.58 118.95 111.13 1wvb s ARG 92 Ca 0.22 -1.13 -0.30 0.00 -0.52 0.00 0.00 55.73 54.00 1wvb s ARG 92 Cb -0.08 -0.19 -0.07 0.00 0.52 0.00 0.00 34.95 35.14 1wvb s ARG 92 CO 0.86 -0.01 1.08 0.42 0.02 0.00 0.00 175.30 177.67 1wvb s ILE 93 N -2.91 4.02 -0.23 1.52 -1.09 0.37 -3.80 121.20 119.07 1wvb s ILE 93 Ca 0.04 1.69 -0.23 0.00 -2.23 0.00 0.00 60.65 59.92 1wvb s ILE 93 Cb 0.00 -4.08 -0.01 0.00 -1.58 0.00 0.00 42.46 36.80 1wvb s ILE 93 CO -0.04 0.27 0.77 -0.94 -1.23 0.00 0.00 174.94 173.77 1wvb s SER 94 N 0.05 6.78 -0.32 3.58 1.04 0.06 0.11 113.70 124.99 1wvb s SER 94 Ca 0.50 0.96 -0.03 0.00 0.48 0.00 0.00 55.95 57.86 1wvb s SER 94 Cb -0.28 -2.41 0.06 0.00 0.10 0.00 0.00 66.02 63.49 1wvb s SER 94 CO 0.33 -0.45 0.05 -0.22 0.98 0.00 0.00 173.24 173.93 1wvb s LEU 95 N 2.60 4.19 -0.52 2.42 0.20 0.84 0.89 118.68 129.30 1wvb s LEU 95 Ca 0.33 -1.39 -0.05 0.00 0.69 0.00 0.00 54.13 53.70 1wvb s LEU 95 Cb -0.16 -1.75 0.14 0.00 -0.43 0.00 0.00 46.19 43.99 1wvb s LEU 95 CO 0.08 -0.32 0.35 -0.69 -0.29 0.00 0.00 176.35 175.49 1wvb s VAL 96 N 1.25 3.83 -0.73 1.68 1.01 0.18 -2.14 120.40 125.47 1wvb s VAL 96 Ca -0.02 -2.29 -0.26 0.00 0.00 0.00 0.00 61.98 59.41 1wvb s VAL 96 Cb -0.20 -3.53 0.01 0.00 0.00 0.00 0.00 36.38 32.66 1wvb s VAL 96 CO -0.01 -0.80 1.50 -0.76 0.00 0.00 0.00 175.10 175.04 1wvb s LEU 97 N 0.77 3.23 0.00 3.92 1.43 -1.23 -0.26 118.68 126.53 1wvb s LEU 97 Ca 0.11 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 52.92 1wvb s LEU 97 Cb -0.22 -2.55 0.00 0.00 0.03 0.00 0.00 46.19 43.45 1wvb s LEU 97 CO -0.03 -2.02 0.00 0.61 0.23 0.00 0.00 176.35 175.14 1wvb n GLY 98 N 5.65 0.44 0.00 -3.19 0.00 0.44 -2.75 105.19 105.79 1wvb n GLY 98 Ca 0.12 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.29 1wvb n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wvb n GLY 99 N 5.00 0.63 3.87 -0.02 0.00 -1.07 -4.34 105.19 109.26 1wvb n GLY 99 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1wvb n GLY 99 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1wvb s ASP 100 N 0.31 6.64 0.00 1.61 1.47 -0.97 -0.99 116.67 124.74 1wvb s ASP 100 Ca 0.00 0.88 0.00 0.00 1.18 0.00 0.00 52.55 54.61 1wvb s ASP 100 Cb 0.00 -2.21 0.00 0.00 -0.34 0.00 0.00 42.92 40.37 1wvb s ASP 100 CO 0.00 -0.01 0.04 1.57 0.68 0.00 0.00 175.17 177.46 1wvb n HIS 101 N 0.14 0.00 0.06 2.11 -0.00 -1.26 -2.41 115.22 113.85 1wvb n HIS 101 Ca -0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 57.72 57.68 1wvb n HIS 101 Cb 0.52 -0.00 -0.07 0.00 -0.00 0.00 0.00 29.99 30.44 1wvb n HIS 101 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1wvb h SER 102 N 0.56 0.00 0.00 0.26 4.64 -1.82 -3.26 113.55 113.93 1wvb h SER 102 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1wvb h SER 102 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1wvb h SER 102 CO 0.00 0.72 0.02 -0.07 -0.87 0.00 0.00 176.83 176.63 1wvb h LEU 103 N 0.00 0.00 -1.63 5.97 3.38 -1.85 -2.42 115.31 118.76 1wvb h LEU 103 Ca -0.11 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.04 1wvb h LEU 103 Cb 1.64 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.34 1wvb h LEU 103 CO 0.07 0.00 0.54 0.00 0.09 0.00 0.00 178.44 179.14 1wvb h ALA 104 N 1.95 2.25 -0.72 1.53 0.00 -1.82 0.86 119.26 123.30 1wvb h ALA 104 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1wvb h ALA 104 Cb 0.04 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1wvb h ALA 104 CO 0.00 -0.48 0.45 0.82 0.00 0.00 0.00 179.25 180.04 1wvb h ILE 105 N 0.34 1.08 0.38 0.00 2.04 -1.71 -2.41 117.51 117.24 1wvb h ILE 105 Ca 0.40 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.94 1wvb h ILE 105 Cb 1.06 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1wvb h ILE 105 CO -0.12 0.16 -0.18 1.23 0.00 0.00 0.00 178.15 179.24 1wvb h GLY 106 N 0.87 -0.53 -0.09 5.37 0.00 0.55 -2.69 103.07 106.54 1wvb h GLY 106 Ca 0.30 0.20 0.02 0.00 0.00 0.00 0.00 47.33 47.84 1wvb h GLY 106 CO -0.12 -0.19 -0.29 0.23 0.00 0.00 0.00 176.54 176.16 1wvb h SER 107 N -0.87 -0.93 -0.08 0.19 0.87 -1.15 -0.52 113.55 111.06 1wvb h SER 107 Ca -0.05 0.11 0.02 0.00 -1.23 0.00 0.00 61.79 60.64 1wvb h SER 107 Cb 0.54 0.36 -0.00 0.00 -0.44 0.00 0.00 62.40 62.86 1wvb h SER 107 CO 0.09 -0.25 0.30 0.40 -0.53 0.00 0.00 176.83 176.83 1wvb h ILE 108 N -0.30 0.10 0.17 2.23 2.04 -1.56 -1.99 117.51 118.20 1wvb h ILE 108 Ca 0.02 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 1wvb h ILE 108 Cb 0.35 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1wvb h ILE 108 CO -0.24 0.00 -0.08 0.28 0.00 0.00 0.00 178.15 178.11 1wvb h SER 109 N 0.00 -0.19 -0.63 1.72 0.02 -0.75 -1.99 113.55 111.73 1wvb h SER 109 Ca 0.04 0.01 0.09 0.00 -0.84 0.00 0.00 61.79 61.08 1wvb h SER 109 Cb 0.63 0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.18 1wvb h SER 109 CO -0.00 -0.00 0.42 1.23 -1.14 0.00 0.00 176.83 177.34 1wvb h GLY 110 N -0.49 0.68 0.79 -3.77 0.00 -1.25 0.13 103.07 99.16 1wvb h GLY 110 Ca -0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 1wvb h GLY 110 CO 0.04 0.13 -0.13 0.84 0.00 0.00 0.00 176.54 177.41 1wvb h HIS 111 N 0.50 -0.35 -0.94 5.60 6.17 -1.47 -3.02 115.15 121.64 1wvb h HIS 111 Ca 0.29 -0.01 0.02 0.00 0.71 0.00 0.00 60.37 61.38 1wvb h HIS 111 Cb 0.47 0.11 -0.05 0.00 2.52 0.00 0.00 27.41 30.46 1wvb h HIS 111 CO -0.00 -0.07 0.62 0.00 0.71 0.00 0.00 177.93 179.18 1wvb h ALA 112 N 0.06 1.36 -1.11 5.26 0.00 -0.52 0.24 119.26 124.55 1wvb h ALA 112 Ca -0.04 -0.06 0.31 0.00 0.00 0.00 0.00 54.91 55.12 1wvb h ALA 112 Cb 0.43 -0.36 -0.09 0.00 0.00 0.00 0.00 17.79 17.76 1wvb h ALA 112 CO 0.06 0.58 0.73 0.00 0.00 0.00 0.00 179.25 180.62 1wvb h ARG 113 N 1.24 0.27 0.00 0.00 2.47 -0.66 0.22 114.38 117.92 1wvb h ARG 113 Ca 0.36 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 59.05 1wvb h ARG 113 Cb -0.09 -0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 28.17 1wvb h ARG 113 CO -0.09 0.18 -0.50 0.28 0.56 0.00 0.00 179.97 180.39 1wvb h VAL 114 N 0.28 0.04 -2.83 2.04 2.07 -1.02 -3.42 116.25 113.40 1wvb h VAL 114 Ca 0.62 -1.04 -0.71 0.00 0.82 0.00 0.00 66.70 66.39 1wvb h VAL 114 Cb 1.80 0.09 -0.35 0.00 -1.52 0.00 0.00 31.29 31.31 1wvb h VAL 114 CO -0.26 0.01 0.06 1.41 0.02 0.00 0.00 177.57 178.81 1wvb n HIS 115 N -4.62 3.41 0.00 1.57 8.25 0.69 -4.86 115.22 119.66 1wvb n HIS 115 Ca -0.08 -3.62 0.00 0.00 -0.26 0.00 0.00 57.72 53.77 1wvb n HIS 115 Cb 0.26 -1.01 0.00 0.00 1.12 0.00 0.00 29.99 30.37 1wvb n HIS 115 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1wvb n PRO 116 N 1.51 0.00 0.00 -0.41 -0.04 0.72 -0.98 135.00 135.80 1wvb n PRO 116 Ca 0.26 0.34 0.13 0.00 -0.04 0.00 0.00 63.50 64.18 1wvb n PRO 116 Cb 0.37 -1.61 0.32 0.00 -0.04 0.00 0.00 33.50 32.54 1wvb n PRO 116 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1wvb n ASP 117 N -1.32 1.78 -4.38 3.54 5.75 -1.26 -4.93 116.55 115.72 1wvb n ASP 117 Ca 0.00 -1.46 -0.33 0.00 -0.01 0.00 0.00 54.79 53.00 1wvb n ASP 117 Cb 0.11 0.10 0.14 0.00 -1.03 0.00 0.00 41.12 40.44 1wvb n ASP 117 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1wvb n LEU 118 N 0.20 -0.85 -4.35 -2.12 -0.00 -0.16 -4.44 117.00 105.28 1wvb n LEU 118 Ca 0.15 0.18 -0.28 0.00 -0.00 0.00 0.00 56.01 56.05 1wvb n LEU 118 Cb 0.42 -1.13 -0.13 0.00 -0.00 0.00 0.00 43.42 42.58 1wvb n LEU 118 CO 0.20 -3.43 -0.56 -0.83 -0.00 0.00 0.00 177.39 172.78 1wvb s GLY 119 N -1.98 1.45 0.01 1.47 0.00 0.46 -4.90 107.32 103.83 1wvb s GLY 119 Ca 0.57 -1.36 0.06 0.00 0.00 0.00 0.00 44.72 43.99 1wvb s GLY 119 CO 0.67 -1.32 -0.19 0.14 0.00 0.00 0.00 173.10 172.40 1wvb s VAL 120 N -1.01 2.72 -0.28 1.40 