#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1va0 s ARG 3 N 0.00 4.19 -0.16 1.61 3.52 -0.64 -4.34 118.95 123.13 1va0 s ARG 3 Ca 0.00 0.88 -0.01 0.00 -0.13 0.00 0.00 55.73 56.47 1va0 s ARG 3 Cb 0.00 -2.59 -0.01 0.00 -1.56 0.00 0.00 34.95 30.80 1va0 s ARG 3 CO 0.00 0.22 -0.12 0.08 -0.81 0.00 0.00 175.30 174.67 1va0 s VAL 4 N -1.82 3.00 -0.29 7.11 1.01 -0.18 -1.44 120.40 127.79 1va0 s VAL 4 Ca 0.51 -0.66 -0.11 0.00 0.00 0.00 0.00 61.98 61.72 1va0 s VAL 4 Cb -0.13 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 1va0 s VAL 4 CO 0.19 0.50 0.19 -0.31 0.00 0.00 0.00 175.10 175.67 1va0 s TYR 5 N 0.72 3.21 -0.47 5.22 2.02 -0.67 -1.00 117.35 126.38 1va0 s TYR 5 Ca -0.06 0.02 -0.21 0.00 -0.37 0.00 0.00 57.07 56.46 1va0 s TYR 5 Cb -0.15 -2.39 0.03 0.00 -0.40 0.00 0.00 41.96 39.06 1va0 s TYR 5 CO 0.02 -0.21 0.69 -1.17 -1.57 0.00 0.00 175.55 173.31 1va0 s LEU 6 N 1.74 4.54 -0.08 -1.29 2.96 0.32 -0.70 118.68 126.17 1va0 s LEU 6 Ca 0.07 -0.46 0.03 0.00 -0.22 0.00 0.00 54.13 53.55 1va0 s LEU 6 Cb -0.16 -2.69 -0.02 0.00 0.50 0.00 0.00 46.19 43.82 1va0 s LEU 6 CO 0.10 -0.87 -0.17 -0.69 -1.32 0.00 0.00 176.35 173.40 1va0 s VAL 7 N 2.96 2.78 -0.06 1.68 1.01 0.26 -0.38 120.40 128.64 1va0 s VAL 7 Ca 0.22 -0.80 -0.28 0.00 0.00 0.00 0.00 61.98 61.13 1va0 s VAL 7 Cb -0.15 -2.10 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1va0 s VAL 7 CO 0.18 0.56 0.90 -0.83 0.00 0.00 0.00 175.10 175.91 1va0 s GLY 8 N -0.22 2.60 0.00 4.51 0.00 -0.81 -1.18 107.32 112.22 1va0 s GLY 8 Ca -0.00 0.33 0.27 0.00 0.00 0.00 0.00 44.72 45.32 1va0 s GLY 8 CO 0.03 1.62 1.67 0.00 0.00 0.00 0.00 173.10 176.42 1va0 n ALA 9 N 4.32 2.96 0.00 3.20 0.00 0.13 -4.71 120.51 126.41 1va0 n ALA 9 Ca 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1va0 n ALA 9 Cb 0.50 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1va0 n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1va0 n GLY 10 N 1.49 -0.65 0.06 0.00 0.00 -0.83 -4.51 105.19 100.75 1va0 n GLY 10 Ca 0.07 -1.75 0.12 0.00 0.00 0.00 0.00 46.02 44.46 1va0 n GLY 10 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1va0 n PRO 11 N -0.66 0.13 0.00 1.61 -0.04 -1.20 -0.43 135.00 134.41 1va0 n PRO 11 Ca 0.00 0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.66 1va0 n PRO 11 Cb 0.00 -1.68 0.00 0.00 -0.04 0.00 0.00 33.50 31.78 1va0 n PRO 11 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1va0 n GLY 12 N 0.90 0.40 3.66 0.55 0.00 -1.26 -4.77 105.19 104.67 1va0 n GLY 12 Ca 0.05 0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1va0 n GLY 12 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1va0 n ASP 13 N 0.00 4.16 0.31 1.61 2.03 -1.04 -4.60 116.55 119.03 1va0 n ASP 13 Ca 0.00 0.91 0.20 0.00 0.52 0.00 0.00 54.79 56.42 1va0 n ASP 13 Cb 0.00 -1.53 1.06 0.00 -0.72 0.00 0.00 41.12 39.94 1va0 n ASP 13 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1va0 h PRO 14 N 10.34 0.00 0.00 -0.67 0.13 -1.90 0.26 132.00 140.16 1va0 h PRO 14 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1va0 h PRO 14 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1va0 h PRO 14 CO 0.94 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 179.10 1va0 n GLU 15 N -3.35 0.22 -0.32 0.86 -0.58 -1.26 -2.17 120.64 114.04 1va0 n GLU 15 Ca -0.02 0.38 0.09 0.00 -0.42 0.00 0.00 57.16 57.19 1va0 n GLU 15 Cb 0.13 -1.87 0.26 0.00 -0.57 0.00 0.00 31.44 29.39 1va0 n GLU 15 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1va0 n LEU 16 N -2.28 3.22 -4.79 -4.62 4.77 0.08 -4.88 117.00 108.50 1va0 n LEU 16 Ca 0.03 -1.61 -0.33 0.00 -0.03 0.00 0.00 56.01 54.06 1va0 n LEU 16 Cb 0.28 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1va0 n LEU 16 CO 0.23 0.76 0.73 -0.76 -1.33 0.00 0.00 177.39 177.02 1va0 s LEU 17 N -1.08 3.60 0.58 2.23 1.43 -0.92 -4.45 118.68 120.07 1va0 s LEU 17 Ca 0.39 1.91 -0.08 0.00 -1.03 0.00 0.00 54.13 55.32 1va0 s LEU 17 Cb 0.21 -4.55 -0.01 0.00 0.03 0.00 0.00 46.19 41.87 1va0 s LEU 17 CO 0.26 -1.14 0.93 0.42 0.23 0.00 0.00 176.35 177.05 1va0 s THR 18 N -2.25 4.23 0.22 5.49 -4.23 -1.26 -4.91 115.64 112.94 1va0 s THR 18 Ca 0.66 0.34 -0.09 0.00 -1.18 0.00 0.00 61.69 61.43 1va0 s THR 18 Cb -0.18 -3.67 0.19 0.00 1.34 0.00 0.00 72.50 70.18 1va0 s THR 18 CO 0.32 -0.76 1.89 -0.07 -0.54 0.00 0.00 174.62 175.46 1va0 h LEU 19 N -0.17 0.92 -0.12 4.79 3.38 -1.98 -0.69 115.31 121.45 1va0 h LEU 19 Ca -0.45 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.50 1va0 h LEU 19 Cb 1.23 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1va0 h LEU 19 CO 0.62 0.66 0.07 0.50 0.09 0.00 0.00 178.44 180.38 1va0 h LYS 20 N 1.09 0.17 -0.80 1.13 3.64 -1.98 0.10 116.57 119.91 1va0 h LYS 20 Ca 0.31 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 1va0 h LYS 20 Cb -0.08 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.66 1va0 h LYS 20 CO -0.08 0.18 0.51 0.00 -2.27 0.00 0.00 179.45 177.79 1va0 h ALA 21 N 0.98 1.02 -0.55 5.00 0.00 -1.81 -1.42 119.26 122.48 1va0 h ALA 21 Ca 0.04 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1va0 h ALA 21 Cb 0.06 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1va0 h ALA 21 CO -0.01 0.46 0.24 -0.92 0.00 0.00 0.00 179.25 179.03 1va0 h TYR 22 N 1.09 0.81 -0.27 0.00 3.20 -0.79 -0.54 116.97 120.48 1va0 h TYR 22 Ca 0.29 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 62.11 1va0 h TYR 22 Cb -0.08 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 37.93 1va0 h TYR 22 CO -0.01 0.65 0.17 -0.09 -1.64 0.00 0.00 178.16 177.23 1va0 h ARG 23 N 0.75 0.36 -0.59 1.82 2.43 -0.61 -1.66 114.38 116.87 1va0 h ARG 23 Ca 0.19 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.24 1va0 h ARG 23 Cb 0.16 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 1va0 h ARG 23 CO -0.02 0.26 0.01 -0.07 -1.51 0.00 0.00 179.97 178.64 1va0 h LEU 24 N 0.35 1.00 -0.82 3.80 3.38 -1.07 -2.75 115.31 119.19 1va0 h LEU 24 Ca 0.10 -0.27 -0.09 0.00 0.09 0.00 0.00 57.88 57.70 1va0 h LEU 24 Cb -0.01 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1va0 h LEU 24 CO -0.02 1.04 -0.11 -0.07 0.09 0.00 0.00 178.44 179.37 1va0 h LEU 25 N 0.94 0.75 -1.07 1.67 3.38 -0.91 -0.61 115.31 119.46 1va0 h LEU 25 Ca 0.17 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1va0 h LEU 25 Cb 0.53 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1va0 h LEU 25 CO 0.03 0.89 -0.29 0.11 0.09 0.00 0.00 178.44 179.27 1va0 h LYS 26 N 0.69 0.00 0.00 1.13 1.79 -1.17 -3.34 116.57 115.68 1va0 h LYS 26 Ca 0.12 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.59 1va0 h LYS 26 Cb 0.58 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.23 1va0 h LYS 26 CO 0.04 0.29 -1.24 0.39 -1.08 0.00 0.00 179.45 177.84 1va0 n GLU 27 N -3.48 1.25 -1.73 3.15 1.02 -1.05 -4.60 120.64 115.20 1va0 n GLU 27 Ca -0.00 -0.08 -0.42 0.00 -0.02 0.00 0.00 57.16 56.64 1va0 n GLU 27 Cb 0.45 -1.26 -0.02 0.00 -0.02 0.00 0.00 31.44 30.59 1va0 n GLU 27 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1va0 n ALA 28 N -1.72 2.46 0.18 0.62 0.00 -0.26 -4.89 120.51 116.90 1va0 n ALA 28 Ca -0.00 0.38 0.05 0.00 0.00 0.00 0.00 53.44 53.87 1va0 n ALA 28 Cb 0.31 -2.46 0.29 0.00 0.00 0.00 0.00 19.45 17.59 1va0 n ALA 28 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1va0 h PRO 29 N 5.23 0.00 -3.35 0.00 0.13 -1.91 -3.34 132.00 128.77 1va0 h PRO 29 Ca -0.46 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.46 1va0 h PRO 29 Cb 1.22 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.07 1va0 h PRO 29 CO 0.83 0.40 -0.57 0.08 -0.23 0.00 0.00 178.00 178.50 1va0 s VAL 30 N -3.52 -0.02 -0.18 1.56 1.01 -1.26 -0.96 120.40 117.04 1va0 s VAL 30 Ca 0.01 0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.06 1va0 s VAL 30 Cb 0.11 -0.21 0.01 0.00 0.00 0.00 0.00 36.38 36.29 1va0 s VAL 30 CO 0.69 0.03 -0.18 -0.69 0.00 0.00 0.00 175.10 174.95 1va0 s VAL 31 N 0.49 2.23 -0.44 2.92 1.01 0.13 -1.98 120.40 124.76 1va0 s VAL 31 Ca -0.03 -0.89 -0.13 0.00 0.00 0.00 0.00 61.98 60.93 1va0 s VAL 31 Cb -0.05 -1.94 0.06 0.00 0.00 0.00 0.00 36.38 34.46 1va0 s VAL 31 CO -0.02 0.53 0.32 -0.76 0.00 0.00 0.00 175.10 175.17 1va0 s LEU 32 N 1.23 5.32 0.06 3.92 1.43 0.21 -0.63 118.68 130.22 1va0 s LEU 32 Ca 0.03 -1.30 0.06 0.00 -1.03 0.00 0.00 54.13 51.89 1va0 s LEU 32 Cb -0.14 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.95 1va0 s LEU 32 CO -0.10 -0.56 -0.10 -0.72 0.23 0.00 0.00 176.35 175.10 1va0 s TYR 33 N 1.57 2.77 0.70 0.29 1.13 -0.76 -0.35 117.35 122.69 1va0 s TYR 33 Ca 0.04 -0.13 0.03 0.00 -1.41 0.00 0.00 57.07 55.59 1va0 s TYR 33 Cb -0.23 -1.50 0.13 0.00 -1.10 0.00 0.00 41.96 39.26 1va0 s TYR 33 CO 0.06 0.38 0.96 0.16 -2.51 0.00 0.00 175.55 174.59 1va0 s ASP 34 N -1.80 4.47 0.27 -0.18 1.47 -0.95 -1.20 116.67 118.76 1va0 s ASP 34 Ca 0.19 -0.60 -0.00 0.00 1.18 0.00 0.00 52.55 53.32 1va0 s ASP 34 Cb -0.11 0.24 0.51 0.00 -0.34 0.00 0.00 42.92 43.22 1va0 s ASP 34 CO 0.10 -1.79 1.84 -0.09 0.68 0.00 0.00 175.17 175.91 1va0 h ARG 35 N -0.37 0.96 -0.57 2.11 2.43 -1.84 -3.03 114.38 114.07 1va0 h ARG 35 Ca -0.33 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.78 1va0 h ARG 35 Cb 1.27 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 1va0 h ARG 35 CO 0.38 0.64 0.00 1.28 -1.51 0.00 0.00 179.97 180.76 1va0 n LEU 36 N -4.62 1.66 -4.70 3.80 4.77 -1.26 -4.84 117.00 111.80 1va0 n LEU 36 Ca 0.18 -0.83 -0.40 0.00 -0.03 0.00 0.00 56.01 54.92 1va0 n LEU 36 Cb 0.32 -0.35 -0.05 0.00 -2.33 0.00 0.00 43.42 41.01 1va0 n LEU 36 CO 0.28 0.30 0.45 -0.69 -1.33 0.00 0.00 177.39 176.40 1va0 s VAL 37 N -1.59 5.00 0.45 4.08 1.01 -1.15 -4.33 120.40 123.88 1va0 s VAL 37 Ca 0.13 1.48 -0.25 0.00 0.00 0.00 0.00 61.98 63.34 1va0 s VAL 37 Cb 0.09 -4.06 -0.08 0.00 0.00 0.00 0.00 36.38 32.33 1va0 s VAL 37 CO 0.06 0.19 1.37 -0.62 0.00 0.00 0.00 175.10 176.09 1va0 s ASP 38 N 0.92 5.95 0.24 3.32 -1.08 -1.26 -4.91 116.67 119.85 1va0 s ASP 38 Ca 0.37 2.78 -0.06 0.00 -0.52 0.00 0.00 52.55 55.13 1va0 s ASP 38 Cb -0.17 -2.64 0.29 0.00 -1.46 0.00 0.00 42.92 38.94 1va0 s ASP 38 CO 0.16 -1.11 1.88 -0.33 0.52 0.00 0.00 175.17 176.29 1va0 h GLU 39 N 2.31 1.07 -0.14 4.34 3.07 -1.95 -2.07 114.58 121.21 1va0 h GLU 39 Ca -0.50 -0.06 -0.06 0.00 -0.50 0.00 0.00 59.36 58.24 1va0 h GLU 39 Cb 1.26 -0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 28.92 1va0 h GLU 39 CO 0.61 0.71 -0.17 0.00 -1.40 0.00 0.00 179.01 178.76 1va0 h ARG 40 N 1.10 0.23 -0.05 2.33 3.08 -1.92 -1.81 114.38 117.34 1va0 h ARG 40 Ca 0.36 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.30 1va0 h ARG 40 Cb 0.04 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1va0 h ARG 40 CO -0.13 0.40 -0.21 0.28 -1.07 0.00 0.00 179.97 179.24 1va0 h VAL 41 N 0.21 1.45 -0.82 2.04 2.07 -1.64 -3.26 116.25 116.30 1va0 h VAL 41 Ca 0.04 -1.64 0.04 0.00 0.82 0.00 0.00 66.70 65.96 1va0 h VAL 41 Cb 0.43 2.38 -0.05 0.00 -1.52 0.00 0.00 31.29 32.54 1va0 h VAL 41 CO 0.03 0.46 0.54 0.25 0.02 0.00 0.00 177.57 178.87 1va0 h LEU 42 N -0.31 0.86 -2.22 2.57 5.85 -1.32 -1.74 115.31 119.00 1va0 h LEU 42 Ca -0.01 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1va0 h LEU 42 Cb 0.85 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.69 1va0 h LEU 42 CO 0.04 0.58 0.00 0.00 -0.34 0.00 0.00 178.44 178.73 1va0 h ALA 43 N 1.53 1.00 0.00 1.25 0.00 -1.37 -2.05 119.26 119.61 1va0 h ALA 43 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1va0 h ALA 43 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1va0 h ALA 43 CO -0.10 0.00 0.00 -0.07 0.00 0.00 0.00 179.25 179.08 1va0 h LEU 44 N 0.00 0.00 -8.95 0.00 3.38 -1.40 -3.44 115.31 104.91 1va0 h LEU 44 Ca 0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 1va0 h LEU 44 Cb 0.14 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.78 1va0 h LEU 44 CO 0.00 0.00 0.22 0.00 0.09 0.00 0.00 178.44 178.75 1va0 s ALA 45 N -3.20 3.57 -0.85 1.53 0.00 -0.77 -4.59 121.76 117.45 1va0 s ALA 45 Ca 0.08 -0.48 0.26 0.00 0.00 0.00 0.00 51.96 51.82 1va0 s ALA 45 Cb 0.08 -3.12 0.69 0.00 0.00 0.00 0.00 23.12 20.77 1va0 s ALA 45 CO 0.62 -0.97 1.57 -0.35 0.00 0.00 0.00 175.76 176.63 1va0 n PRO 46 N 5.87 0.13 -1.00 0.00 -0.04 -1.26 -4.93 135.00 133.78 1va0 n PRO 46 Ca 0.00 0.06 -0.16 0.00 -0.04 0.00 0.00 63.50 63.37 1va0 n PRO 46 Cb 0.49 -1.61 0.11 0.00 -0.04 0.00 0.00 33.50 32.45 1va0 n PRO 46 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1va0 n GLY 47 N 1.42 -1.41 3.69 0.55 0.00 -1.25 -4.95 105.19 103.24 1va0 n GLY 47 Ca 0.05 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 43.97 1va0 n GLY 47 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1va0 s GLU 48 N -4.56 4.19 -0.26 1.61 2.12 -0.13 -4.78 118.70 116.88 1va0 s GLU 48 Ca 0.41 2.39 -0.08 0.00 0.36 0.00 0.00 54.97 58.05 1va0 s GLU 48 Cb -0.01 -3.52 -0.02 0.00 0.26 0.00 0.00 34.13 30.84 1va0 s GLU 48 CO 0.29 -0.74 0.08 0.15 -0.54 0.00 0.00 175.26 174.50 1va0 s LYS 49 N 2.39 3.55 -0.19 4.30 1.02 -1.26 0.22 119.74 129.77 1va0 s LYS 49 Ca 0.75 -0.55 -0.00 0.00 0.02 0.00 0.00 55.97 56.18 1va0 s LYS 49 Cb -0.42 -3.36 0.01 0.00 -0.52 0.00 0.00 37.83 33.54 1va0 s LYS 49 CO 0.33 -0.25 -0.16 0.08 -0.92 0.00 0.00 175.35 174.43 1va0 s VAL 50 N 1.60 2.41 -0.16 3.17 1.01 0.20 -4.96 120.40 123.67 1va0 s VAL 50 Ca 0.06 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 60.92 1va0 s VAL 50 Cb -0.16 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 1va0 s VAL 50 CO 0.04 0.51 1.49 -0.47 0.00 0.00 0.00 175.10 176.66 1va0 s TYR 51 N 1.32 2.35 -0.38 5.22 5.04 -1.26 -1.84 117.35 127.80 1va0 s TYR 51 Ca 0.05 0.61 0.01 0.00 -2.44 0.00 0.00 57.07 55.30 1va0 s TYR 51 Cb -0.13 -3.80 0.13 0.00 0.35 0.00 0.00 41.96 38.50 1va0 s TYR 51 CO -0.10 -2.71 0.20 0.08 -1.34 0.00 0.00 175.55 171.68 1va0 s VAL 52 N 4.23 0.82 0.00 3.14 1.01 -0.34 -4.91 120.40 124.35 1va0 s VAL 52 Ca 0.65 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 60.63 1va0 s VAL 52 Cb -0.26 -1.59 0.00 0.00 0.00 0.00 0.00 36.38 34.53 1va0 s VAL 52 CO 0.24 -0.89 0.00 0.61 0.00 0.00 0.00 175.10 175.07 1va0 n GLY 53 N 4.00 2.02 3.79 4.51 0.00 -1.26 -3.73 105.19 114.51 1va0 n GLY 53 Ca 0.07 -0.96 -0.05 0.00 0.00 0.00 0.00 46.02 45.08 1va0 n GLY 53 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1va0 s LYS 54 N -1.58 1.43 -0.17 1.61 -2.85 -1.26 -4.87 