1.01 -0.60 0.82 120.40 124.47 1wvb s VAL 120 Ca 0.12 -1.07 0.02 0.00 0.00 0.00 0.00 61.98 61.05 1wvb s VAL 120 Cb -0.10 -2.10 0.07 0.00 0.00 0.00 0.00 36.38 34.26 1wvb s VAL 120 CO 0.05 0.44 -0.03 -0.63 0.00 0.00 0.00 175.10 174.93 1wvb s ILE 121 N -0.83 1.85 -0.73 2.22 1.09 0.13 -1.21 121.20 123.71 1wvb s ILE 121 Ca 0.13 -1.65 -0.16 0.00 -1.10 0.00 0.00 60.65 57.87 1wvb s ILE 121 Cb -0.10 -2.16 0.17 0.00 -1.06 0.00 0.00 42.46 39.31 1wvb s ILE 121 CO 0.03 -0.27 0.73 0.86 -0.10 0.00 0.00 174.94 176.20 1wvb s TRP 122 N 1.20 3.45 -0.34 3.97 -0.11 0.25 -0.91 118.94 126.45 1wvb s TRP 122 Ca -0.01 -1.60 -0.25 0.00 1.22 0.00 0.00 56.10 55.47 1wvb s TRP 122 Cb -0.19 -3.90 0.01 0.00 -1.50 0.00 0.00 33.47 27.89 1wvb s TRP 122 CO -0.08 -1.10 0.86 0.08 -4.62 0.00 0.00 176.95 172.09 1wvb s VAL 123 N 1.19 4.69 -0.20 5.86 1.01 -0.67 -0.77 120.40 131.51 1wvb s VAL 123 Ca 0.15 1.19 -0.30 0.00 0.00 0.00 0.00 61.98 63.02 1wvb s VAL 123 Cb -0.17 -4.24 0.15 0.00 0.00 0.00 0.00 36.38 32.12 1wvb s VAL 123 CO -0.04 -0.39 1.14 -0.62 0.00 0.00 0.00 175.10 175.20 1wvb s ASP 124 N 1.73 -0.23 0.00 3.32 -1.08 0.15 -1.45 116.67 119.12 1wvb s ASP 124 Ca 0.35 0.21 0.29 0.00 -0.52 0.00 0.00 52.55 52.88 1wvb s ASP 124 Cb -0.13 0.19 1.28 0.00 -1.46 0.00 0.00 42.92 42.80 1wvb s ASP 124 CO 0.15 -0.23 1.94 0.00 0.52 0.00 0.00 175.17 177.55 1wvb n ALA 125 N 0.51 2.34 -2.58 3.66 0.00 -1.23 -2.04 120.51 121.18 1wvb n ALA 125 Ca -0.05 -0.11 -0.22 0.00 0.00 0.00 0.00 53.44 53.06 1wvb n ALA 125 Cb 0.58 -1.47 -0.13 0.00 0.00 0.00 0.00 19.45 18.44 1wvb n ALA 125 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1wvb s HIS 126 N -2.91 1.55 0.20 0.00 3.76 -1.26 -1.23 115.29 115.40 1wvb s HIS 126 Ca 0.17 -0.40 -0.00 0.00 -0.15 0.00 0.00 55.06 54.67 1wvb s HIS 126 Cb 0.19 -0.89 0.12 0.00 1.11 0.00 0.00 32.58 33.12 1wvb s HIS 126 CO 0.51 0.11 1.49 1.79 -0.85 0.00 0.00 174.74 177.79 1wvb h THR 127 N 4.28 1.37 -5.99 1.30 1.35 -1.87 -3.48 112.91 109.87 1wvb h THR 127 Ca -0.42 -2.00 -0.41 0.00 -0.55 0.00 0.00 66.41 63.02 1wvb h THR 127 Cb 1.18 1.99 0.08 0.00 -1.73 0.00 0.00 68.15 69.67 1wvb h THR 127 CO 0.42 0.60 -0.76 0.47 -0.25 0.00 0.00 175.52 176.00 1wvb n ASP 128 N -3.88 -3.65 -0.79 5.36 8.00 -1.26 -4.78 116.55 115.54 1wvb n ASP 128 Ca -0.03 -0.69 0.06 0.00 0.71 0.00 0.00 54.79 54.83 1wvb n ASP 128 Cb 0.65 -4.50 0.14 0.00 -0.02 0.00 0.00 41.12 37.40 1wvb n ASP 128 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wvb n ILE 129 N -4.54 1.46 -2.73 0.53 3.06 -1.21 -1.54 119.36 114.39 1wvb n ILE 129 Ca -0.13 -2.38 -0.34 0.00 -2.50 0.00 0.00 62.75 57.40 1wvb n ILE 129 Cb 0.61 0.14 -0.06 0.00 0.54 0.00 0.00 39.64 40.86 1wvb n ILE 129 CO 0.00 0.00 0.00 0.20 -2.50 0.00 0.00 176.55 174.25 1wvb s ASN 130 N -2.75 6.90 0.52 9.51 0.01 -1.09 -4.54 114.94 123.49 1wvb s ASN 130 Ca 0.34 1.81 0.06 0.00 -0.71 0.00 0.00 52.86 54.36 1wvb s ASN 130 Cb 0.35 -2.56 0.05 0.00 0.41 0.00 0.00 41.25 39.50 1wvb s ASN 130 CO -0.08 -0.39 0.71 0.42 -1.51 0.00 0.00 177.10 176.25 1wvb s THR 131 N -1.96 2.63 -0.32 1.60 -4.23 -1.26 -4.30 115.64 107.80 1wvb s THR 131 Ca 0.60 -0.89 0.22 0.00 -1.18 0.00 0.00 61.69 60.44 1wvb s THR 131 Cb -0.14 -2.75 0.23 0.00 1.34 0.00 0.00 72.50 71.18 1wvb s THR 131 CO 0.18 0.00 1.68 -2.65 -0.54 0.00 0.00 174.62 173.29 1wvb n PRO 132 N -2.15 0.16 -0.03 3.99 -0.02 -1.26 -1.59 135.00 134.10 1wvb n PRO 132 Ca 0.11 0.55 0.07 0.00 -2.02 0.00 0.00 63.50 62.21 1wvb n PRO 132 Cb 0.60 -1.92 0.08 0.00 -0.02 0.00 0.00 33.50 32.23 1wvb n PRO 132 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1wvb n LEU 133 N -2.25 2.31 -0.00 2.45 4.77 -1.26 -4.52 117.00 118.50 1wvb n LEU 133 Ca -0.00 -1.14 0.00 0.00 -0.03 0.00 0.00 56.01 54.85 1wvb n LEU 133 Cb 0.11 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.15 1wvb n LEU 133 CO 0.14 0.45 -0.52 0.35 -1.33 0.00 0.00 177.39 176.47 1wvb n THR 134 N 0.79 0.03 -1.66 -5.08 -2.24 -0.79 -5.03 114.28 100.31 1wvb n THR 134 Ca 0.09 -0.04 -0.48 0.00 -2.27 0.00 0.00 64.05 61.36 1wvb n THR 134 Cb 0.37 -0.04 -0.05 0.00 -2.10 0.00 0.00 70.33 68.51 1wvb n THR 134 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1wvb n THR 135 N -1.72 0.10 -0.08 4.28 5.66 -0.62 -4.86 114.28 117.04 1wvb n THR 135 Ca -0.01 -0.02 -0.06 0.00 -3.05 0.00 0.00 64.05 60.91 1wvb n THR 135 Cb 0.21 -1.46 -0.02 0.00 -1.55 0.00 0.00 70.33 67.51 1wvb n THR 135 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1wvb n THR 136 N 3.56 1.44 -0.37 1.09 -2.24 -1.26 -4.32 114.28 112.19 1wvb n THR 136 Ca 0.18 0.19 0.04 0.00 -2.27 0.00 0.00 64.05 62.19 1wvb n THR 136 Cb 0.27 -2.37 0.19 0.00 -2.10 0.00 0.00 70.33 66.31 1wvb n THR 136 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1wvb h SER 137 N -1.00 1.02 0.00 3.42 4.64 -1.98 -3.46 113.55 116.19 1wvb h SER 137 Ca -0.01 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1wvb h SER 137 Cb 0.67 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1wvb h SER 137 CO -0.00 0.62 0.00 0.61 -0.87 0.00 0.00 176.83 177.19 1wvb n GLY 138 N -1.36 0.75 3.83 -0.77 0.00 -1.26 -5.01 105.19 101.36 1wvb n GLY 138 Ca 0.16 -0.23 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 1wvb n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wvb s ASN 139 N -2.21 6.94 0.43 1.61 0.01 -1.26 -3.51 114.94 116.95 1wvb s ASN 139 Ca 0.00 1.13 0.24 0.00 -0.71 0.00 0.00 52.86 53.52 1wvb s ASN 139 Cb 0.00 -2.31 0.71 0.00 0.41 0.00 0.00 41.25 40.06 1wvb s ASN 139 CO 0.00 0.25 1.73 -0.07 -1.51 0.00 0.00 177.10 177.50 1wvb h LEU 140 N 4.35 0.00 0.00 0.60 3.38 -1.73 -3.17 115.31 118.74 1wvb h LEU 140 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1wvb h LEU 140 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1wvb h LEU 140 CO 0.63 0.18 0.00 0.00 0.09 0.00 0.00 178.44 179.34 1wvb n HIS 141 N -3.23 0.00 -1.39 1.13 1.44 0.18 -1.77 115.22 111.58 1wvb n HIS 141 Ca 0.01 0.00 0.04 0.00 -2.01 0.00 0.00 57.72 55.76 1wvb n HIS 141 Cb 0.49 -0.45 0.20 0.00 0.12 0.00 0.00 29.99 30.35 1wvb n HIS 141 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1wvb n GLY 142 N -0.80 4.91 0.00 -1.39 0.00 -1.20 -4.41 105.19 102.31 1wvb n GLY 142 Ca 0.02 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.81 1wvb n GLY 142 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1wvb n GLN 143 N -1.12 0.00 -0.30 1.61 6.02 -0.73 -2.68 117.38 120.19 1wvb n GLN 143 Ca 0.23 -0.03 0.13 0.00 -0.01 0.00 0.00 57.00 57.31 1wvb n GLN 143 Cb 0.81 -0.49 0.28 0.00 1.02 0.00 0.00 30.24 31.87 1wvb n GLN 143 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1wvb h PRO 144 N 0.00 0.19 -0.93 -1.09 0.13 -1.58 -2.17 132.00 126.56 1wvb h PRO 144 Ca 0.00 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 65.13 1wvb h PRO 144 Cb 0.54 -0.04 -0.05 0.00 0.13 0.00 0.00 31.00 31.58 1wvb h PRO 144 CO 0.00 0.12 0.61 0.28 -0.23 0.00 0.00 178.00 178.79 1wvb h VAL 145 N 0.19 1.23 0.00 1.56 2.07 -1.58 -2.29 116.25 117.43 1wvb h VAL 145 Ca 0.55 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.64 1wvb h VAL 145 Cb 1.10 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1wvb h VAL 145 CO -0.67 0.23 0.00 0.77 0.02 0.00 0.00 177.57 177.92 1wvb h SER 146 N 1.25 0.00 0.74 0.57 4.64 -1.55 -0.21 113.55 118.99 1wvb h SER 146 Ca 0.34 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.42 1wvb h SER 146 Cb -0.13 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 61.92 1wvb h SER 146 CO -0.08 0.00 -1.37 -0.26 -0.87 0.00 0.00 176.83 174.25 1wvb h PHE 147 N 0.00 0.00 0.00 4.77 -1.00 -1.49 -3.36 116.94 115.87 1wvb h PHE 147 Ca 0.00 0.00 -0.24 0.00 2.81 0.00 0.00 57.97 60.54 1wvb h PHE 147 Cb 0.10 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.62 1wvb h PHE 147 CO 0.00 0.92 -1.35 -0.07 -1.61 0.00 0.00 178.31 176.20 1wvb h LEU 148 N 0.00 0.00 -9.34 1.54 3.38 -1.15 -3.37 115.31 106.37 1wvb h LEU 148 Ca -0.16 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.26 1wvb h LEU 148 Cb 1.85 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.59 1wvb h LEU 148 CO 0.09 0.93 0.94 -0.22 0.09 0.00 0.00 178.44 180.27 1wvb s LEU 149 N -6.31 4.32 0.05 1.67 0.20 -0.21 -1.66 118.68 116.74 1wvb s LEU 149 Ca -0.02 2.19 -0.28 0.00 0.69 0.00 0.00 54.13 56.71 1wvb s LEU 149 Cb 0.09 -3.55 -0.17 0.00 -0.43 0.00 0.00 46.19 42.12 1wvb s LEU 149 CO 0.82 -0.81 1.48 0.11 -0.29 0.00 0.00 176.35 177.66 1wvb h LYS 150 N 8.42 -0.49 0.00 1.98 1.57 -1.57 -2.79 116.57 123.69 1wvb h LYS 150 Ca -0.38 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 1wvb h LYS 150 Cb 1.18 0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1wvb h LYS 150 CO 0.93 -0.24 0.05 0.93 -0.57 0.00 0.00 179.45 180.54 1wvb h GLU 151 N -0.65 0.00 0.00 3.15 3.07 -1.93 0.19 114.58 118.41 1wvb h GLU 151 Ca -0.05 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1wvb h GLU 151 Cb 0.47 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.38 1wvb h GLU 151 CO 0.09 0.00 -0.97 -0.11 -1.40 0.00 0.00 179.01 176.62 1wvb n LEU 152 N -2.35 0.62 -4.71 1.33 7.94 -1.07 -4.86 117.00 113.90 1wvb n LEU 152 Ca -0.02 0.01 -0.42 0.00 -1.11 0.00 0.00 56.01 54.47 1wvb n LEU 152 Cb 0.08 -0.11 -0.01 0.00 0.53 0.00 0.00 43.42 43.92 1wvb n LEU 152 CO 0.11 0.03 0.98 1.17 -1.11 0.00 0.00 177.39 178.57 1wvb n LYS 153 N -1.97 2.27 0.00 1.96 4.81 0.05 0.03 118.16 125.31 1wvb n LYS 153 Ca 0.02 0.80 0.00 0.00 -0.87 0.00 0.00 58.31 58.26 1wvb n LYS 153 Cb 0.43 -2.43 0.00 0.00 0.02 0.00 0.00 35.03 33.05 1wvb n LYS 153 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wvb n GLY 154 N 0.94 2.98 0.10 3.14 0.00 -1.26 -4.76 105.19 106.33 1wvb n GLY 154 Ca 0.05 -0.03 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 1wvb n GLY 154 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wvb h LYS 155 N 0.00 0.14 -6.45 1.61 1.79 -0.73 -3.45 116.57 109.47 1wvb h LYS 155 Ca 0.00 -0.24 -0.54 0.00 -2.18 0.00 0.00 60.65 57.69 1wvb h LYS 155 Cb 0.00 0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 1wvb h LYS 155 CO 0.00 0.91 0.44 0.42 -1.08 0.00 0.00 179.45 180.14 1wvb s ILE 156 N -2.61 4.51 0.40 1.86 -1.09 -1.14 -4.89 121.20 118.24 1wvb s ILE 156 Ca -0.08 1.83 -0.07 0.00 -2.23 0.00 0.00 60.65 60.10 1wvb s ILE 156 Cb 0.08 -4.17 0.09 0.00 -1.58 0.00 0.00 42.46 36.88 1wvb s ILE 156 CO 0.83 0.15 0.52 -0.81 -1.23 0.00 0.00 174.94 174.40 1wvb n PRO 157 N 3.81 -0.63 -3.25 2.79 -0.04 -1.26 -5.00 135.00 131.41 1wvb n PRO 157 Ca 0.07 -0.81 -0.46 0.00 -0.04 0.00 0.00 63.50 62.27 1wvb n PRO 157 Cb 0.49 -0.55 -0.05 0.00 -0.04 0.00 0.00 33.50 33.35 1wvb n PRO 157 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1wvb s ASP 158 N -2.91 6.25 -0.14 3.54 1.01 -1.26 -5.05 116.67 118.11 1wvb s ASP 158 Ca 0.30 -1.78 -0.06 0.00 0.71 0.00 0.00 52.55 51.72 1wvb s ASP 158 Cb -0.01 -2.24 -0.04 0.00 1.01 0.00 0.00 42.92 41.64 1wvb s ASP 158 CO 0.21 -0.91 0.07 -0.69 0.21 0.00 0.00 175.17 174.06 1wvb s VAL 159 N 1.78 4.85 0.10 -1.27 1.01 -1.26 -5.06 120.40 120.54 1wvb s VAL 159 Ca 0.07 -0.03 -0.36 0.00 0.00 0.00 0.00 61.98 61.66 1wvb s VAL 159 Cb -0.26 -3.13 -0.16 0.00 0.00 0.00 0.00 36.38 32.84 1wvb s VAL 159 CO 0.03 0.54 1.45 -2.65 0.00 0.00 0.00 175.10 174.47 1wvb n PRO 160 N 2.73 1.53 0.00 2.72 -0.02 -1.26 -2.39 135.00 138.30 1wvb n PRO 160 Ca -0.18 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 1wvb n PRO 160 Cb 0.53 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 1wvb n PRO 160 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wvb n GLY 161 N 2.93 2.76 0.72 -1.23 0.00 -1.26 -2.94 105.19 106.17 1wvb n GLY 161 Ca 0.18 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.24 1wvb n GLY 161 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1wvb n PHE 162 N -0.93 0.23 -0.08 1.61 3.01 -1.01 -4.19 117.46 116.10 1wvb n PHE 162 Ca 0.00 -1.55 0.02 0.00 1.01 0.00 0.00 57.45 56.93 1wvb n PHE 162 Cb 0.00 -0.27 0.35 0.00 -0.01 0.00 0.00 39.48 39.55 1wvb n PHE 162 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1wvb h SER 163 N 1.08 0.62 0.23 4.37 4.64 -1.94 -2.34 113.55 120.22 1wvb h SER 163 Ca 0.04 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.31 1wvb h SER 163 Cb 1.07 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1wvb h SER 163 CO 0.07 0.46 -0.11 4.11 -0.87 0.00 0.00 176.83 180.49 1wvb h TRP 164 N 0.73 0.00 -3.51 4.77 5.08 -1.98 -3.44 115.95 117.60 1wvb h TRP 164 Ca 0.20 0.00 -0.53 0.00 1.08 0.00 0.00 58.89 59.64 1wvb h TRP 164 Cb -0.07 0.00 0.07 0.00 -3.00 0.00 0.00 29.16 26.16 1wvb h TRP 164 CO 0.00 0.11 0.77 0.08 -1.28 0.00 0.00 178.44 178.12 1wvb s VAL 165 N -4.43 2.46 -0.12 0.12 1.01 -0.88 -5.02 120.40 113.55 1wvb s VAL 165 Ca -0.04 0.40 -0.02 0.00 0.00 0.00 0.00 61.98 62.33 1wvb s VAL 165 Cb 0.14 -3.26 0.04 0.00 0.00 0.00 0.00 36.38 33.30 1wvb s VAL 165 CO 0.61 0.07 -0.00 -0.89 0.00 0.00 0.00 175.10 174.89 1wvb s THR 166 N -0.31 0.55 -0.32 3.92 2.01 -1.26 -5.09 115.64 115.15 1wvb s THR 166 Ca 0.58 -0.17 -0.40 0.00 0.31 0.00 0.00 61.69 62.01 1wvb s THR 166 Cb -0.43 -0.79 -0.15 0.00 0.01 0.00 0.00 72.50 71.13 1wvb s THR 166 CO 0.48 0.13 1.84 -2.65 -0.69 0.00 0.00 174.62 173.74 1wvb n PRO 167 N 5.07 1.02 -0.11 4.92 -0.02 -1.26 -4.87 135.00 139.75 1wvb n PRO 167 Ca -0.09 0.36 -0.25 0.00 -2.02 0.00 0.00 63.50 61.50 1wvb n PRO 167 Cb 0.49 -2.10 -0.11 0.00 -0.02 0.00 0.00 33.50 31.76 1wvb n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wvb s ILE 169 N -2.48 5.24 0.17 0.00 -5.25 -1.10 -4.91 121.20 112.87 1wvb s ILE 169 Ca -0.34 -0.02 0.04 0.00 -0.99 0.00 0.00 60.65 59.34 1wvb s ILE 169 Cb 0.11 -3.62 -0.04 0.00 2.95 0.00 0.00 42.46 41.86 1wvb s ILE 169 CO 0.56 0.13 0.20 -0.94 -1.79 0.00 0.00 174.94 173.11 1wvb s SER 170 N -2.29 5.84 0.47 4.36 1.04 -1.26 -1.54 113.70 120.32 1wvb s SER 170 Ca 0.37 -0.03 0.31 0.00 0.48 0.00 0.00 55.95 57.08 1wvb s SER 170 Cb -0.13 -1.62 1.41 0.00 0.10 0.00 0.00 66.02 65.78 1wvb s SER 170 CO 0.24 0.04 1.72 0.00 0.98 0.00 0.00 173.24 176.22 1wvb h ALA 171 N 2.16 2.84 -0.10 5.32 0.00 -1.97 0.64 119.26 128.16 1wvb h ALA 171 Ca -0.48 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1wvb h ALA 171 Cb 1.20 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1wvb h ALA 171 CO 0.65 -1.31 0.00 0.36 0.00 0.00 0.00 179.25 178.95 1wvb n LYS 172 N -4.42 1.32 -0.09 0.00 2.85 -1.26 -4.03 118.16 112.52 1wvb n LYS 172 Ca 0.31 -0.48 0.07 0.00 -1.05 0.00 0.00 58.31 57.16 1wvb n LYS 172 Cb 1.28 -1.26 0.10 0.00 -0.65 0.00 0.00 35.03 34.50 1wvb n LYS 172 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1wvb n ASP 173 N -0.24 2.04 -4.17 -5.58 8.00 0.22 -5.00 116.55 111.83 1wvb n ASP 173 Ca 0.11 -2.77 -0.16 0.00 0.71 0.00 0.00 54.79 52.68 1wvb n ASP 173 Cb 0.16 -0.33 -0.11 0.00 -0.02 0.00 0.00 41.12 40.81 1wvb n ASP 173 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1wvb s ILE 174 N -2.26 0.97 -0.02 0.53 2.07 -1.25 -1.55 121.20 119.68 1wvb s ILE 174 Ca 0.23 -1.49 0.01 0.00 -1.41 0.00 0.00 60.65 57.99 1wvb s ILE 174 Cb 0.20 -1.20 0.02 0.00 0.13 0.00 0.00 42.46 41.61 1wvb s ILE 174 CO 0.02 -0.44 -0.02 -0.69 -1.91 0.00 0.00 174.94 171.90 1wvb s VAL 175 N -1.98 0.30 -0.14 4.00 1.01 -0.35 -4.07 120.40 119.17 1wvb s VAL 175 Ca 0.02 -0.05 -0.08 0.00 0.00 