119.74 112.05 1va0 s LYS 54 Ca 0.00 -0.78 0.00 0.00 -1.00 0.00 0.00 55.97 54.19 1va0 s LYS 54 Cb 0.00 0.49 0.03 0.00 -2.06 0.00 0.00 37.83 36.30 1va0 s LYS 54 CO 0.00 -0.65 -0.10 -2.00 0.10 0.00 0.00 175.35 172.69 1va0 s GLU 55 N -3.55 1.98 -0.93 1.78 2.12 -1.26 -4.73 118.70 114.12 1va0 s GLU 55 Ca 0.11 -0.66 -0.13 0.00 0.36 0.00 0.00 54.97 54.65 1va0 s GLU 55 Cb -0.03 -2.20 -0.28 0.00 0.26 0.00 0.00 34.13 31.88 1va0 s GLU 55 CO 0.04 -0.36 2.19 0.39 -0.54 0.00 0.00 175.26 176.98 1va0 n GLU 56 N 4.76 0.14 -4.30 4.30 -0.58 -1.26 -5.06 120.64 118.64 1va0 n GLU 56 Ca -0.15 -0.22 -0.28 0.00 -0.42 0.00 0.00 57.16 56.10 1va0 n GLU 56 Cb 0.48 -1.68 -0.06 0.00 -0.57 0.00 0.00 31.44 29.61 1va0 n GLU 56 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1va0 s LYS 61 N 7.44 2.19 0.31 3.49 -0.14 -1.26 -3.34 119.74 128.42 1va0 s LYS 61 Ca 1.19 -2.06 0.22 0.00 -1.36 0.00 0.00 55.97 53.97 1va0 s LYS 61 Cb -0.65 -1.85 0.15 0.00 -1.68 0.00 0.00 37.83 33.80 1va0 s LYS 61 CO 0.44 -0.28 1.30 0.37 -0.76 0.00 0.00 175.35 176.41 1va0 h GLN 62 N 1.30 0.00 -0.04 1.68 5.75 -1.99 -2.81 115.11 119.01 1va0 h GLN 62 Ca -0.42 0.00 -0.17 0.00 -0.15 0.00 0.00 58.65 57.91 1va0 h GLN 62 Cb 1.28 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.82 1va0 h GLN 62 CO 0.70 0.02 -0.72 1.05 -2.65 0.00 0.00 178.83 177.23 1va0 h GLU 63 N 0.00 0.20 -0.24 1.69 4.11 -2.03 -0.89 114.58 117.42 1va0 h GLU 63 Ca -0.00 -0.17 -0.02 0.00 0.07 0.00 0.00 59.36 59.24 1va0 h GLU 63 Cb 1.03 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 1va0 h GLU 63 CO 0.00 0.84 0.09 1.49 0.07 0.00 0.00 179.01 181.50 1va0 h GLU 64 N 0.14 0.37 -0.76 1.06 4.81 -1.99 -0.79 114.58 117.42 1va0 h GLU 64 Ca -0.02 -0.07 0.05 0.00 -0.13 0.00 0.00 59.36 59.19 1va0 h GLU 64 Cb 1.27 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 30.54 1va0 h GLU 64 CO 0.11 0.42 0.46 0.82 -0.73 0.00 0.00 179.01 180.09 1va0 h ILE 65 N 0.24 1.03 -0.19 2.32 2.04 -1.30 -1.41 117.51 120.25 1va0 h ILE 65 Ca 0.08 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.65 1va0 h ILE 65 Cb 0.20 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.37 1va0 h ILE 65 CO -0.01 0.16 0.12 0.45 0.00 0.00 0.00 178.15 178.87 1va0 h HIS 66 N 0.86 0.25 -0.75 1.37 3.86 -0.61 -1.59 115.15 118.53 1va0 h HIS 66 Ca 0.33 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.52 1va0 h HIS 66 Cb 0.13 -0.08 -0.04 0.00 1.06 0.00 0.00 27.41 28.48 1va0 h HIS 66 CO -0.05 0.20 0.41 0.00 0.86 0.00 0.00 177.93 179.34 1va0 h ARG 67 N 0.24 1.04 -0.55 2.45 2.47 -0.61 -0.95 114.38 118.48 1va0 h ARG 67 Ca 0.07 -0.12 -0.02 0.00 -1.26 0.00 0.00 59.98 58.65 1va0 h ARG 67 Cb 0.02 -0.21 -0.02 0.00 -1.65 0.00 0.00 29.97 28.10 1va0 h ARG 67 CO -0.01 0.77 0.24 -0.07 0.56 0.00 0.00 179.97 181.46 1va0 h LEU 68 N 1.05 0.73 -0.84 3.04 3.38 -1.01 -0.16 115.31 121.49 1va0 h LEU 68 Ca 0.26 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 1va0 h LEU 68 Cb 0.03 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 1va0 h LEU 68 CO -0.04 0.68 0.46 -0.07 0.09 0.00 0.00 178.44 179.55 1va0 h LEU 69 N 0.74 1.06 -0.45 1.67 3.38 -0.73 -1.73 115.31 119.24 1va0 h LEU 69 Ca 0.18 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 1va0 h LEU 69 Cb 0.15 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1va0 h LEU 69 CO -0.02 0.85 -0.05 0.25 0.09 0.00 0.00 178.44 179.56 1va0 h LEU 70 N 1.18 0.83 -0.14 1.67 5.85 -0.82 -0.82 115.31 123.05 1va0 h LEU 70 Ca 0.30 -0.33 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 1va0 h LEU 70 Cb 0.03 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 1va0 h LEU 70 CO -0.05 0.97 0.07 -0.09 -0.34 0.00 0.00 178.44 179.00 1va0 h ARG 71 N 0.67 0.21 -0.38 1.25 2.43 -0.73 -1.75 114.38 116.09 1va0 h ARG 71 Ca 0.12 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.16 1va0 h ARG 71 Cb 0.57 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1va0 h ARG 71 CO 0.03 0.26 -0.17 0.45 -1.51 0.00 0.00 179.97 179.04 1va0 h HIS 72 N 0.10 0.90 -0.62 2.20 3.86 -1.31 -3.03 115.15 117.24 1va0 h HIS 72 Ca 0.05 -0.22 0.02 0.00 -1.16 0.00 0.00 60.37 59.06 1va0 h HIS 72 Cb 0.13 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.36 1va0 h HIS 72 CO -0.03 0.96 0.41 0.00 0.86 0.00 0.00 177.93 180.13 1va0 h ALA 73 N 0.81 1.59 0.00 2.45 0.00 -1.05 -1.90 119.26 121.16 1va0 h ALA 73 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1va0 h ALA 73 Cb 0.71 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1va0 h ALA 73 CO 0.05 0.36 0.00 0.00 0.00 0.00 0.00 179.25 179.67 1va0 h ARG 74 N 0.81 0.00 -0.28 0.00 3.08 -1.21 0.62 114.38 117.40 1va0 h ARG 74 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1va0 h ARG 74 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1va0 h ARG 74 CO -0.06 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.84 1va0 n ALA 75 N -2.05 2.46 -2.32 0.04 0.00 -0.72 -4.37 120.51 113.56 1va0 n ALA 75 Ca 0.02 -0.78 -0.08 0.00 0.00 0.00 0.00 53.44 52.59 1va0 n ALA 75 Cb 0.35 -0.96 -0.09 0.00 0.00 0.00 0.00 19.45 18.75 1va0 n ALA 75 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1va0 s HIS 76 N -1.64 0.38 0.27 0.00 3.76 -1.21 -5.03 115.29 111.82 1va0 s HIS 76 Ca 0.35 -0.86 -0.02 0.00 -0.15 0.00 0.00 55.06 54.38 1va0 s HIS 76 Cb 0.20 -0.24 0.37 0.00 1.11 0.00 0.00 32.58 34.02 1va0 s HIS 76 CO 0.29 -0.48 1.83 -1.35 -0.85 0.00 0.00 174.74 174.18 1va0 h PRO 77 N 2.93 0.90 -2.90 8.40 0.11 -1.93 -2.69 132.00 136.82 1va0 h PRO 77 Ca -0.34 -0.17 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 1va0 h PRO 77 Cb 1.17 -0.14 -0.13 0.00 0.11 0.00 0.00 31.00 32.02 1va0 h PRO 77 CO 0.61 0.78 0.22 -0.59 -0.21 0.00 0.00 178.00 178.80 1va0 s PHE 78 N -5.30 -0.54 0.10 0.65 -0.12 -1.26 -1.62 117.98 109.88 1va0 s PHE 78 Ca -0.10 0.39 -0.03 0.00 -0.05 0.00 0.00 56.93 57.14 1va0 s PHE 78 Cb 0.16 0.55 -0.03 0.00 -0.63 0.00 0.00 43.02 43.06 1va0 s PHE 78 CO 0.81 -0.82 0.06 0.14 -0.05 0.00 0.00 175.22 175.35 1va0 s VAL 79 N -3.53 0.15 -0.15 -2.49 -7.23 -0.52 -4.45 120.40 102.17 1va0 s VAL 79 Ca 0.00 -1.75 -0.00 0.00 -1.81 0.00 0.00 61.98 58.42 1va0 s VAL 79 Cb -0.01 -1.75 -0.01 0.00 0.56 0.00 0.00 36.38 35.17 1va0 s VAL 79 CO -0.11 -0.68 -0.14 -0.69 -0.31 0.00 0.00 175.10 173.18 1va0 s VAL 80 N -3.97 2.88 -0.43 1.32 1.01 -0.84 -1.68 120.40 118.68 1va0 s VAL 80 Ca 0.15 -0.71 -0.08 0.00 0.00 0.00 0.00 61.98 61.34 1va0 s VAL 80 Cb 0.07 -2.22 0.10 0.00 0.00 0.00 0.00 36.38 34.33 1va0 s VAL 80 CO -0.04 0.51 0.28 -0.60 0.00 0.00 0.00 175.10 175.25 1va0 s ARG 81 N 0.66 2.50 -0.11 2.72 6.06 0.12 0.66 118.95 131.56 1va0 s ARG 81 Ca -0.07 -1.60 -0.18 0.00 -2.50 0.00 0.00 55.73 51.38 1va0 s ARG 81 Cb -0.16 -3.80 -0.04 0.00 0.06 0.00 0.00 34.95 31.01 1va0 s ARG 81 CO 0.02 -1.04 0.47 -1.17 -2.50 0.00 0.00 175.30 171.07 1va0 s LEU 82 N 1.37 4.28 0.09 -0.88 2.96 0.53 -0.57 118.68 126.47 1va0 s LEU 82 Ca 0.04 0.81 0.05 0.00 -0.22 0.00 0.00 54.13 54.81 1va0 s LEU 82 Cb -0.24 -2.68 -0.03 0.00 0.50 0.00 0.00 46.19 43.74 1va0 s LEU 82 CO 0.00 0.02 -0.13 -0.54 -1.32 0.00 0.00 176.35 174.38 1va0 s LYS 83 N 0.53 0.87 0.53 1.98 1.02 -0.33 -2.24 119.74 122.11 