0.00 0.00 61.98 61.87 1wvb s VAL 175 Cb -0.06 -0.33 -0.04 0.00 0.00 0.00 0.00 36.38 35.95 1wvb s VAL 175 CO 0.01 0.14 0.14 -0.31 0.00 0.00 0.00 175.10 175.08 1wvb s TYR 176 N 0.61 3.55 -0.04 5.22 2.02 -0.96 0.84 117.35 128.59 1wvb s TYR 176 Ca -0.07 0.48 -0.00 0.00 -0.37 0.00 0.00 57.07 57.11 1wvb s TYR 176 Cb -0.10 -2.00 0.03 0.00 -0.40 0.00 0.00 41.96 39.49 1wvb s TYR 176 CO -0.01 0.62 0.01 0.42 -1.57 0.00 0.00 175.55 175.02 1wvb s ILE 177 N -0.66 0.22 0.00 2.71 1.01 0.05 -0.25 121.20 124.28 1wvb s ILE 177 Ca 0.13 0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.92 1wvb s ILE 177 Cb -0.12 -0.35 0.00 0.00 0.01 0.00 0.00 42.46 42.00 1wvb s ILE 177 CO 0.03 0.19 0.00 0.61 0.00 0.00 0.00 174.94 175.77 1wvb n GLY 178 N 4.61 1.04 3.73 6.18 0.00 -0.83 -0.67 105.19 119.25 1wvb n GLY 178 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1wvb n GLY 178 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wvb s LEU 179 N 0.00 4.39 0.00 0.99 1.43 -0.87 -3.47 118.68 121.15 1wvb s LEU 179 Ca 0.00 2.55 0.00 0.00 -1.03 0.00 0.00 54.13 55.65 1wvb s LEU 179 Cb 0.00 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.61 1wvb s LEU 179 CO 0.00 -0.68 0.09 -2.11 0.23 0.00 0.00 176.35 173.88 1wvb n ARG 180 N 2.92 0.00 -2.99 1.70 1.85 -0.37 -0.74 116.66 119.04 1wvb n ARG 180 Ca 0.09 -0.09 -0.14 0.00 -1.00 0.00 0.00 57.85 56.71 1wvb n ARG 180 Cb 0.41 -0.10 -0.02 0.00 -1.05 0.00 0.00 32.46 31.69 1wvb n ARG 180 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1wvb n ASP 181 N 0.00 -2.01 -4.60 2.89 2.03 -0.93 -5.07 116.55 108.87 1wvb n ASP 181 Ca 0.00 -2.82 -0.35 0.00 0.52 0.00 0.00 54.79 52.14 1wvb n ASP 181 Cb 0.47 0.80 -0.10 0.00 -0.72 0.00 0.00 41.12 41.57 1wvb n ASP 181 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1wvb s VAL 182 N 0.30 4.63 0.51 5.18 1.01 -1.26 -4.58 120.40 126.20 1wvb s VAL 182 Ca 0.32 -0.09 -0.22 0.00 0.00 0.00 0.00 61.98 62.00 1wvb s VAL 182 Cb 0.09 -3.09 -0.06 0.00 0.00 0.00 0.00 36.38 33.32 1wvb s VAL 182 CO -0.14 0.45 1.22 -1.81 0.00 0.00 0.00 175.10 174.82 1wvb s ASP 183 N 0.50 5.73 0.43 3.32 1.01 -1.26 -4.71 116.67 121.69 1wvb s ASP 183 Ca 0.02 2.43 0.26 0.00 0.71 0.00 0.00 52.55 55.97 1wvb s ASP 183 Cb -0.13 -2.61 1.30 0.00 1.01 0.00 0.00 42.92 42.49 1wvb s ASP 183 CO 0.01 -1.23 1.71 -0.65 0.21 0.00 0.00 175.17 175.22 1wvb h PRO 184 N 1.62 0.21 0.07 8.23 0.11 -1.99 0.48 132.00 140.73 1wvb h PRO 184 Ca -0.50 -0.01 -0.25 0.00 0.11 0.00 0.00 66.00 65.35 1wvb h PRO 184 Cb 1.27 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1wvb h PRO 184 CO 0.58 0.14 -1.19 0.78 -0.21 0.00 0.00 178.00 178.10 1wvb h GLY 185 N 0.22 0.17 1.09 -0.55 0.00 -1.94 -2.96 103.07 99.10 1wvb h GLY 185 Ca 0.69 -0.43 -0.13 0.00 0.00 0.00 0.00 47.33 47.45 1wvb h GLY 185 CO -0.30 0.38 -0.23 0.83 0.00 0.00 0.00 176.54 177.22 1wvb h GLU 186 N 0.04 0.96 -0.75 4.80 5.08 -0.54 -1.79 114.58 122.39 1wvb h GLU 186 Ca -0.10 -0.43 -0.05 0.00 -1.00 0.00 0.00 59.36 57.79 1wvb h GLU 186 Cb 1.90 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 31.09 1wvb h GLU 186 CO 0.16 1.09 0.28 1.25 -1.00 0.00 0.00 179.01 180.80 1wvb h HIS 187 N 0.81 1.14 -0.45 4.33 2.76 -0.76 0.06 115.15 123.04 1wvb h HIS 187 Ca 0.10 -0.09 -0.03 0.00 -2.20 0.00 0.00 60.37 58.16 1wvb h HIS 187 Cb 0.81 -0.34 -0.02 0.00 1.55 0.00 0.00 27.41 29.41 1wvb h HIS 187 CO 0.06 0.87 0.17 -0.92 -1.30 0.00 0.00 177.93 176.81 1wvb h TYR 188 N 1.09 0.65 -0.16 5.26 3.20 -1.31 -1.73 116.97 123.96 1wvb h TYR 188 Ca 0.25 -0.03 -0.07 0.00 3.14 0.00 0.00 58.73 62.02 1wvb h TYR 188 Cb 0.23 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 38.29 1wvb h TYR 188 CO 0.02 0.51 -0.16 0.82 -1.64 0.00 0.00 178.16 177.71 1wvb h ILE 189 N 0.65 1.34 -0.04 1.81 1.08 -0.61 -2.46 117.51 119.28 1wvb h ILE 189 Ca 0.16 -1.33 0.04 0.00 -0.39 0.00 0.00 64.86 63.34 1wvb h ILE 189 Cb 0.14 1.84 -0.06 0.00 -3.07 0.00 0.00 36.82 35.68 1wvb h ILE 189 CO -0.01 0.39 -0.33 -0.07 -0.69 0.00 0.00 178.15 177.44 1wvb h LEU 190 N 0.04 -1.01 -0.50 1.44 3.38 -0.30 -1.01 115.31 117.35 1wvb h LEU 190 Ca 0.03 0.14 -0.17 0.00 0.09 0.00 0.00 57.88 57.97 1wvb h LEU 190 Cb 0.70 0.41 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 1wvb h LEU 190 CO 0.04 -0.38 -0.61 0.11 0.09 0.00 0.00 178.44 177.69 1wvb h LYS 191 N -0.46 0.48 -0.16 1.13 1.79 -1.45 -2.33 116.57 115.57 1wvb h LYS 191 Ca 0.07 -0.33 -0.15 0.00 -2.18 0.00 0.00 60.65 58.06 1wvb h LYS 191 Cb 0.57 0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.27 1wvb h LYS 191 CO -0.30 0.94 -0.49 1.15 -1.08 0.00 0.00 179.45 179.67 1wvb h THR 192 N 0.35 1.34 0.00 -0.16 2.02 -1.30 -3.20 112.91 111.96 1wvb h THR 192 Ca -0.01 -1.75 0.00 0.00 0.77 0.00 0.00 66.41 65.42 1wvb h THR 192 Cb 1.16 2.01 0.00 0.00 -1.74 0.00 0.00 68.15 69.58 1wvb h THR 192 CO 0.11 0.54 0.00 -0.07 0.37 0.00 0.00 175.52 176.47 1wvb h LEU 193 N 0.26 0.00 0.14 2.58 4.07 -1.27 -3.47 115.31 117.62 1wvb h LEU 193 Ca -0.02 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.86 1wvb h LEU 193 Cb 1.11 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.86 1wvb h LEU 193 CO 0.10 0.00 -0.11 0.61 -1.08 0.00 0.00 178.44 177.96 1wvb n GLY 194 N 0.77 0.33 3.76 0.83 0.00 -1.06 -4.87 105.19 104.96 1wvb n GLY 194 Ca 0.04 -0.66 -0.41 0.00 0.00 0.00 0.00 46.02 45.00 1wvb n GLY 194 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wvb s ILE 195 N -2.45 3.22 -0.05 -0.61 1.01 -0.90 -4.86 121.20 116.56 1wvb s ILE 195 Ca 0.03 1.18 -0.29 0.00 0.00 0.00 0.00 60.65 61.57 1wvb s ILE 195 Cb -0.01 -3.75 -0.02 0.00 0.01 0.00 0.00 42.46 38.68 1wvb s ILE 195 CO 0.04 0.26 0.96 -0.75 0.00 0.00 0.00 174.94 175.46 1wvb s LYS 196 N -1.28 4.49 -0.08 2.79 2.47 -1.26 -4.89 119.74 121.98 1wvb s LYS 196 Ca 0.48 1.35 -0.15 0.00 -1.56 0.00 0.00 55.97 56.09 1wvb s LYS 196 Cb -0.35 -3.50 0.03 0.00 -1.46 0.00 0.00 37.83 32.56 1wvb s LYS 196 CO 0.44 -0.16 0.37 1.52 0.16 0.00 0.00 175.35 177.68 1wvb s TYR 197 N 1.44 -0.33 -0.47 4.03 -0.85 -1.26 -2.26 117.35 117.65 1wvb s TYR 197 Ca 0.49 0.71 0.04 0.00 -0.52 0.00 0.00 57.07 57.78 1wvb s TYR 197 Cb -0.19 0.14 0.12 0.00 0.38 0.00 0.00 41.96 42.41 1wvb s TYR 197 CO 0.23 -0.31 0.21 -0.06 -1.52 0.00 0.00 175.55 174.10 1wvb s PHE 198 N -0.55 3.16 1.02 -3.49 0.40 0.66 -4.92 117.98 114.26 1wvb s PHE 198 Ca -0.07 -3.05 -0.16 0.00 -0.60 0.00 0.00 56.93 53.05 1wvb s PHE 198 Cb -0.04 -2.74 0.21 0.00 0.51 0.00 0.00 43.02 40.96 1wvb s PHE 198 CO 0.03 -0.79 1.19 -1.54 0.70 0.00 0.00 175.22 174.81 1wvb s SER 199 N 0.03 2.57 0.65 1.36 1.04 -1.26 -1.96 113.70 116.12 1wvb s SER 199 Ca 0.16 0.62 0.41 0.00 0.48 0.00 0.00 55.95 57.61 1wvb s SER 199 Cb -0.24 -0.90 2.26 0.00 0.10 0.00 0.00 66.02 67.24 1wvb s SER 199 CO -0.02 -3.10 2.34 0.24 0.98 0.00 0.00 173.24 173.68 1wvb h MET 200 N -1.88 0.00 -0.70 4.02 2.86 -1.20 -0.93 114.93 117.09 1wvb h MET 200 Ca -0.47 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.14 1wvb h MET 200 Cb 1.29 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.92 1wvb h MET 200 CO 0.45 0.00 0.30 1.15 1.06 0.00 0.00 176.91 179.87 1wvb h THR 201 N 0.00 1.24 0.05 2.22 2.02 -1.90 -2.04 112.91 114.49 1wvb h THR 201 Ca -0.00 -0.73 -0.23 0.00 0.77 0.00 0.00 66.41 66.22 1wvb h THR 201 Cb 0.02 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 66.83 1wvb h THR 201 CO 0.00 0.30 -1.06 -0.33 0.37 0.00 0.00 175.52 174.80 1wvb h GLU 202 N 0.99 0.12 -0.13 6.66 3.07 -1.51 -2.23 114.58 121.56 1wvb h GLU 202 Ca 0.23 -0.19 -0.05 0.00 -0.50 0.00 0.00 59.36 58.85 1wvb h GLU 202 Cb 0.18 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.15 1wvb h GLU 202 CO -0.02 1.06 -0.17 0.28 -1.40 0.00 0.00 179.01 178.76 1wvb h VAL 203 N 0.04 1.19 -0.03 3.13 2.07 -1.32 0.26 116.25 121.58 1wvb h VAL 203 Ca -0.06 -0.84 -0.23 0.00 0.82 0.00 0.00 66.70 66.39 1wvb h VAL 203 Cb 1.79 1.28 0.01 0.00 -1.52 0.00 0.00 31.29 32.84 1wvb h VAL 203 CO 0.16 0.26 -0.91 0.44 0.02 0.00 0.00 177.57 177.54 1wvb h ASP 204 N 0.19 0.67 0.06 0.57 5.19 -1.28 0.12 116.42 121.94 1wvb h ASP 204 Ca 0.04 -0.50 -0.00 0.00 -0.62 0.00 0.00 57.03 55.94 1wvb h ASP 204 Cb 0.41 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.72 1wvb h ASP 204 CO 0.03 1.29 -0.03 -0.09 -3.12 0.00 0.00 179.24 177.32 1wvb h ARG 205 N 0.32 -0.07 0.00 3.56 2.43 -0.80 -3.36 114.38 116.45 1wvb h ARG 205 Ca -0.08 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1wvb h ARG 205 Cb 1.53 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 31.10 1wvb h ARG 205 CO 0.17 0.50 -1.03 1.28 -1.51 0.00 0.00 179.97 179.38 1wvb n LEU 206 N -4.83 0.76 -0.09 3.80 4.77 0.86 -5.09 117.00 117.19 1wvb n LEU 206 Ca -0.08 0.27 0.01 0.00 -0.03 0.00 0.00 56.01 56.18 1wvb n LEU 206 Cb 0.30 -0.07 -0.01 0.00 -2.33 0.00 0.00 43.42 41.32 1wvb n LEU 206 CO 0.31 -0.14 -0.04 0.61 -1.33 0.00 0.00 177.39 176.79 1wvb n GLY 207 N 1.22 -2.51 0.26 -0.72 0.00 0.41 -3.60 105.19 100.25 1wvb n GLY 207 Ca 0.00 -1.44 0.14 0.00 0.00 0.00 0.00 46.02 44.73 1wvb n GLY 207 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1wvb h ILE 208 N -0.08 0.24 -0.33 -0.61 6.09 -1.93 -2.44 117.51 118.45 1wvb h ILE 208 Ca -0.01 -0.74 -0.01 0.00 -1.37 0.00 0.00 64.86 62.73 1wvb h ILE 208 Cb 0.08 1.59 -0.01 0.00 0.47 0.00 0.00 36.82 38.95 1wvb h ILE 208 CO 0.00 0.09 0.15 1.23 -3.07 0.00 0.00 178.15 176.55 1wvb h GLY 209 N 1.97 0.52 1.75 8.18 0.00 -1.95 -2.30 103.07 111.24 1wvb h GLY 209 Ca -0.00 -0.27 -0.23 0.00 0.00 0.00 0.00 47.33 46.83 1wvb h GLY 209 CO 0.01 0.25 -1.05 1.70 0.00 0.00 0.00 176.54 177.45 1wvb h LYS 210 N 0.39 0.20 -0.70 4.80 1.63 -1.60 -3.19 116.57 118.10 1wvb h LYS 210 Ca 0.11 -0.29 0.04 0.00 -0.85 0.00 0.00 60.65 59.66 1wvb h LYS 210 Cb 0.14 0.10 -0.05 0.00 -0.60 0.00 0.00 32.23 31.83 1wvb h LYS 210 CO -0.01 1.08 0.43 0.28 -3.45 0.00 0.00 179.45 177.78 1wvb h VAL 211 N 0.08 1.07 -0.30 2.00 2.07 -1.33 -1.27 116.25 118.58 1wvb h VAL 211 Ca -0.08 -0.29 -0.15 0.00 0.82 0.00 0.00 66.70 67.01 1wvb h VAL 211 Cb 1.75 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 1wvb h VAL 211 CO 0.16 0.15 -0.42 0.24 0.02 0.00 0.00 177.57 177.73 1wvb h MET 212 N 0.84 0.73 -0.37 1.57 2.86 -1.49 -1.06 114.93 118.02 1wvb h MET 212 Ca 0.29 -0.39 -0.13 0.00 -2.06 0.00 0.00 59.70 57.41 1wvb h MET 212 Cb 0.05 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 1wvb h MET 212 CO -0.12 1.01 -0.28 1.49 1.06 0.00 0.00 176.91 180.07 1wvb h GLU 213 N 0.59 0.77 -0.02 1.72 4.81 -1.49 -2.27 114.58 118.70 1wvb h GLU 213 Ca 0.04 -0.34 -0.24 0.00 -0.13 0.00 0.00 59.36 58.70 1wvb h GLU 213 Cb 0.97 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.34 1wvb h GLU 213 CO 0.09 0.96 -0.96 0.93 -0.73 0.00 0.00 179.01 179.30 1wvb h GLU 214 N 0.66 0.56 -0.03 1.92 5.08 -1.17 -1.22 114.58 120.38 1wvb h GLU 214 Ca 0.08 -0.58 -0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1wvb h GLU 214 Cb 0.80 0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.21 1wvb h GLU 214 CO 0.07 1.20 0.01 1.79 -1.00 0.00 0.00 179.01 181.08 1wvb h THR 215 N 0.33 1.20 -0.13 1.13 1.35 -1.17 -1.33 112.91 114.29 1wvb h THR 215 Ca -0.10 -0.61 -0.09 0.00 -0.55 0.00 0.00 66.41 65.06 1wvb h THR 215 Cb 1.60 1.56 -0.01 0.00 -1.73 0.00 0.00 68.15 69.57 1wvb h THR 215 CO 0.18 0.16 -0.33 -0.07 -0.25 0.00 0.00 175.52 175.21 1wvb h LEU 216 N -0.19 0.26 -0.17 3.87 3.38 -1.47 -0.76 115.31 120.23 1wvb h LEU 216 Ca 0.01 -0.09 -0.21 0.00 0.09 0.00 0.00 57.88 57.67 1wvb h LEU 216 Cb 0.26 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1wvb h LEU 216 CO 0.00 0.59 -0.95 0.77 0.09 0.00 0.00 178.44 178.93 1wvb h SER 217 N 0.23 0.23 0.22 -0.43 4.64 -1.21 0.35 113.55 117.58 1wvb h SER 217 Ca 0.03 -0.20 -0.12 0.00 -0.47 0.00 0.00 61.79 61.03 1wvb h SER 217 Cb 0.70 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.71 1wvb h SER 217 CO 0.05 1.05 -0.44 0.22 -0.87 0.00 0.00 176.83 176.84 1wvb h TYR 218 N 0.08 0.33 0.00 4.77 3.20 -0.98 0.44 116.97 124.81 1wvb h TYR 218 Ca -0.05 -0.10 -0.15 0.00 3.14 0.00 0.00 58.73 61.57 1wvb h TYR 218 Cb 1.62 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 39.80 1wvb h TYR 218 CO 0.03 0.67 -0.83 -0.07 -1.64 0.00 0.00 178.16 176.32 1wvb h LEU 219 N 0.23 0.00 -3.04 2.82 3.38 -1.10 -3.39 115.31 114.20 1wvb h LEU 219 Ca 0.02 -0.66 0.00 0.00 0.09 0.00 0.00 57.88 57.32 1wvb h LEU 219 Cb 0.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1wvb h LEU 219 CO 0.07 1.32 0.00 0.18 0.09 0.00 0.00 178.44 180.10 1wvb n LEU 220 N -4.49 4.73 0.00 1.67 4.77 0.12 -4.70 117.00 119.10 1wvb n LEU 220 Ca -0.24 -2.39 0.00 0.00 -0.03 0.00 0.00 56.01 53.35 1wvb n LEU 220 Cb 0.61 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1wvb n LEU 220 CO 0.24 0.72 0.29 0.61 -1.33 0.00 0.00 177.39 177.92 1wvb n GLY 221 N 0.96 -2.89 0.36 -0.72 0.00 0.14 -4.12 105.19 98.92 1wvb n GLY 221 Ca 0.25 0.02 -0.12 0.00 0.00 0.00 0.00 46.02 46.16 1wvb n GLY 221 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1wvb h ARG 222 N 0.00 -0.59 -5.91 1.61 3.08 -1.84 -3.45 114.38 107.29 1wvb h ARG 222 Ca 0.00 0.04 -0.52 0.00 0.07 0.00 0.00 59.98 59.57 1wvb h ARG 222 Cb 0.00 0.13 -0.18 0.00 0.08 0.00 0.00 29.97 30.00 1wvb h ARG 222 CO 0.00 -0.39 -0.78 0.15 -1.07 0.00 0.00 179.97 177.88 1wvb s LYS 223 N -5.03 1.26 -1.20 0.04 -0.14 -1.26 -5.08 119.74 108.34 1wvb s LYS 223 Ca -0.12 -1.39 -0.08 0.00 -1.36 0.00 0.00 55.97 53.01 1wvb s LYS 223 Cb 0.04 -1.31 0.22 0.00 -1.68 0.00 0.00 37.83 35.10 1wvb s LYS 223 CO 0.44 0.27 1.63 1.63 -0.76 0.00 0.00 175.35 178.55 1wvb n LYS 224 N 0.32 3.83 -3.00 1.68 4.01 -1.26 -4.39 118.16 119.34 1wvb n LYS 224 Ca -0.13 -3.96 -0.20 0.00 -0.51 0.00 0.00 58.31 53.51 1wvb n LYS 224 Cb 0.57 -2.79 0.01 0.00 -0.51 0.00 0.00 35.03 32.32 1wvb n LYS 224 CO 0.00 0.00 0.00 -0.98 -1.11 0.00 0.00 177.40 175.31 1wvb s ARG 225 N -0.51 2.87 0.40 1.97 1.04 -1.26 -5.07 118.95 118.39 1wvb s ARG 225 Ca 0.37 -0.88 -0.25 0.00 -1.04 0.00 0.00 55.73 53.93 1wvb s ARG 225 Cb 0.05 -2.65 -0.11 0.00 -2.04 0.00 0.00 34.95 30.19 1wvb s ARG 225 CO 0.03 -0.32 0.95 -2.30 -0.04 0.00 0.00 175.30 173.62 1wvb n PRO 226 N -2.00 1.25 -4.92 3.89 -0.02 -1.26 -4.69 135.00 127.26 1wvb n PRO 226 Ca 0.05 0.45 -0.33 0.00 -2.02 0.00 0.00 63.50 61.65 1wvb n PRO 226 Cb 0.59 -1.95 -0.14 0.00 -0.02 0.00 0.00 33.50 31.98 1wvb n PRO 226 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1wvb s ILE 227 N -1.26 2.86 -0.21 4.25 -1.09 0.19 0.17 121.20 126.12 1wvb s ILE 227 Ca 0.63 -0.76 0.01 0.00 -2.23 0.00 0.00 60.65 58.30 1wvb s ILE 227 Cb -0.59 -2.14 0.04 0.00 -1.58 0.00 0.00 42.46 38.19 1wvb s ILE 227 CO 0.57 0.56 -0.13 -2.28 -1.23 0.00 0.00 174.94 172.43 1wvb s HIS 228 N -0.17 2.73 -0.41 3.97 5.65 0.24 -0.60 115.29 126.70 1wvb s HIS 228 Ca -0.01 -1.79 -0.13 0.00 0.25 0.00 0.00 55.06 53.38 1wvb s HIS 228 Cb -0.13 -1.79 0.04 0.00 -1.18 0.00 0.00 32.58 29.51 1wvb s HIS 228 CO 0.03 -0.79 0.27 -1.17 -0.65 0.00 0.00 174.74 172.43 1wvb s LEU 229 N 1.29 5.04 -0.37 8.88 2.96 -0.84 0.17 118.68 135.81 1wvb s LEU 229 Ca -0.02 -1.05 -0.18 0.00 -0.22 0.00 0.00 54.13 52.66 1wvb s LEU 229 Cb -0.16 -2.10 0.00 0.00 0.50 0.00 0.00 46.19 44.43 1wvb s LEU 229 CO -0.09 -0.46 0.52 -0.55 -1.32 0.00 0.00 176.35 174.45 