1va0 s LYS 83 Ca 0.25 -1.07 -0.21 0.00 0.02 0.00 0.00 55.97 54.96 1va0 s LYS 83 Cb -0.15 -0.77 -0.05 0.00 -0.52 0.00 0.00 37.83 36.34 1va0 s LYS 83 CO 0.10 0.15 1.23 0.20 -0.92 0.00 0.00 175.35 176.11 1va0 s GLY 84 N -2.09 2.79 0.00 -3.33 0.00 -1.26 0.21 107.32 103.64 1va0 s GLY 84 Ca 0.02 1.06 0.00 0.00 0.00 0.00 0.00 44.72 45.80 1va0 s GLY 84 CO 0.02 1.51 0.00 0.61 0.00 0.00 0.00 173.10 175.24 1va0 n GLY 85 N 0.53 3.77 3.70 0.20 0.00 0.43 -4.36 105.19 109.46 1va0 n GLY 85 Ca 0.10 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 1va0 n GLY 85 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1va0 s ASP 86 N -4.00 5.67 0.59 1.61 -1.08 -1.26 -1.97 116.67 116.23 1va0 s ASP 86 Ca 0.00 0.19 0.37 0.00 -0.52 0.00 0.00 52.55 52.59 1va0 s ASP 86 Cb 0.00 -1.83 1.77 0.00 -1.46 0.00 0.00 42.92 41.40 1va0 s ASP 86 CO 0.00 0.29 2.14 1.55 0.52 0.00 0.00 175.17 179.67 1va0 h PRO 87 N 5.81 0.00 -0.10 4.34 0.13 -1.83 -3.25 132.00 137.10 1va0 h PRO 87 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1va0 h PRO 87 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1va0 h PRO 87 CO 0.62 0.01 0.00 -1.33 -0.23 0.00 0.00 178.00 177.07 1va0 n MET 88 N -3.12 1.82 -4.40 0.86 2.81 -1.26 -3.76 117.12 110.07 1va0 n MET 88 Ca -0.01 -1.22 -0.21 0.00 -1.81 0.00 0.00 57.70 54.46 1va0 n MET 88 Cb 0.22 -1.45 -0.16 0.00 -0.71 0.00 0.00 33.22 31.12 1va0 n MET 88 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1va0 s VAL 89 N -1.89 0.81 -1.71 2.03 -7.23 -1.23 -4.78 120.40 106.40 1va0 s VAL 89 Ca 0.35 -0.36 -0.01 0.00 -1.81 0.00 0.00 61.98 60.15 1va0 s VAL 89 Cb 0.20 -0.73 0.00 0.00 0.56 0.00 0.00 36.38 36.41 1va0 s VAL 89 CO 0.30 0.26 0.16 0.49 -0.31 0.00 0.00 175.10 176.00 1va0 n PHE 90 N 3.40 -1.26 -1.67 2.82 3.72 -1.26 -4.79 117.46 118.41 1va0 n PHE 90 Ca -0.19 0.13 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 1va0 n PHE 90 Cb 0.54 -4.08 0.00 0.00 -0.94 0.00 0.00 39.48 35.00 1va0 n PHE 90 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1va0 n GLY 91 N -1.14 -0.41 2.48 1.37 0.00 -1.26 -5.00 105.19 101.23 1va0 n GLY 91 Ca -0.21 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.63 1va0 n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1va0 n ARG 92 N 0.00 -1.25 0.06 1.61 1.74 -1.26 -4.87 116.66 112.69 1va0 n ARG 92 Ca 0.00 1.08 0.03 0.00 -0.77 0.00 0.00 57.85 58.19 1va0 n ARG 92 Cb 0.54 -5.36 0.42 0.00 -1.02 0.00 0.00 32.46 27.04 1va0 n ARG 92 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 1va0 h GLY 93 N 0.00 0.42 1.02 -0.13 0.00 -1.89 -2.04 103.07 100.44 1va0 h GLY 93 Ca -0.37 -0.20 -0.02 0.00 0.00 0.00 0.00 47.33 46.74 1va0 h GLY 93 CO 0.52 0.19 0.42 -1.33 0.00 0.00 0.00 176.54 176.35 1va0 h GLY 94 N 0.59 1.22 1.03 4.60 0.00 -1.86 -0.66 103.07 108.00 1va0 h GLY 94 Ca 0.09 -0.58 -0.09 0.00 0.00 0.00 0.00 47.33 46.76 1va0 h GLY 94 CO -0.00 0.55 -0.04 0.83 0.00 0.00 0.00 176.54 177.88 1va0 h GLU 95 N 1.13 0.92 -0.19 4.80 5.08 -1.79 -0.62 114.58 123.91 1va0 h GLU 95 Ca 0.28 -0.31 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1va0 h GLU 95 Cb 0.06 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1va0 h GLU 95 CO -0.04 0.96 0.09 0.93 -1.00 0.00 0.00 179.01 179.95 1va0 h GLU 96 N 0.78 0.27 -0.72 2.33 5.08 -1.06 -0.91 114.58 120.34 1va0 h GLU 96 Ca 0.14 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1va0 h GLU 96 Cb 0.58 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 1va0 h GLU 96 CO 0.03 0.31 0.39 0.28 -1.00 0.00 0.00 179.01 179.03 1va0 h VAL 97 N 0.17 1.22 -0.01 3.13 2.07 -1.04 -2.09 116.25 119.70 1va0 h VAL 97 Ca 0.06 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 67.02 1va0 h VAL 97 Cb 0.13 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1va0 h VAL 97 CO -0.01 0.25 0.01 0.25 0.02 0.00 0.00 177.57 178.09 1va0 h LEU 98 N 1.00 0.02 -0.51 2.57 5.85 -0.84 -0.62 115.31 122.79 1va0 h LEU 98 Ca 0.25 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 59.01 1va0 h LEU 98 Cb 0.04 -0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.02 1va0 h LEU 98 CO -0.04 0.03 0.23 0.15 -0.34 0.00 0.00 178.44 178.47 1va0 h PHE 99 N 0.00 0.42 -0.33 1.25 3.04 -1.03 -0.63 116.94 119.66 1va0 h PHE 99 Ca 0.00 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 61.94 1va0 h PHE 99 Cb 0.01 -0.11 -0.01 0.00 2.56 0.00 0.00 35.95 38.40 1va0 h PHE 99 CO -0.07 0.18 0.07 -0.07 -2.02 0.00 0.00 178.31 176.40 1va0 h LEU 100 N 0.45 0.51 -0.87 0.59 3.38 -1.16 -2.03 115.31 116.18 1va0 h LEU 100 Ca 0.23 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1va0 h LEU 100 Cb 0.18 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1va0 h LEU 100 CO -0.19 0.62 0.50 -0.07 0.09 0.00 0.00 178.44 179.40 1va0 h LEU 101 N 0.38 1.07 -2.26 1.67 3.38 -0.82 -0.47 115.31 118.26 1va0 h LEU 101 Ca 0.10 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1va0 h LEU 101 Cb 0.32 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1va0 h LEU 101 CO 0.00 0.84 -0.05 0.03 0.09 0.00 0.00 178.44 179.36 1va0 h ARG 102 N 1.21 0.00 -0.59 1.13 3.08 -0.83 -1.16 114.38 117.22 1va0 h ARG 102 Ca 0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.36 1va0 h ARG 102 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.04 1va0 h ARG 102 CO -0.05 0.05 0.00 0.72 -1.07 0.00 0.00 179.97 179.62 1va0 n HIS 103 N -3.49 1.68 -1.62 3.04 8.25 -0.32 -4.94 115.22 117.81 1va0 n HIS 103 Ca -0.02 -0.67 -0.13 0.00 -0.26 0.00 0.00 57.72 56.63 1va0 n HIS 103 Cb 0.17 -0.35 -0.04 0.00 1.12 0.00 0.00 29.99 30.88 1va0 n HIS 103 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1va0 n GLY 104 N 0.81 0.97 3.66 -1.41 0.00 -0.44 -5.00 105.19 103.78 1va0 n GLY 104 Ca 0.26 -0.39 -0.38 0.00 0.00 0.00 0.00 46.02 45.51 1va0 n GLY 104 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1va0 s VAL 105 N -2.54 5.20 0.39 1.61 1.01 -0.40 -5.01 120.40 120.67 1va0 s VAL 105 Ca 0.00 0.65 -0.27 0.00 0.00 0.00 0.00 61.98 62.36 1va0 s VAL 105 Cb 0.00 -3.71 -0.09 0.00 0.00 0.00 0.00 36.38 32.58 1va0 s VAL 105 CO 0.00 0.23 1.32 -2.84 0.00 0.00 0.00 175.10 173.82 1va0 s PRO 106 N 1.48 4.02 0.00 2.72 0.02 -1.26 -4.07 135.00 137.91 1va0 s PRO 106 Ca 0.17 2.21 0.02 0.00 0.02 0.00 0.00 61.00 63.43 1va0 s PRO 106 Cb -0.15 -2.82 -0.01 0.00 0.02 0.00 0.00 34.50 31.55 1va0 s PRO 106 CO 0.08 -0.46 -0.07 0.08 -0.33 0.00 0.00 177.00 176.29 1va0 s VAL 107 N -1.23 0.58 -0.07 3.83 1.01 -1.26 -1.02 120.40 122.24 1va0 s VAL 107 Ca 0.55 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 62.13 1va0 s VAL 107 Cb -0.39 -0.51 0.02 0.00 0.00 0.00 0.00 36.38 35.50 1va0 s VAL 107 CO 0.51 0.09 -0.10 -0.70 0.00 0.00 0.00 175.10 174.90 1va0 s GLU 108 N -0.37 1.52 -0.13 2.72 2.12 -0.17 -4.96 118.70 119.44 1va0 s GLU 108 Ca 0.01 -0.33 -0.14 0.00 0.36 0.00 0.00 54.97 54.87 1va0 s GLU 108 Cb -0.04 -1.34 -0.05 0.00 0.26 0.00 0.00 34.13 32.97 1va0 s GLU 108 CO -0.00 -0.04 0.33 0.08 -0.54 0.00 0.00 175.26 175.08 1va0 s VAL 109 N 0.89 5.26 -0.30 3.70 1.01 -1.26 -0.52 120.40 129.17 1va0 s VAL 109 Ca -0.11 0.63 0.02 0.00 0.00 0.00 0.00 61.98 62.52 1va0 s VAL 109 Cb -0.15 -3.65 0.07 0.00 0.00 0.00 0.00 36.38 