1wvb s SER 230 N 1.79 6.29 -0.34 3.68 0.15 -0.09 -2.78 113.70 122.40 1wvb s SER 230 Ca 0.03 -0.17 -0.06 0.00 0.70 0.00 0.00 55.95 56.45 1wvb s SER 230 Cb -0.20 -2.27 0.04 0.00 -1.71 0.00 0.00 66.02 61.89 1wvb s SER 230 CO 0.08 -0.53 0.11 0.12 1.20 0.00 0.00 173.24 174.21 1wvb s PHE 231 N 2.41 3.27 -0.26 3.44 2.19 -0.70 -1.67 117.98 126.65 1wvb s PHE 231 Ca 0.18 -1.49 -0.15 0.00 0.33 0.00 0.00 56.93 55.80 1wvb s PHE 231 Cb -0.15 -2.34 -0.04 0.00 -1.31 0.00 0.00 43.02 39.18 1wvb s PHE 231 CO 0.14 -0.75 0.39 0.34 1.83 0.00 0.00 175.22 177.18 1wvb s ASP 232 N 1.45 6.29 0.60 6.13 -1.08 -0.53 -0.72 116.67 128.82 1wvb s ASP 232 Ca -0.01 0.34 0.29 0.00 -0.52 0.00 0.00 52.55 52.65 1wvb s ASP 232 Cb -0.20 -2.22 1.55 0.00 -1.46 0.00 0.00 42.92 40.59 1wvb s ASP 232 CO 0.02 -0.19 1.95 0.58 0.52 0.00 0.00 175.17 178.05 1wvb h VAL 233 N 5.36 0.31 -0.06 1.11 2.07 -1.73 0.18 116.25 123.49 1wvb h VAL 233 Ca -0.32 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.20 1wvb h VAL 233 Cb 1.16 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1wvb h VAL 233 CO 0.66 0.00 0.00 -0.90 0.02 0.00 0.00 177.57 177.35 1wvb n ASP 234 N -3.57 0.64 0.15 0.57 5.68 -1.26 -2.69 116.55 116.06 1wvb n ASP 234 Ca 0.05 -2.02 0.03 0.00 -0.50 0.00 0.00 54.79 52.34 1wvb n ASP 234 Cb 0.53 -0.17 0.08 0.00 -1.14 0.00 0.00 41.12 40.42 1wvb n ASP 234 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1wvb h GLY 235 N 5.60 0.00 -3.47 6.12 0.00 -0.92 -3.29 103.07 107.11 1wvb h GLY 235 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 1wvb h GLY 235 CO 0.01 0.00 -0.27 1.08 0.00 0.00 0.00 176.54 177.37 1wvb s LEU 236 N -6.59 4.16 0.30 3.11 1.43 -1.10 -2.81 118.68 117.19 1wvb s LEU 236 Ca 0.03 0.49 -0.30 0.00 -1.03 0.00 0.00 54.13 53.32 1wvb s LEU 236 Cb 0.08 -3.28 -0.12 0.00 0.03 0.00 0.00 46.19 42.90 1wvb s LEU 236 CO 0.74 -0.11 1.48 -0.67 0.23 0.00 0.00 176.35 178.01 1wvb n ASP 237 N -0.86 3.36 0.00 2.29 -0.08 -0.89 -4.64 116.55 115.74 1wvb n ASP 237 Ca -0.04 1.17 0.00 0.00 -1.51 0.00 0.00 54.79 54.41 1wvb n ASP 237 Cb 0.54 -1.53 0.00 0.00 2.34 0.00 0.00 41.12 42.47 1wvb n ASP 237 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1wvb n PRO 238 N 1.61 0.00 0.00 -0.67 -0.02 -1.26 -0.17 135.00 134.50 1wvb n PRO 238 Ca 0.08 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.67 1wvb n PRO 238 Cb 0.35 -1.42 0.11 0.00 -0.02 0.00 0.00 33.50 32.53 1wvb n PRO 238 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1wvb n SER 239 N -0.84 0.68 -0.05 2.55 3.41 -1.26 -2.46 113.62 115.66 1wvb n SER 239 Ca 0.00 -0.52 -0.06 0.00 -0.26 0.00 0.00 58.87 58.03 1wvb n SER 239 Cb 0.00 0.53 -0.05 0.00 -0.26 0.00 0.00 64.21 64.43 1wvb n SER 239 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1wvb n PHE 240 N -1.51 0.00 -3.14 7.33 3.72 0.77 -4.81 117.46 119.82 1wvb n PHE 240 Ca 0.05 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.22 1wvb n PHE 240 Cb 0.33 -0.38 -0.05 0.00 -0.94 0.00 0.00 39.48 38.45 1wvb n PHE 240 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1wvb n THR 241 N -2.65 1.21 0.25 4.37 -2.24 -0.89 -3.77 114.28 110.55 1wvb n THR 241 Ca -0.16 -4.93 0.09 0.00 -2.27 0.00 0.00 64.05 56.79 1wvb n THR 241 Cb 0.70 -1.17 0.64 0.00 -2.10 0.00 0.00 70.33 68.40 1wvb n THR 241 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1wvb h PRO 242 N 3.32 0.00 -3.27 -0.78 0.13 -1.74 -3.35 132.00 126.31 1wvb h PRO 242 Ca 0.12 0.00 -0.74 0.00 -0.87 0.00 0.00 66.00 64.51 1wvb h PRO 242 Cb 0.75 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.77 1wvb h PRO 242 CO 0.65 0.14 2.46 0.00 -0.23 0.00 0.00 178.00 181.02 1wvb n ALA 243 N -2.39 6.01 -2.41 -0.56 0.00 -1.26 -4.75 120.51 115.15 1wvb n ALA 243 Ca -0.02 -4.12 -0.20 0.00 0.00 0.00 0.00 53.44 49.09 1wvb n ALA 243 Cb 0.23 -3.04 -0.10 0.00 0.00 0.00 0.00 19.45 16.54 1wvb n ALA 243 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1wvb s THR 244 N 0.50 1.54 0.00 0.00 2.01 -1.26 -1.14 115.64 117.30 1wvb s THR 244 Ca 0.47 -2.11 0.11 0.00 0.31 0.00 0.00 61.69 60.47 1wvb s THR 244 Cb 0.13 -2.42 -0.17 0.00 0.01 0.00 0.00 72.50 70.06 1wvb s THR 244 CO -0.04 -0.32 1.06 1.23 -0.69 0.00 0.00 174.62 175.86 1wvb h GLY 245 N 2.32 0.00 -6.20 4.40 0.00 -1.91 -3.42 103.07 98.26 1wvb h GLY 245 Ca -0.40 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.36 1wvb h GLY 245 CO 0.67 0.00 -1.03 2.41 0.00 0.00 0.00 176.54 178.59 1wvb n THR 246 N -3.18 -0.88 -3.22 4.70 -1.04 -1.26 -5.09 114.28 104.31 1wvb n THR 246 Ca -0.06 -3.74 -0.37 0.00 -2.04 0.00 0.00 64.05 57.84 1wvb n THR 246 Cb 0.93 -1.81 -0.06 0.00 -1.82 0.00 0.00 70.33 67.57 1wvb n THR 246 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1wvb s PRO 247 N -0.58 4.18 0.04 -2.82 0.04 -1.26 -4.89 135.00 129.71 1wvb s PRO 247 Ca 0.34 0.74 0.05 0.00 0.04 0.00 0.00 61.00 62.17 1wvb s PRO 247 Cb 0.10 -3.03 -0.02 0.00 0.04 0.00 0.00 34.50 31.59 1wvb s PRO 247 CO -0.16 0.50 -0.16 0.08 0.04 0.00 0.00 177.00 177.31 1wvb s VAL 248 N -1.36 1.24 0.66 -0.36 1.01 -1.26 -5.02 120.40 115.31 1wvb s VAL 248 Ca 0.37 -1.02 -0.11 0.00 0.00 0.00 0.00 61.98 61.22 1wvb s VAL 248 Cb -0.17 -1.11 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 1wvb s VAL 248 CO 0.20 0.07 1.06 0.68 0.00 0.00 0.00 175.10 177.12 1wvb s VAL 249 N -0.80 4.15 0.00 2.92 -7.23 -1.26 -3.99 120.40 114.19 1wvb s VAL 249 Ca 0.03 0.70 0.00 0.00 -1.81 0.00 0.00 61.98 60.90 1wvb s VAL 249 Cb -0.08 -3.66 0.00 0.00 0.56 0.00 0.00 36.38 33.20 1wvb s VAL 249 CO 0.01 -0.91 0.00 0.61 -0.31 0.00 0.00 175.10 174.50 1wvb n GLY 250 N -2.77 0.71 2.26 2.32 0.00 -1.26 -5.05 105.19 101.40 1wvb n GLY 250 Ca 0.06 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.88 1wvb n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wvb n GLY 251 N -2.54 -3.44 3.75 -0.02 0.00 -1.26 -4.94 105.19 96.74 1wvb n GLY 251 Ca 0.00 -1.35 -0.41 0.00 0.00 0.00 0.00 46.02 44.27 1wvb n GLY 251 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wvb s LEU 252 N 0.00 4.54 0.69 0.99 1.43 -1.12 -4.37 118.68 120.83 1wvb s LEU 252 Ca 0.47 2.17 -0.12 0.00 -1.03 0.00 0.00 54.13 55.62 1wvb s LEU 252 Cb -0.07 -3.62 0.01 0.00 0.03 0.00 0.00 46.19 42.54 1wvb s LEU 252 CO 0.38 -0.14 1.06 -0.89 0.23 0.00 0.00 176.35 176.99 1wvb s THR 253 N -0.81 3.89 0.17 5.49 2.01 -1.26 -2.09 115.64 123.05 1wvb s THR 253 Ca 0.46 0.67 -0.21 0.00 0.31 0.00 0.00 61.69 62.92 1wvb s THR 253 Cb -0.30 -3.33 0.09 0.00 0.01 0.00 0.00 72.50 68.96 1wvb s THR 253 CO 0.38 -0.75 1.61 0.22 -0.69 0.00 0.00 174.62 175.39 1wvb h TYR 254 N -0.54 -0.74 -0.90 4.92 3.20 -1.96 0.16 116.97 121.11 1wvb h TYR 254 Ca -0.44 0.05 0.09 0.00 3.14 0.00 0.00 58.73 61.57 1wvb h TYR 254 Cb 1.21 0.39 -0.06 0.00 1.54 0.00 0.00 36.73 39.81 1wvb h TYR 254 CO 0.61 -0.35 0.58 0.00 -1.64 0.00 0.00 178.16 177.36 1wvb h ARG 255 N -0.20 0.90 -0.21 1.82 3.08 -1.99 -2.06 114.38 115.73 1wvb h ARG 255 Ca 0.19 -0.05 -0.14 0.00 0.07 0.00 0.00 59.98 60.05 1wvb h ARG 255 Cb 0.51 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1wvb h ARG 255 CO -0.54 0.60 -0.46 1.96 -1.07 0.00 0.00 179.97 180.46 1wvb h GLN 256 N 0.93 0.53 -0.56 0.04 4.20 -1.39 -1.44 115.11 117.43 1wvb h GLN 256 Ca 0.41 -0.29 -0.08 0.00 0.06 0.00 0.00 58.65 58.75 1wvb h GLN 256 Cb 0.34 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.12 1wvb h GLN 256 CO -0.17 0.88 0.04 0.78 -0.67 0.00 0.00 178.83 179.69 1wvb h GLY 257 N 1.08 0.99 2.00 3.46 0.00 -0.52 -2.66 103.07 107.42 1wvb h GLY 257 Ca 0.03 -0.66 -0.11 0.00 0.00 0.00 0.00 47.33 46.58 1wvb h GLY 257 CO 0.09 0.62 -0.51 1.41 0.00 0.00 0.00 176.54 178.14 1wvb h LEU 258 N 0.86 0.00 -0.20 3.11 3.38 -1.15 -3.06 115.31 118.26 1wvb h LEU 258 Ca 0.17 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.98 1wvb h LEU 258 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1wvb h LEU 258 CO 0.02 0.51 -0.50 0.22 0.09 0.00 0.00 178.44 178.78 1wvb h TYR 259 N 0.00 0.88 0.31 1.13 3.20 -0.94 -1.81 116.97 119.74 1wvb h TYR 259 Ca -0.01 -0.34 -0.01 0.00 3.14 0.00 0.00 58.73 61.52 1wvb h TYR 259 Cb 0.94 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 39.04 1wvb h TYR 259 CO 0.00 1.13 -0.32 0.82 -1.64 0.00 0.00 178.16 178.15 1wvb h ILE 260 N 0.39 0.00 -0.95 1.81 2.04 -1.50 -1.18 117.51 118.11 1wvb h ILE 260 Ca -0.01 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.01 1wvb h ILE 260 Cb 1.11 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 37.11 1wvb h ILE 260 CO 0.11 0.00 0.60 0.71 0.00 0.00 0.00 178.15 179.57 1wvb h THR 261 N -0.62 0.80 -0.20 -0.27 1.35 -1.59 0.79 112.91 113.17 1wvb h THR 261 Ca -0.04 -0.26 -0.13 0.00 -0.55 0.00 0.00 66.41 65.43 1wvb h THR 261 Cb 0.54 -0.01 -0.01 0.00 -1.73 0.00 0.00 68.15 66.94 1wvb h THR 261 CO -0.04 0.14 -0.45 -0.33 -0.25 0.00 0.00 175.52 174.59 1wvb h GLU 262 N 0.75 0.49 -0.11 4.72 5.08 -1.18 -0.53 114.58 123.79 1wvb h GLU 262 Ca 0.50 -0.26 -0.18 0.00 -1.00 0.00 0.00 59.36 58.42 1wvb h GLU 262 Cb 0.77 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.03 1wvb h GLU 262 CO -0.26 0.84 -0.68 0.93 -1.00 0.00 0.00 179.01 178.84 1wvb h GLU 263 N 0.40 0.46 -0.17 2.33 4.39 0.18 -0.02 114.58 122.14 1wvb h GLU 263 Ca 0.03 -0.35 -0.07 0.00 0.34 0.00 0.00 59.36 59.31 1wvb h GLU 263 Cb 0.94 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.65 1wvb h GLU 263 CO 0.08 0.97 -0.16 0.82 -1.16 0.00 0.00 179.01 179.57 1wvb h ILE 264 N 0.33 1.34 -0.23 3.13 2.04 -0.83 -3.03 117.51 120.26 1wvb h ILE 264 Ca -0.02 -1.30 0.06 0.00 1.00 0.00 0.00 64.86 64.59 1wvb h ILE 264 Cb 1.24 1.81 -0.06 0.00 -0.74 0.00 0.00 36.82 39.08 1wvb h ILE 264 CO 0.12 0.39 -0.15 0.22 0.00 0.00 0.00 178.15 178.73 1wvb h TYR 265 N 0.05 -0.37 -0.56 1.37 3.20 -0.97 -2.10 116.97 117.59 1wvb h TYR 265 Ca 0.03 0.03 0.16 0.00 3.14 0.00 0.00 58.73 62.09 1wvb h TYR 265 Cb 0.68 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 39.13 1wvb h TYR 265 CO 0.08 -0.22 0.49 0.87 -1.64 0.00 0.00 178.16 177.74 1wvb h LYS 266 N -0.14 0.00 -0.03 1.82 1.57 -0.90 0.21 116.57 119.11 1wvb h LYS 266 Ca 0.13 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.78 1wvb h LYS 266 Cb 0.33 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1wvb h LYS 266 CO -0.31 0.00 -0.59 1.79 -0.57 0.00 0.00 179.45 179.77 1wvb h THR 267 N 0.00 1.41 -1.24 -0.16 1.35 -1.26 -3.47 112.91 109.54 1wvb h THR 267 Ca 0.27 -1.98 -0.22 0.00 -0.55 0.00 0.00 66.41 63.92 1wvb h THR 267 Cb 1.24 2.04 -0.03 0.00 -1.73 0.00 0.00 68.15 69.66 1wvb h THR 267 CO -0.00 0.57 -0.26 0.61 -0.25 0.00 0.00 175.52 176.20 1wvb n GLY 268 N 0.19 0.32 0.40 5.82 0.00 0.75 -4.89 105.19 107.78 1wvb n GLY 268 Ca -0.02 -0.46 0.05 0.00 0.00 0.00 0.00 46.02 45.59 1wvb n GLY 268 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wvb n LEU 269 N -1.47 2.72 -4.71 0.99 4.77 -1.26 -5.00 117.00 113.04 1wvb n LEU 269 Ca -0.12 -2.31 -0.42 0.00 -0.03 0.00 0.00 56.01 53.13 1wvb n LEU 269 Cb 0.53 -0.24 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 1wvb n LEU 269 CO 0.16 0.65 0.95 -0.22 -1.33 0.00 0.00 177.39 177.59 1wvb s LEU 270 N -1.55 4.37 0.00 2.23 2.96 -1.26 0.56 118.68 125.99 1wvb s LEU 270 Ca 0.20 2.13 0.00 0.00 -0.22 0.00 0.00 54.13 56.24 1wvb s LEU 270 Cb 0.14 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.25 1wvb s LEU 270 CO 0.08 -0.54 0.00 -1.20 -1.32 0.00 0.00 176.35 173.37 1wvb n SER 271 N 3.95 4.01 -4.02 3.68 7.64 0.23 -4.82 113.62 124.30 1wvb n SER 271 Ca 0.10 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.82 1wvb n SER 271 Cb 0.45 0.40 -0.13 0.00 -1.01 0.00 0.00 64.21 63.92 1wvb n SER 271 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wvb s GLY 272 N -2.60 0.42 -0.03 0.23 0.00 -0.97 -0.76 107.32 103.61 1wvb s GLY 272 Ca 0.00 -0.50 -0.09 0.00 0.00 0.00 0.00 44.72 44.13 1wvb s GLY 272 CO 0.00 -0.49 0.20 -2.27 0.00 0.00 0.00 173.10 170.54 1wvb s LEU 273 N -0.77 1.26 -0.05 0.66 0.20 0.26 -1.98 118.68 118.25 1wvb s LEU 273 Ca -0.02 0.10 -0.04 0.00 0.69 0.00 0.00 54.13 54.86 1wvb s LEU 273 Cb -0.06 0.83 0.02 0.00 -0.43 0.00 0.00 46.19 46.55 1wvb s LEU 273 CO 0.00 -0.28 0.13 -1.81 -0.29 0.00 0.00 176.35 174.11 1wvb s ASP 274 N -0.81 -0.12 -0.33 3.68 1.01 -1.12 0.47 116.67 119.45 1wvb s ASP 274 Ca -0.09 0.27 0.02 0.00 0.71 0.00 0.00 52.55 53.46 1wvb s ASP 274 Cb -0.05 0.23 0.09 0.00 1.01 0.00 0.00 42.92 44.19 1wvb s ASP 274 CO 0.02 -0.08 0.03 -0.63 0.21 0.00 0.00 175.17 174.71 1wvb s ILE 275 N 0.47 2.52 0.54 0.77 1.09 0.64 -1.72 121.20 125.51 1wvb s ILE 275 Ca -0.03 -1.99 0.05 0.00 -1.10 0.00 0.00 60.65 57.57 1wvb s ILE 275 Cb -0.05 -2.69 0.03 0.00 -1.06 0.00 0.00 42.46 38.69 1wvb s ILE 275 CO -0.02 -0.41 0.35 -0.04 -0.10 0.00 0.00 174.94 174.72 1wvb s MET 276 N 1.04 2.25 -1.41 2.79 -1.94 0.10 -0.42 119.30 121.70 1wvb s MET 276 Ca 0.03 -2.07 0.00 0.00 -1.71 0.00 0.00 55.69 51.94 1wvb s MET 276 Cb -0.20 -2.02 0.00 0.00 2.01 0.00 0.00 34.83 34.62 1wvb s MET 276 CO -0.06 -0.58 0.00 0.39 -0.01 0.00 0.00 175.02 174.76 1wvb n GLU 277 N -1.69 -1.65 -3.62 2.03 -0.58 -0.16 -2.20 120.64 112.76 1wvb n GLU 277 Ca -0.04 0.79 -0.37 0.00 -0.42 0.00 0.00 57.16 57.12 1wvb n GLU 277 Cb 0.65 -5.21 -0.07 0.00 -0.57 0.00 0.00 31.44 26.24 1wvb n GLU 277 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1wvb s VAL 278 N -2.44 5.30 -0.31 2.62 1.01 -1.26 -4.00 120.40 121.32 1wvb s VAL 278 Ca 0.00 0.50 -0.03 0.00 0.00 0.00 0.00 61.98 62.45 1wvb s VAL 278 Cb 0.00 -3.58 0.11 0.00 0.00 0.00 0.00 36.38 32.91 1wvb s VAL 278 CO 0.00 0.48 0.15 0.21 0.00 0.00 0.00 175.10 175.94 1wvb s ASN 279 N -0.18 3.46 0.33 3.32 3.84 -0.29 -4.28 114.94 121.15 1wvb s ASN 279 Ca 0.17 -1.54 0.06 0.00 0.21 0.00 0.00 52.86 51.76 1wvb s ASN 279 Cb -0.13 -0.41 0.72 0.00 -0.55 0.00 0.00 41.25 40.87 1wvb s ASN 279 CO 0.05 -0.41 1.87 1.55 -2.79 0.00 0.00 177.10 177.38 1wvb h PRO 280 N 8.05 0.78 -0.78 0.43 0.13 -1.81 -2.12 132.00 136.68 1wvb h PRO 280 Ca -0.13 -0.05 0.17 0.00 -0.87 0.00 0.00 66.00 65.12 1wvb h PRO 280 Cb 1.00 -0.18 -0.05 0.00 0.13 0.00 0.00 31.00 31.90 1wvb h PRO 280 CO 0.40 0.52 0.53 0.66 -0.23 0.00 0.00 178.00 179.88 1wvb h SER 281 N 0.81 0.33 0.00 1.44 4.64 -1.93 -0.93 113.55 117.91 1wvb h SER 281 Ca 0.44 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 1wvb h SER 281 Cb 0.57 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1wvb h SER 281 CO -0.21 0.16 0.00 0.18 -0.87 0.00 0.00 176.83 176.09 1wvb n LEU 282 N -4.46 0.00 -4.88 5.97 4.77 -0.79 -4.85 117.00 112.76 1wvb n LEU 282 Ca 0.16 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.82 1wvb n LEU 282 Cb 0.61 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.65 1wvb n LEU 282 CO 0.33 0.00 0.25 -0.83 -1.33 0.00 0.00 177.39 175.80 1wvb s GLY 283 N -1.29 2.18 0.00 -0.72 0.00 -0.35 -4.64 107.32 102.49 1wvb s GLY 283 Ca 0.13 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.55 1wvb s GLY 283 CO 0.10 -0.16 0.00 0.28 0.00 0.00 0.00 173.10 173.32 1wvb n LYS 284 N -0.40 0.00 -0.97 2.90 5.02 -1.26 -4.90 118.16 118.56 1wvb n LYS 284 Ca 0.00 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.99 1wvb n LYS 284 Cb 0.53 -0.06 0.14 0.00 -0.02 0.00 0.00 35.03 35.63 1wvb n LYS 284 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1wvb s THR 