32.65 1va0 s VAL 109 CO 0.01 0.43 -0.02 -0.69 0.00 0.00 0.00 175.10 174.83 1va0 s VAL 110 N 0.13 2.40 0.98 2.92 1.01 0.49 -4.93 120.40 123.39 1va0 s VAL 110 Ca 0.19 -1.85 -0.12 0.00 0.00 0.00 0.00 61.98 60.20 1va0 s VAL 110 Cb -0.14 -2.54 0.12 0.00 0.00 0.00 0.00 36.38 33.82 1va0 s VAL 110 CO 0.06 -0.27 0.77 -2.65 0.00 0.00 0.00 175.10 173.02 1va0 n PRO 111 N 4.41 -0.72 -3.96 2.72 -0.02 -1.26 -1.92 135.00 134.26 1va0 n PRO 111 Ca -0.07 -0.16 -0.17 0.00 -2.02 0.00 0.00 63.50 61.08 1va0 n PRO 111 Cb 0.42 -2.11 -0.06 0.00 -0.02 0.00 0.00 33.50 31.73 1va0 n PRO 111 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1va0 n GLY 112 N 0.94 2.83 3.58 -1.23 0.00 -1.26 -4.42 105.19 105.64 1va0 n GLY 112 Ca 0.08 -1.81 -0.43 0.00 0.00 0.00 0.00 46.02 43.86 1va0 n GLY 112 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1va0 s VAL 113 N -3.12 4.37 0.50 1.61 1.01 -1.26 -4.51 120.40 119.00 1va0 s VAL 113 Ca 0.34 0.96 -0.21 0.00 0.00 0.00 0.00 61.98 63.06 1va0 s VAL 113 Cb 0.01 -4.50 -0.06 0.00 0.00 0.00 0.00 36.38 31.83 1va0 s VAL 113 CO 0.24 -0.90 1.18 0.28 0.00 0.00 0.00 175.10 175.90 1va0 s THR 114 N 4.03 2.98 0.59 3.92 -1.32 -1.26 -3.27 115.64 121.31 1va0 s THR 114 Ca 0.41 0.69 0.29 0.00 -1.21 0.00 0.00 61.69 61.87 1va0 s THR 114 Cb -0.09 -3.33 0.36 0.00 -1.51 0.00 0.00 72.50 67.93 1va0 s THR 114 CO 0.28 -0.06 2.17 0.28 -2.21 0.00 0.00 174.62 175.09 1va0 h SER 115 N 1.65 0.00 -0.14 8.08 0.02 -1.90 -0.80 113.55 120.46 1va0 h SER 115 Ca -0.50 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.49 1va0 h SER 115 Cb 1.26 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.80 1va0 h SER 115 CO 0.59 0.00 0.14 -0.07 -1.14 0.00 0.00 176.83 176.34 1va0 h LEU 116 N 0.00 0.00 -3.00 5.07 3.38 -2.00 -1.39 115.31 117.37 1va0 h LEU 116 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1va0 h LEU 116 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1va0 h LEU 116 CO -0.00 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.71 1va0 n LEU 117 N -3.95 3.88 0.23 1.67 4.77 -0.31 -4.66 117.00 118.63 1va0 n LEU 117 Ca 0.00 -2.29 0.09 0.00 -0.03 0.00 0.00 56.01 53.78 1va0 n LEU 117 Cb 0.25 -0.44 0.54 0.00 -2.33 0.00 0.00 43.42 41.44 1va0 n LEU 117 CO 0.29 0.80 0.85 0.00 -1.33 0.00 0.00 177.39 178.00 1va0 h ALA 118 N 3.11 1.18 0.00 -1.18 0.00 -1.31 -3.16 119.26 117.91 1va0 h ALA 118 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1va0 h ALA 118 Cb 1.12 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1va0 h ALA 118 CO 0.11 0.28 0.00 -1.13 0.00 0.00 0.00 179.25 178.51 1va0 n SER 119 N -3.63 0.00 -1.05 0.00 3.41 -1.26 -4.52 113.62 106.57 1va0 n SER 119 Ca -0.01 0.27 -0.14 0.00 -0.26 0.00 0.00 58.87 58.74 1va0 n SER 119 Cb 0.36 -0.42 -0.06 0.00 -0.26 0.00 0.00 64.21 63.82 1va0 n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1va0 n GLY 120 N 1.41 1.39 3.91 5.00 0.00 -1.19 -4.98 105.19 110.72 1va0 n GLY 120 Ca 0.10 -0.17 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 1va0 n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1va0 s LEU 121 N -3.13 4.30 -0.04 0.99 1.43 -1.26 -5.06 118.68 115.92 1va0 s LEU 121 Ca 0.00 0.22 -0.30 0.00 -1.03 0.00 0.00 54.13 53.02 1va0 s LEU 121 Cb 0.00 -2.90 -0.05 0.00 0.03 0.00 0.00 46.19 43.27 1va0 s LEU 121 CO 0.00 0.14 1.45 -2.16 0.23 0.00 0.00 176.35 176.01 1va0 s PRO 122 N -2.68 4.25 0.17 1.29 0.04 -1.26 -4.88 135.00 131.93 1va0 s PRO 122 Ca 0.34 1.98 0.21 0.00 0.04 0.00 0.00 61.00 63.58 1va0 s PRO 122 Cb -0.12 -3.70 -0.03 0.00 0.04 0.00 0.00 34.50 30.68 1va0 s PRO 122 CO 0.28 -0.66 0.99 1.28 0.04 0.00 0.00 177.00 178.92 1va0 n LEU 123 N 5.98 0.85 -4.27 -3.56 4.77 -1.26 -4.81 117.00 114.71 1va0 n LEU 123 Ca 0.14 0.34 -0.26 0.00 -0.03 0.00 0.00 56.01 56.20 1va0 n LEU 123 Cb 0.43 -0.03 -0.14 0.00 -2.33 0.00 0.00 43.42 41.35 1va0 n LEU 123 CO 0.59 -0.11 -0.53 0.42 -1.33 0.00 0.00 177.39 176.43 1va0 s THR 124 N -3.27 1.76 -0.28 -5.08 -4.23 -1.26 -4.71 115.64 98.57 1va0 s THR 124 Ca -0.01 -1.23 -0.21 0.00 -1.18 0.00 0.00 61.69 59.06 1va0 s THR 124 Cb 0.09 -1.52 0.10 0.00 1.34 0.00 0.00 72.50 72.51 1va0 s THR 124 CO 0.80 0.24 0.85 -2.28 -0.54 0.00 0.00 174.62 173.68 1va0 s HIS 125 N -0.79 -0.73 0.05 3.99 2.46 -0.05 -4.93 115.29 115.29 1va0 s HIS 125 Ca 0.08 1.63 -0.37 0.00 0.47 0.00 0.00 55.06 56.87 1va0 s HIS 125 Cb -0.09 0.40 -0.19 0.00 -0.13 0.00 0.00 32.58 32.57 1va0 s HIS 125 CO 0.02 -0.36 1.05 -2.13 -2.47 0.00 0.00 174.74 170.85 1va0 n ARG 126 N 3.12 0.29 0.00 2.88 0.63 -1.26 -0.48 116.66 121.83 1va0 n ARG 126 Ca -0.16 0.10 0.00 0.00 -0.92 0.00 0.00 57.85 56.87 1va0 n ARG 126 Cb 0.57 -1.56 0.00 0.00 0.45 0.00 0.00 32.46 31.92 1va0 n ARG 126 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1va0 n GLY 127 N 1.77 2.07 0.33 5.14 0.00 -1.26 -4.71 105.19 108.53 1va0 n GLY 127 Ca 0.19 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.05 1va0 n GLY 127 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1va0 n LEU 128 N 0.00 1.85 -3.68 0.99 4.77 0.37 -5.05 117.00 116.25 1va0 n LEU 128 Ca 0.00 0.10 -0.10 0.00 -0.03 0.00 0.00 56.01 55.98 1va0 n LEU 128 Cb 0.00 -0.52 -0.10 0.00 -2.33 0.00 0.00 43.42 40.47 1va0 n LEU 128 CO 0.00 0.50 0.08 0.00 -1.33 0.00 0.00 177.39 176.64 1va0 s ALA 129 N -2.31 -1.16 -2.16 -1.18 0.00 -0.54 -4.85 121.76 109.56 1va0 s ALA 129 Ca -0.23 1.62 0.21 0.00 0.00 0.00 0.00 51.96 53.56 1va0 s ALA 129 Cb 0.08 -1.05 0.42 0.00 0.00 0.00 0.00 23.12 22.57 1va0 s ALA 129 CO 0.32 -0.36 1.37 -2.39 0.00 0.00 0.00 175.76 174.70 1va0 n HIS 130 N 4.46 0.53 -3.88 0.00 1.44 -1.26 -0.88 115.22 115.63 1va0 n HIS 130 Ca -0.21 -0.30 0.02 0.00 -2.01 0.00 0.00 57.72 55.23 1va0 n HIS 130 Cb 0.55 -0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.66 1va0 n HIS 130 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 1va0 s GLY 131 N -1.32 -0.18 0.23 -1.39 0.00 -1.26 -5.03 107.32 98.36 1va0 s GLY 131 Ca 0.37 0.17 -0.09 0.00 0.00 0.00 0.00 44.72 45.17 1va0 s GLY 131 CO 0.29 3.76 0.36 -0.11 0.00 0.00 0.00 173.10 177.40 1va0 s PHE 132 N -2.15 0.63 0.11 1.90 -0.71 -1.26 -4.05 117.98 112.44 1va0 s PHE 132 Ca 0.24 -0.94 0.05 0.00 -1.04 0.00 0.00 56.93 55.24 1va0 s PHE 132 Cb 0.01 -0.06 -0.04 0.00 -1.21 0.00 0.00 43.02 41.72 1va0 s PHE 132 CO -0.01 -0.87 -0.12 0.00 -1.34 0.00 0.00 175.22 172.88 1va0 s ALA 133 N -4.06 1.28 -0.02 1.99 0.00 -0.51 -5.00 121.76 115.43 1va0 s ALA 133 Ca 0.28 -1.24 0.01 0.00 0.00 0.00 0.00 51.96 51.01 1va0 s ALA 133 Cb 0.02 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.14 1va0 s ALA 133 CO 0.10 0.01 -0.05 0.00 0.00 0.00 0.00 175.76 175.83 1va0 s ALA 134 N -2.36 0.54 0.12 0.00 0.00 -1.26 -0.68 121.76 118.12 1va0 s ALA 134 Ca 0.07 -0.13 -0.07 0.00 0.00 0.00 0.00 51.96 51.83 1va0 s ALA 134 Cb -0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.82 1va0 s ALA 134 CO 0.01 0.06 0.19 0.54 0.00 0.00 0.00 175.76 176.56 1va0 s VAL 135 N 0.37 0.11 0.00 0.00 0.11 -0.53 -4.98 120.40 115.49 1va0 s VAL 135 Ca -0.04 -1.39 0.03 0.00 -2.93 0.00 0.00 61.98 57.64 1va0 s VAL 135 Cb -0.08 -1.63 -0.03 0.00 -1.53 0.00 0.00 36.38 33.10 1va0 s VAL 135 CO -0.00 -0.52 -0.06 -0.55 -3.33 0.00 0.00 175.10 170.64 1va0 s SER 136 N -2.93 4.67 0.05 3.54 0.15 -1.26 -0.83 113.70 117.09 1va0 s SER 136 Ca 0.12 -0.13 0.28 0.00 0.70 0.00 0.00 55.95 56.92 1va0 s SER 136 Cb 0.05 -1.10 1.10 0.00 -1.71 0.00 0.00 66.02 64.36 1va0 s SER 136 CO -0.05 0.28 1.87 0.61 1.20 0.00 0.00 173.24 177.15 1va0 n GLY 137 N 1.54 -1.54 2.85 9.45 0.00 -0.00 -4.57 105.19 112.92 1va0 n GLY 137 Ca -0.15 -0.10 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 1va0 n GLY 137 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1va0 s VAL 138 N -3.02 0.92 0.29 1.61 1.01 -1.25 -4.46 120.40 115.50 1va0 s VAL 138 Ca 0.13 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.59 1va0 s VAL 138 Cb 0.17 -1.15 0.06 0.00 0.00 0.00 0.00 36.38 35.46 1va0 s VAL 138 CO 0.55 0.09 0.39 0.18 0.00 0.00 0.00 175.10 176.32 1va0 n LEU 139 N 4.94 0.00 -4.67 3.92 4.77 -0.19 -4.90 117.00 120.87 1va0 n LEU 139 Ca -0.11 -0.87 -0.43 0.00 -0.03 0.00 0.00 56.01 54.58 1va0 n LEU 139 Cb 0.48 -0.25 -0.03 0.00 -2.33 0.00 0.00 43.42 41.29 1va0 n LEU 139 CO 0.15 -0.68 1.57 -0.62 -1.33 0.00 0.00 177.39 176.48 1va0 n GLU 140 N -1.72 2.78 -0.70 3.23 4.71 -1.26 -0.86 120.64 126.83 1va0 n GLU 140 Ca 0.07 1.02 0.00 0.00 -0.01 0.00 0.00 57.16 58.24 1va0 n GLU 140 Cb 0.24 -2.95 0.00 0.00 -1.01 0.00 0.00 31.44 27.71 1va0 n GLU 140 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1va0 n GLY 141 N 4.49 0.60 2.35 0.62 0.00 -1.26 -3.86 105.19 108.13 1va0 n GLY 141 Ca 0.20 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1va0 n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1va0 n GLY 142 N -2.70 0.43 3.68 -0.02 0.00 -0.04 -5.02 105.19 101.53 1va0 n GLY 142 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1va0 n GLY 142 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1va0 s GLY 143 N -2.00 1.64 0.14 -0.02 0.00 -1.23 -4.56 107.32 101.29 1va0 s GLY 143 Ca 0.00 0.23 -0.13 0.00 0.00 0.00 0.00 44.72 44.82 1va0 s GLY 143 CO 0.00 0.70 0.53 -0.19 0.00 0.00 0.00 173.10 174.13 1va0 s TYR 144 N -2.76 3.59 0.19 1.90 1.51 -1.26 -1.02 117.35 119.50 1va0 s TYR 144 Ca 0.65 1.00 -0.21 0.00 -1.01 0.00 0.00 57.07 57.50 1va0 s TYR 144 Cb -0.20 -2.33 -0.08 0.00 -0.11 0.00 0.00 41.96 39.24 1va0 s TYR 144 CO 0.58 0.43 0.72 -1.25 -1.11 0.00 0.00 175.55 174.92 1va0 s PRO 145 N -2.03 4.31 -0.67 -1.71 0.04 -1.26 -4.91 135.00 128.77 1va0 s PRO 145 Ca 0.38 0.92 -0.27 0.00 0.04 0.00 0.00 61.00 62.06 1va0 s PRO 145 Cb -0.14 -3.00 0.03 0.00 0.04 0.00 0.00 34.50 31.43 1va0 s PRO 145 CO 0.19 0.46 1.23 0.34 0.04 0.00 0.00 177.00 179.25 1va0 s ASP 146 N -1.49 6.28 0.00 6.66 2.15 -1.26 -4.87 116.67 124.14 1va0 s ASP 146 Ca 0.40 -0.24 0.30 0.00 0.43 0.00 0.00 52.55 53.44 1va0 s ASP 146 Cb -0.18 -2.55 1.39 0.00 -0.30 0.00 0.00 42.92 41.28 1va0 s ASP 146 CO 0.22 -1.66 1.99 0.18 -0.17 0.00 0.00 175.17 175.72 1va0 n LEU 147 N 8.89 0.05 -0.28 -1.34 4.77 -1.26 -4.32 117.00 123.52 1va0 n LEU 147 Ca 0.05 0.32 0.09 0.00 -0.03 0.00 0.00 56.01 56.44 1va0 n LEU 147 Cb 0.49 -0.34 0.25 0.00 -2.33 0.00 0.00 43.42 41.48 1va0 n LEU 147 CO 0.71 0.01 1.01 -0.09 -1.33 0.00 0.00 177.39 177.70 1va0 h ARG 148 N 0.05 0.36 0.00 3.23 2.43 -1.95 -0.31 114.38 118.18 1va0 h ARG 148 Ca 0.00 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1va0 h ARG 148 Cb 0.36 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1va0 h ARG 148 CO 0.00 0.24 -0.07 -1.35 -1.51 0.00 0.00 179.97 177.28 1va0 h PRO 149 N 0.38 0.00 0.00 0.20 0.11 -2.02 -3.23 132.00 127.44 1va0 h PRO 149 Ca 0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.60 1va0 h PRO 149 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1va0 h PRO 149 CO -0.50 0.07 -1.19 1.19 -0.21 0.00 0.00 178.00 177.35 1va0 n PHE 150 N -3.35 0.00 -0.35 0.65 3.01 -0.36 -4.74 117.46 112.33 1va0 n PHE 150 Ca -0.01 0.00 0.28 0.00 1.01 0.00 0.00 57.45 58.72 1va0 n PHE 150 Cb 0.23 -0.17 0.57 0.00 -0.01 0.00 0.00 39.48 40.10 1va0 n PHE 150 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1va0 h ALA 151 N 1.64 2.46 -0.48 4.37 0.00 -1.14 -2.48 119.26 123.63 1va0 h ALA 151 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1va0 h ALA 151 Cb 0.51 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1va0 h ALA 151 CO 0.00 -0.91 0.00 0.54 0.00 0.00 0.00 179.25 178.88 1va0 n ARG 152 N -4.58 2.68 -2.14 0.00 5.12 -1.26 -4.42 116.66 112.05 1va0 n ARG 152 Ca 0.28 -2.26 -0.42 0.00 -1.93 0.00 0.00 57.85 53.52 1va0 n ARG 152 Cb 1.05 -1.40 -0.03 0.00 -1.16 0.00 0.00 32.46 30.92 1va0 n ARG 152 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1va0 s VAL 153 N -1.04 3.12 0.28 1.55 1.01 -0.94 -4.89 120.40 119.50 1va0 s VAL 153 Ca 0.34 0.86 -0.01 0.00 0.00 0.00 0.00 61.98 63.17 1va0 s VAL 153 Cb 0.18 -3.55 0.34 0.00 0.00 0.00 0.00 36.38 33.35 1va0 s VAL 153 CO 0.24 0.10 1.62 -0.65 0.00 0.00 0.00 175.10 176.40 1va0 h PRO 154 N 6.09 0.10 -4.85 2.72 0.11 -1.91 -3.36 132.00 130.90 1va0 h PRO 154 Ca -0.44 -0.01 -0.62 0.00 0.11 0.00 0.00 66.00 65.05 1va0 h PRO 154 Cb 1.21 -0.02 -0.35 0.00 0.11 0.00 0.00 31.00 31.95 1va0 h PRO 154 CO 0.83 0.07 -0.84 0.99 -0.21 0.00 0.00 178.00 178.83 1va0 s THR 155 N -6.01 1.69 -0.06 -1.15 2.01 -1.26 -4.42 115.64 106.45 1va0 s THR 155 Ca -0.13 -0.74 0.06 0.00 0.31 0.00 0.00 61.69 61.19 1va0 s THR 155 Cb 0.26 -1.54 -0.01 0.00 0.01 0.00 0.00 72.50 71.22 1va0 s THR 155 CO 0.77 0.48 -0.24 -0.22 -0.69 0.00 0.00 174.62 174.71 1va0 s LEU 156 N 1.11 2.06 -0.10 4.42 2.96 -0.06 -1.42 118.68 127.65 1va0 s LEU 156 Ca -0.03 -0.50 0.04 0.00 -0.22 0.00 0.00 54.13 53.42 1va0 s LEU 156 Cb -0.14 -1.35 -0.00 0.00 0.50 0.00 0.00 46.19 45.20 1va0 s LEU 156 CO -0.05 0.23 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.29 1va0 s VAL 157 N -0.12 2.14 -0.17 1.68 1.01 0.14 0.04 120.40 125.12 1va0 s VAL 157 Ca -0.04 -0.99 -0.00 0.00 0.00 0.00 0.00 61.98 60.94 1va0 s VAL 157 Cb -0.14 -1.82 -0.00 0.00 0.00 0.00 0.00 36.38 34.42 1va0 s VAL 157 CO 0.04 0.56 -0.14 -0.69 0.00 0.00 0.00 175.10 174.86 1va0 s VAL 158 N 0.32 2.70 0.14 2.92 1.01 0.87 -1.46 120.40 126.90 1va0 s VAL 158 Ca -0.18 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.08 1va0 s VAL 158 Cb -0.18 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 1va0 s VAL 158 CO 0.08 0.51 0.23 -0.76 0.00 0.00 0.00 175.10 175.16 1va0 s LEU 159 N 0.95 4.19 -1.49 3.92 1.43 -0.01 -2.31 118.68 125.37 1va0 s LEU 159 Ca -0.03 0.10 -0.13 0.00 -1.03 0.00 0.00 54.13 53.04 1va0 s LEU 159 Cb -0.15 -2.78 0.10 0.00 0.03 0.00 0.00 46.19 43.39 1va0 s LEU 159 CO -0.02 0.07 0.75 0.23 0.23 0.00 0.00 176.35 177.61 1va0 n MET 160 N -0.38 -4.16 -0.11 1.70 2.81 -1.26 -0.82 117.12 114.89 1va0 n MET 160 Ca -0.07 0.51 0.06 0.00 -1.81 0.00 0.00 57.70 56.39 1va0 n MET 160 Cb 0.54 -5.30 0.11 0.00 -0.71 0.00 0.00 33.22 27.86 1va0 n MET 160 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1va0 n GLY 161 N -1.42 1.53 0.16 3.03 0.00 -1.26 -3.41 105.19 103.82 1va0 n GLY 161 Ca 0.03 -0.37 -0.12 0.00 0.00 0.00 0.00 46.02 45.56 1va0 n GLY 161 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1va0 h VAL 162 N 2.17 0.79 -0.88 1.61 2.07 -1.89 -1.13 116.25 119.00 