285 N 0.00 2.60 0.46 -0.18 -4.23 -1.26 -4.89 115.64 108.13 1wvb s THR 285 Ca 0.00 0.19 0.38 0.00 -1.18 0.00 0.00 61.69 61.08 1wvb s THR 285 Cb 0.00 -2.46 0.40 0.00 1.34 0.00 0.00 72.50 71.78 1wvb s THR 285 CO 0.00 -0.25 2.21 -0.65 -0.54 0.00 0.00 174.62 175.39 1wvb h PRO 286 N -1.64 0.00 0.00 3.99 0.11 -2.00 -2.04 132.00 130.43 1wvb h PRO 286 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1wvb h PRO 286 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1wvb h PRO 286 CO 0.48 0.02 -0.22 1.05 -0.21 0.00 0.00 178.00 179.12 1wvb h GLU 287 N 0.00 0.00 0.00 1.05 -0.00 -1.99 -3.01 114.58 110.63 1wvb h GLU 287 Ca -0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 59.36 59.30 1wvb h GLU 287 Cb 0.20 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 28.94 1wvb h GLU 287 CO 0.00 0.00 -0.28 0.93 -0.00 0.00 0.00 179.01 179.66 1wvb h GLU 288 N 0.00 0.00 0.01 1.06 5.08 -1.71 0.55 114.58 119.57 1wvb h GLU 288 Ca 0.00 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.10 1wvb h GLU 288 Cb 0.95 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.22 1wvb h GLU 288 CO 0.00 0.28 -1.01 0.28 -1.00 0.00 0.00 179.01 177.56 1wvb h VAL 289 N 0.00 1.30 -0.51 3.13 2.07 -1.58 -1.50 116.25 119.17 1wvb h VAL 289 Ca -0.00 -2.25 -0.07 0.00 0.82 0.00 0.00 66.70 65.20 1wvb h VAL 289 Cb 0.88 2.45 -0.02 0.00 -1.52 0.00 0.00 31.29 33.09 1wvb h VAL 289 CO 0.04 0.69 0.06 0.74 0.02 0.00 0.00 177.57 179.11 1wvb h THR 290 N 0.31 1.25 -0.65 2.57 2.02 -1.32 -0.07 112.91 117.03 1wvb h THR 290 Ca -0.13 -0.98 -0.09 0.00 0.77 0.00 0.00 66.41 65.98 1wvb h THR 290 Cb 1.67 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 68.96 1wvb h THR 290 CO 0.20 0.35 0.07 -0.09 0.37 0.00 0.00 175.52 176.42 1wvb h ARG 291 N 0.73 1.10 0.03 6.66 2.43 0.12 0.69 114.38 126.14 1wvb h ARG 291 Ca 0.15 -0.31 -0.24 0.00 -0.81 0.00 0.00 59.98 58.77 1wvb h ARG 291 Cb 0.44 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1wvb h ARG 291 CO 0.01 1.03 -1.01 1.15 -1.51 0.00 0.00 179.97 179.64 1wvb h THR 292 N 1.02 1.42 -0.02 0.20 2.02 -1.15 -2.85 112.91 113.54 1wvb h THR 292 Ca 0.19 -2.57 -0.11 0.00 0.77 0.00 0.00 66.41 64.69 1wvb h THR 292 Cb 0.49 2.53 0.01 0.00 -1.74 0.00 0.00 68.15 69.43 1wvb h THR 292 CO 0.02 0.76 -0.43 0.58 0.37 0.00 0.00 175.52 176.82 1wvb h VAL 293 N 0.20 1.46 -0.65 3.16 2.07 -0.92 -2.84 116.25 118.71 1wvb h VAL 293 Ca -0.09 -1.95 -0.07 0.00 0.82 0.00 0.00 66.70 65.41 1wvb h VAL 293 Cb 1.66 2.56 -0.03 0.00 -1.52 0.00 0.00 31.29 33.96 1wvb h VAL 293 CO 0.17 0.56 0.14 0.78 0.02 0.00 0.00 177.57 179.24 1wvb h ASN 294 N -0.21 1.01 -0.54 0.57 4.21 -0.98 -1.36 115.58 118.27 1wvb h ASN 294 Ca -0.05 -0.25 -0.00 0.00 1.21 0.00 0.00 56.30 57.21 1wvb h ASN 294 Cb 1.14 -0.27 -0.03 0.00 -1.12 0.00 0.00 38.32 38.04 1wvb h ASN 294 CO 0.09 1.00 0.33 0.74 -1.29 0.00 0.00 177.43 178.30 1wvb h THR 295 N 0.99 1.16 -0.42 2.81 2.02 -1.59 0.11 112.91 117.98 1wvb h THR 295 Ca 0.20 -0.36 -0.06 0.00 0.77 0.00 0.00 66.41 66.97 1wvb h THR 295 Cb 0.40 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 1wvb h THR 295 CO 0.01 0.17 0.04 0.00 0.37 0.00 0.00 175.52 176.10 1wvb h ALA 296 N 1.60 0.57 -0.52 6.16 0.00 -1.12 -2.76 119.26 123.19 1wvb h ALA 296 Ca 0.20 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 1wvb h ALA 296 Cb -0.03 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1wvb h ALA 296 CO -0.04 0.31 -0.12 0.28 0.00 0.00 0.00 179.25 179.69 1wvb h VAL 297 N 0.57 1.27 0.00 0.00 2.07 -0.39 -2.40 116.25 117.36 1wvb h VAL 297 Ca 0.13 -1.26 0.00 0.00 0.82 0.00 0.00 66.70 66.38 1wvb h VAL 297 Cb 0.42 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1wvb h VAL 297 CO 0.01 0.44 0.00 0.00 0.02 0.00 0.00 177.57 178.05 1wvb h ALA 298 N 0.98 1.00 0.01 1.67 0.00 -0.55 -2.15 119.26 120.22 1wvb h ALA 298 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 54.91 54.65 1wvb h ALA 298 Cb 0.67 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 1wvb h ALA 298 CO 0.05 0.00 -2.40 -0.89 0.00 0.00 0.00 179.25 176.01 1wvb n ILE 299 N -2.29 1.53 0.02 0.00 5.41 -0.99 -3.98 119.36 119.06 1wvb n ILE 299 Ca -0.01 -0.53 -0.10 0.00 1.00 0.00 0.00 62.75 63.11 1wvb n ILE 299 Cb 0.04 -1.56 -0.03 0.00 -0.71 0.00 0.00 39.64 37.37 1wvb n ILE 299 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 1wvb h THR 300 N -0.22 0.54 -0.76 1.39 2.02 -0.95 -2.18 112.91 112.75 1wvb h THR 300 Ca -0.58 0.00 0.10 0.00 0.77 0.00 0.00 66.41 66.70 1wvb h THR 300 Cb 1.84 0.54 -0.05 0.00 -1.74 0.00 0.00 68.15 68.74 1wvb h THR 300 CO -0.14 0.00 0.50 -0.07 0.37 0.00 0.00 175.52 176.18 1wvb h LEU 301 N -0.25 0.61 -0.94 2.58 3.38 -1.63 -0.97 115.31 118.10 1wvb h LEU 301 Ca 0.08 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.97 1wvb h LEU 301 Cb 0.37 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1wvb h LEU 301 CO -0.24 0.36 -0.27 0.00 0.09 0.00 0.00 178.44 178.39 1wvb h ALA 302 N 1.61 1.10 -0.52 1.53 0.00 -1.54 -1.19 119.26 120.25 1wvb h ALA 302 Ca 0.35 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1wvb h ALA 302 Cb 0.47 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1wvb h ALA 302 CO -0.13 0.56 0.06 0.00 0.00 0.00 0.00 179.25 179.74 1wvb n PHE 304 N -4.23 2.82 0.00 0.00 3.72 -0.76 -4.36 117.46 114.65 1wvb n PHE 304 Ca 0.03 -1.77 0.00 0.00 -0.05 0.00 0.00 57.45 55.67 1wvb n PHE 304 Cb 0.27 -0.90 0.00 0.00 -0.94 0.00 0.00 39.48 37.91 1wvb n PHE 304 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wvb n GLY 305 N -1.00 3.22 3.68 1.37 0.00 -0.92 -4.77 105.19 106.77 1wvb n GLY 305 Ca 0.55 -1.09 -0.48 0.00 0.00 0.00 0.00 46.02 45.01 1wvb n GLY 305 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1wvb n LEU 306 N 0.00 3.36 -4.18 0.99 0.00 -0.52 -4.93 117.00 111.72 1wvb n LEU 306 Ca 0.00 1.00 -0.27 0.00 0.00 0.00 0.00 56.01 56.74 1wvb n LEU 306 Cb 0.00 -1.38 -0.16 0.00 0.00 0.00 0.00 43.42 41.88 1wvb n LEU 306 CO 0.00 -0.12 -0.52 0.00 0.00 0.00 0.00 177.39 176.75 1wvb s ALA 307 N 3.28 1.69 0.19 1.96 0.00 -1.26 -4.13 121.76 123.49 1wvb s ALA 307 Ca 0.89 -0.81 0.26 0.00 0.00 0.00 0.00 51.96 52.30 1wvb s ALA 307 Cb -0.69 -0.52 1.39 0.00 0.00 0.00 0.00 23.12 23.31 1wvb s ALA 307 CO 0.48 0.34 1.76 0.00 0.00 0.00 0.00 175.76 178.34 1wvb h ARG 308 N 6.05 0.00 0.00 0.00 3.08 -1.97 0.80 114.38 122.34 1wvb h ARG 308 Ca -0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.71 1wvb h ARG 308 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.22 1wvb h ARG 308 CO 0.48 0.00 -0.62 1.05 -1.07 0.00 0.00 179.97 179.80 1wvb h GLU 309 N 0.00 0.00 0.00 0.04 4.11 -2.00 -3.50 114.58 113.23 1wvb h GLU 309 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1wvb h GLU 309 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1wvb h GLU 309 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.49 1wvb n GLY 310 N 1.29 2.54 3.54 1.06 0.00 0.27 -5.14 105.19 108.75 1wvb n GLY 310 Ca 0.03 -2.11 -0.11 0.00 0.00 0.00 0.00 46.02 43.83 1wvb n GLY 310 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wvb s ASN 311 N 0.00 0.25 0.00 1.61 0.01 -1.26 -4.52 114.94 111.03 1wvb s ASN 311 Ca 0.00 -1.16 0.00 0.00 -0.71 0.00 0.00 52.86 50.99 1wvb s ASN 311 Cb 0.00 0.61 0.00 0.00 0.41 0.00 0.00 41.25 42.27 1wvb s ASN 311 CO 0.00 -1.20 0.00 0.00 -1.51 0.00 0.00 177.10 174.39 1wvb n HIS 312 N -0.44 0.00 1.00 2.20 1.44 -1.26 -5.16 115.22 113.00 1wvb n HIS 312 Ca -0.01 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.82 1wvb n HIS 312 Cb 0.62 0.00 0.10 0.00 0.12 0.00 0.00 29.99 30.83 1wvb n HIS 312 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16