1va0 h VAL 162 Ca 0.00 -0.82 0.15 0.00 0.82 0.00 0.00 66.70 66.85 1va0 h VAL 162 Cb 0.64 1.21 -0.09 0.00 -1.52 0.00 0.00 31.29 31.53 1va0 h VAL 162 CO 0.00 0.16 0.47 1.23 0.02 0.00 0.00 177.57 179.45 1va0 h GLY 163 N -0.77 1.45 -3.13 2.17 0.00 -1.92 -2.03 103.07 98.84 1va0 h GLY 163 Ca -0.03 -0.28 -0.27 0.00 0.00 0.00 0.00 47.33 46.75 1va0 h GLY 163 CO 0.05 -0.03 0.26 0.54 0.00 0.00 0.00 176.54 177.37 1va0 n ARG 164 N -4.84 2.76 -0.05 4.80 1.74 -1.23 -4.74 116.66 115.09 1va0 n ARG 164 Ca 0.18 -3.07 0.05 0.00 -0.77 0.00 0.00 57.85 54.24 1va0 n ARG 164 Cb 0.44 -2.07 0.41 0.00 -1.02 0.00 0.00 32.46 30.23 1va0 n ARG 164 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 1va0 h ARG 165 N 1.69 0.59 -0.17 5.56 0.11 -0.43 -1.51 114.38 120.22 1va0 h ARG 165 Ca 0.33 -0.04 -0.08 0.00 0.10 0.00 0.00 59.98 60.29 1va0 h ARG 165 Cb 2.22 -0.13 -0.00 0.00 1.11 0.00 0.00 29.97 33.17 1va0 h ARG 165 CO 0.70 0.39 -0.22 0.28 0.10 0.00 0.00 179.97 181.21 1va0 h VAL 166 N 0.61 1.35 -0.65 0.08 2.07 -1.85 -0.90 116.25 116.96 1va0 h VAL 166 Ca 0.20 -1.43 -0.01 0.00 0.82 0.00 0.00 66.70 66.28 1va0 h VAL 166 Cb 0.05 1.89 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 1va0 h VAL 166 CO -0.05 0.43 0.38 -0.25 0.02 0.00 0.00 177.57 178.10 1va0 h TRP 167 N 0.08 0.86 0.05 1.57 7.01 -1.86 -0.82 115.95 122.84 1va0 h TRP 167 Ca 0.02 -0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.01 1va0 h TRP 167 Cb 0.79 -0.28 0.00 0.00 -2.10 0.00 0.00 29.16 27.57 1va0 h TRP 167 CO 0.09 0.60 -0.02 0.82 -2.79 0.00 0.00 178.44 177.13 1va0 h ILE 168 N 0.88 1.06 -0.62 2.65 2.04 -1.24 -0.34 117.51 121.93 1va0 h ILE 168 Ca 0.23 -0.35 0.04 0.00 1.00 0.00 0.00 64.86 65.79 1va0 h ILE 168 Cb -0.01 1.29 -0.05 0.00 -0.74 0.00 0.00 36.82 37.31 1va0 h ILE 168 CO -0.04 0.09 0.36 0.00 0.00 0.00 0.00 178.15 178.55 1va0 h ALA 169 N 0.72 0.82 -0.61 1.87 0.00 -1.00 0.52 119.26 121.58 1va0 h ALA 169 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1va0 h ALA 169 Cb 0.20 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1va0 h ALA 169 CO 0.01 0.06 0.27 0.87 0.00 0.00 0.00 179.25 180.46 1va0 h LYS 170 N 0.68 0.89 -0.56 0.00 1.57 -0.99 -0.16 116.57 118.00 1va0 h LYS 170 Ca 0.27 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1va0 h LYS 170 Cb 0.11 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 1va0 h LYS 170 CO -0.15 0.73 0.31 0.93 -0.57 0.00 0.00 179.45 180.71 1va0 h GLU 171 N 0.84 0.78 -0.59 3.15 4.39 -0.52 0.22 114.58 122.84 1va0 h GLU 171 Ca 0.21 -0.09 -0.02 0.00 0.34 0.00 0.00 59.36 59.80 1va0 h GLU 171 Cb 0.16 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.62 1va0 h GLU 171 CO -0.02 0.59 0.29 -0.07 -1.16 0.00 0.00 179.01 178.65 1va0 h LEU 172 N 0.76 0.74 -0.30 1.33 3.38 -0.38 0.25 115.31 121.09 1va0 h LEU 172 Ca 0.20 -0.07 -0.19 0.00 0.09 0.00 0.00 57.88 57.92 1va0 h LEU 172 Cb 0.04 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.60 1va0 h LEU 172 CO -0.03 0.63 -0.54 -0.07 0.09 0.00 0.00 178.44 178.51 1va0 h LEU 173 N 0.83 0.98 -1.32 1.67 3.38 -0.44 -0.90 115.31 119.52 1va0 h LEU 173 Ca 0.21 -0.52 -0.04 0.00 0.09 0.00 0.00 57.88 57.62 1va0 h LEU 173 Cb 0.07 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1va0 h LEU 173 CO -0.03 1.33 0.05 -0.09 0.09 0.00 0.00 178.44 179.78 1va0 h ARG 174 N 0.68 0.51 -0.16 1.13 2.43 0.26 -2.47 114.38 116.75 1va0 h ARG 174 Ca 0.02 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1va0 h ARG 174 Cb 1.15 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 1va0 h ARG 174 CO 0.12 0.50 0.00 1.28 -1.51 0.00 0.00 179.97 180.36 1va0 n LEU 175 N -4.32 1.02 0.00 3.80 4.77 0.81 -4.92 117.00 118.16 1va0 n LEU 175 Ca 0.02 -0.48 0.00 0.00 -0.03 0.00 0.00 56.01 55.52 1va0 n LEU 175 Cb 0.21 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1va0 n LEU 175 CO 0.38 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 1va0 n GLY 176 N 0.88 0.44 3.77 -0.72 0.00 -0.93 -4.82 105.19 103.81 1va0 n GLY 176 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 1va0 n GLY 176 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1va0 s ARG 177 N -0.76 4.27 -0.06 1.61 3.52 -0.37 -4.93 118.95 122.24 1va0 s ARG 177 Ca 0.00 2.04 -0.33 0.00 -0.13 0.00 0.00 55.73 57.31 1va0 s ARG 177 Cb 0.00 -2.95 -0.11 0.00 -1.56 0.00 0.00 34.95 30.33 1va0 s ARG 177 CO 0.00 -0.19 1.92 -3.47 -0.81 0.00 0.00 175.30 172.75 1va0 n ASP 178 N 0.59 3.65 0.26 -2.12 2.03 -1.26 -4.53 116.55 115.18 1va0 n ASP 178 Ca 0.01 0.94 0.09 0.00 0.52 0.00 0.00 54.79 56.35 1va0 n ASP 178 Cb 0.44 -1.42 0.67 0.00 -0.72 0.00 0.00 41.12 40.09 1va0 n ASP 178 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1va0 h PRO 179 N 9.76 0.00 -0.02 -0.67 0.11 -1.96 -2.20 132.00 137.02 1va0 h PRO 179 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1va0 h PRO 179 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1va0 h PRO 179 CO 0.95 0.01 -0.00 0.54 -0.21 0.00 0.00 178.00 179.29 1va0 n ARG 180 N -4.41 1.68 -1.71 1.05 1.74 -1.26 -1.58 116.66 112.17 1va0 n ARG 180 Ca -0.03 -1.00 -0.43 0.00 -0.77 0.00 0.00 57.85 55.62 1va0 n ARG 180 Cb 0.10 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.03 1va0 n ARG 180 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1va0 n GLU 181 N 0.21 2.55 -2.30 5.56 2.13 -0.83 -4.72 120.64 123.24 1va0 n GLU 181 Ca 0.19 0.91 -0.39 0.00 0.66 0.00 0.00 57.16 58.53 1va0 n GLU 181 Cb 0.36 -2.71 -0.03 0.00 0.27 0.00 0.00 31.44 29.34 1va0 n GLU 181 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 1va0 s PRO 182 N 0.54 4.27 0.20 5.31 0.02 -1.26 -0.61 135.00 143.47 1va0 s PRO 182 Ca 0.72 1.91 0.00 0.00 0.02 0.00 0.00 61.00 63.66 1va0 s PRO 182 Cb -0.56 -2.89 -0.05 0.00 0.02 0.00 0.00 34.50 31.03 1va0 s PRO 182 CO 0.39 -0.15 0.08 0.95 -0.33 0.00 0.00 177.00 177.93 1va0 s THR 183 N -1.30 0.38 -0.09 0.99 -4.23 0.10 -2.22 115.64 109.27 1va0 s THR 183 Ca 0.52 -1.98 -0.07 0.00 -1.18 0.00 0.00 61.69 58.98 1va0 s THR 183 Cb -0.33 -2.39 0.03 0.00 1.34 0.00 0.00 72.50 71.16 1va0 s THR 183 CO 0.42 -0.19 0.23 -0.22 -0.54 0.00 0.00 174.62 174.32 1va0 s LEU 184 N -3.20 0.89 -0.15 4.79 2.96 -0.10 -2.46 118.68 121.42 1va0 s LEU 184 Ca 0.33 0.47 -0.02 0.00 -0.22 0.00 0.00 54.13 54.69 1va0 s LEU 184 Cb 0.07 0.75 -0.02 0.00 0.50 0.00 0.00 46.19 47.50 1va0 s LEU 184 CO 0.09 -0.11 -0.08 -0.36 -1.32 0.00 0.00 176.35 174.57 1va0 s PHE 185 N 0.51 2.91 -0.54 5.38 0.08 0.87 -1.00 117.98 126.19 1va0 s PHE 185 Ca -0.03 -0.52 -0.02 0.00 0.12 0.00 0.00 56.93 56.48 1va0 s PHE 185 Cb -0.05 -1.91 0.14 0.00 -0.57 0.00 0.00 43.02 40.63 1va0 s PHE 185 CO -0.03 -0.16 0.34 0.08 -0.10 0.00 0.00 175.22 175.35 1va0 s VAL 186 N 0.44 3.41 0.31 -0.44 1.01 0.89 -0.64 120.40 125.38 1va0 s VAL 186 Ca -0.07 -2.74 -0.29 0.00 0.00 0.00 0.00 61.98 58.88 1va0 s VAL 186 Cb -0.15 -3.27 -0.10 0.00 0.00 0.00 0.00 36.38 32.86 1va0 s VAL 186 CO 0.04 -0.81 1.24 -0.70 0.00 0.00 0.00 175.10 174.87 1va0 s GLU 187 N 0.27 4.45 -1.23 2.72 2.12 0.23 -1.32 118.70 125.94 1va0 s GLU 187 Ca 0.14 2.07 -0.20 0.00 0.36 0.00 0.00 54.97 57.34 1va0 s GLU 187 Cb -0.22 -3.12 0.03 0.00 0.26 0.00 0.00 34.13 31.08 1va0 s GLU 187 CO -0.03 -0.06 0.38 0.54 -0.54 0.00 0.00 175.26 175.55 1va0 n ARG 188 N 1.04 -0.53 -1.84 4.30 1.74 -0.59 -1.00 116.66 119.78 1va0 n ARG 188 Ca -0.00 0.03 -0.38 0.00 -0.77 0.00 0.00 57.85 56.73 1va0 n ARG 188 Cb 0.43 -2.58 0.04 0.00 -1.02 0.00 0.00 32.46 29.33 1va0 n ARG 188 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1va0 s ALA 189 N -3.90 2.78 -1.14 7.54 0.00 -1.23 -2.95 121.76 122.85 1va0 s ALA 189 Ca 0.28 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.50 1va0 s ALA 189 Cb -0.15 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.42 1va0 s ALA 189 CO 0.90 -1.31 0.00 0.45 0.00 0.00 0.00 175.76 175.80 1va0 n SER 190 N -1.09 -4.10 -4.21 0.00 2.88 -1.26 -4.76 113.62 101.08 1va0 n SER 190 Ca 0.11 0.08 -0.12 0.00 -1.33 0.00 0.00 58.87 57.60 1va0 n SER 190 Cb 0.46 -3.13 -0.10 0.00 -0.75 0.00 0.00 64.21 60.68 1va0 n SER 190 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1va0 s THR 191 N -2.58 0.23 0.33 2.46 -4.23 -1.15 -2.49 115.64 108.21 1va0 s THR 191 Ca 0.00 -1.97 0.26 0.00 -1.18 0.00 0.00 61.69 58.80 1va0 s THR 191 Cb 0.00 -2.31 0.26 0.00 1.34 0.00 0.00 72.50 71.80 1va0 s THR 191 CO 0.00 -0.23 1.99 -0.65 -0.54 0.00 0.00 174.62 175.18 1va0 h PRO 192 N 2.68 0.00 -0.83 3.99 0.11 -1.95 -2.54 132.00 133.45 1va0 h PRO 192 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1va0 h PRO 192 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1va0 h PRO 192 CO 0.58 0.17 0.00 1.63 -0.21 0.00 0.00 178.00 180.17 1va0 n LYS 193 N -3.59 2.52 -2.17 1.05 5.02 -1.26 -4.93 118.16 114.79 1va0 n LYS 193 Ca -0.01 -1.23 -0.42 0.00 -2.02 0.00 0.00 58.31 54.63 1va0 n LYS 193 Cb 0.30 -1.79 -0.03 0.00 -0.02 0.00 0.00 35.03 33.49 1va0 n LYS 193 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1va0 s GLU 194 N -1.69 4.28 0.00 1.97 2.12 -0.96 -4.62 118.70 119.80 1va0 s GLU 194 Ca 0.21 2.04 0.04 0.00 0.36 0.00 0.00 54.97 57.62 1va0 s GLU 194 Cb 0.16 -3.49 -0.01 0.00 0.26 0.00 0.00 34.13 31.05 1va0 s GLU 194 CO 0.06 -0.56 -0.11 0.50 -0.54 0.00 0.00 175.26 174.61 1va0 s ARG 195 N 2.09 0.89 -0.12 4.30 3.52 -0.17 -4.97 118.95 124.47 1va0 s ARG 195 Ca 0.65 -0.47 -0.00 0.00 -0.13 0.00 0.00 55.73 55.79 1va0 s ARG 195 Cb -0.34 -0.86 -0.02 0.00 -1.56 0.00 0.00 34.95 32.18 1va0 s ARG 195 CO 0.28 0.23 -0.12 1.03 -0.81 0.00 0.00 175.30 175.91 1va0 s ARG 196 N -0.45 3.33 -0.09 5.12 0.52 -1.26 0.76 118.95 126.88 1va0 s ARG 196 Ca 0.03 -0.67 0.04 0.00 -0.52 0.00 0.00 55.73 54.62 1va0 s ARG 196 Cb -0.05 -2.64 -0.00 0.00 0.52 0.00 0.00 34.95 32.78 1va0 s ARG 196 CO -0.00 0.26 -0.24 0.08 0.02 0.00 0.00 175.30 175.42 1va0 s VAL 197 N 0.24 2.04 0.11 3.52 1.01 0.19 -4.97 120.40 122.54 1va0 s VAL 197 Ca -0.08 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 60.92 1va0 s VAL 197 Cb -0.15 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 1va0 s VAL 197 CO 0.05 0.56 0.10 -1.00 0.00 0.00 0.00 175.10 174.81 1va0 s HIS 198 N 0.24 3.18 -0.29 5.22 0.09 -1.26 -0.09 115.29 122.38 1va0 s HIS 198 Ca -0.16 0.04 -0.30 0.00 -0.00 0.00 0.00 55.06 54.65 1va0 s HIS 198 Cb -0.17 -1.58 0.19 0.00 -0.00 0.00 0.00 32.58 31.02 1va0 s HIS 198 CO 0.08 0.52 1.37 0.00 -0.00 0.00 0.00 174.74 176.71 1va0 s ALA 199 N -1.53 -2.13 0.38 -1.40 0.00 -1.03 -4.99 121.76 111.06 1va0 s ALA 199 Ca 0.30 1.90 -0.12 0.00 0.00 0.00 0.00 51.96 54.04 1va0 s ALA 199 Cb -0.11 -1.43 -0.07 0.00 0.00 0.00 0.00 23.12 21.51 1va0 s ALA 199 CO 0.23 -0.27 0.76 1.03 0.00 0.00 0.00 175.76 177.51 1va0 s ARG 200 N -1.12 3.84 0.32 0.00 0.52 -1.26 0.03 118.95 121.28 1va0 s ARG 200 Ca 0.09 0.53 0.09 0.00 -0.52 0.00 0.00 55.73 55.92 1va0 s ARG 200 Cb -0.01 -2.40 0.92 0.00 0.52 0.00 0.00 34.95 33.98 1va0 s ARG 200 CO -0.08 0.01 1.65 1.25 0.02 0.00 0.00 175.30 178.16 1va0 h LEU 201 N 1.51 0.27 -0.44 2.53 5.85 -0.92 -0.77 115.31 123.34 1va0 h LEU 201 Ca -0.47 0.20 0.09 0.00 0.84 0.00 0.00 57.88 58.53 1va0 h LEU 201 Cb 1.18 0.20 -0.09 0.00 0.37 0.00 0.00 40.66 42.33 1va0 h LEU 201 CO 0.64 -0.15 -0.14 -0.33 -0.34 0.00 0.00 178.44 178.12 1va0 h GLU 202 N 0.27 -0.04 -0.57 1.25 5.08 -1.58 -1.85 114.58 117.15 1va0 h GLU 202 Ca 0.65 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 59.03 1va0 h GLU 202 Cb 1.42 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.65 1va0 h GLU 202 CO -0.64 -0.03 0.37 0.93 -1.00 0.00 0.00 179.01 178.65 1va0 h GLU 203 N -0.04 0.69 -0.05 2.33 5.08 -1.44 -0.90 114.58 120.26 1va0 h GLU 203 Ca 0.21 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.51 1va0 h GLU 203 Cb 0.36 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 1va0 h GLU 203 CO -0.47 0.46 -0.04 0.28 -1.00 0.00 0.00 179.01 178.24 1va0 h VAL 204 N 0.72 1.36 -0.61 3.13 2.07 -1.27 0.95 116.25 122.60 1va0 h VAL 204 Ca 0.22 -1.13 0.09 0.00 0.82 0.00 0.00 66.70 66.69 1va0 h VAL 204 Cb -0.01 2.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.74 1va0 h VAL 204 CO -0.05 0.31 0.41 0.00 0.02 0.00 0.00 177.57 178.25 1va0 h ALA 205 N 0.57 1.94 -0.00 1.67 0.00 -0.98 -1.03 119.26 121.43 1va0 h ALA 205 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1va0 h ALA 205 Cb 0.51 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1va0 h ALA 205 CO 0.01 -0.07 -0.03 0.39 0.00 0.00 0.00 179.25 179.55 1va0 n GLU 206 N -4.47 0.96 -1.07 0.00 1.02 -0.38 -4.85 120.64 111.85 1va0 n GLU 206 Ca 0.10 -0.24 -0.02 0.00 -0.02 0.00 0.00 57.16 56.97 1va0 n GLU 206 Cb 0.33 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.24 1va0 n GLU 206 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1va0 n GLY 207 N 1.15 0.58 0.32 0.62 0.00 -0.39 -4.92 105.19 102.55 1va0 n GLY 207 Ca 0.19 -0.51 0.10 0.00 0.00 0.00 0.00 46.02 45.80 1va0 n GLY 207 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1va0 n LYS 208 N -2.59 1.43 -4.99 1.61 4.76 0.29 -4.86 118.16 113.80 1va0 n LYS 208 Ca -0.02 -0.64 -0.32 0.00 -2.87 0.00 0.00 58.31 54.45 1va0 n LYS 208 Cb 0.12 -1.36 -0.15 0.00 -1.84 0.00 0.00 35.03 31.81 1va0 n LYS 208 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1va0 s VAL 209 N -1.88 2.68 -0.25 -0.18 1.01 -1.24 -4.95 120.40 115.59 1va0 s VAL 209 Ca 0.31 -0.83 -0.04 0.00 0.00 0.00 0.00 61.98 61.42 1va0 s VAL 209 Cb 0.16 -2.05 0.01 0.00 0.00 0.00 0.00 36.38 34.49 1va0 s VAL 209 CO 0.25 0.56 -0.02 -0.70 0.00 0.00 0.00 175.10 175.19 1va0 s GLU 210 N -0.14 3.16 -0.11 2.72 2.56 -1.26 -5.03 118.70 120.60 1va0 s GLU 210 Ca -0.02 -0.78 -0.09 0.00 0.00 0.00 0.00 54.97 54.08 1va0 s GLU 210 Cb -0.14 -3.09 0.04 0.00 2.00 0.00 0.00 34.13 32.93 1va0 s GLU 210 CO 0.04 -0.31 0.28 0.08 -0.56 0.00 0.00 175.26 174.79 1va0 s VAL 211 N 1.44 -0.01 0.00 3.70 1.01 -1.26 -5.02 120.40 120.26 1va0 s VAL 211 Ca 0.03 0.05 0.02 0.00 0.00 0.00 0.00 61.98 62.08 1va0 s VAL 211 Cb -0.16 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.77 1va0 s VAL 211 CO -0.02 0.02 0.00 -0.13 0.00 0.00 0.00 175.10 174.97 1va0 s ARG 212 N 0.54 2.77 0.62 2.72 1.81 -1.26 -4.93 118.95 121.23 1va0 s ARG 212 Ca -0.03 -0.62 -0.15 0.00 -1.72 0.00 0.00 55.73 53.20 1va0 s ARG 212 Cb -0.05 -2.66 -0.02 0.00 -0.45 0.00 0.00 34.95 31.77 1va0 s ARG 212 CO -0.03 0.62 1.07 -1.25 -0.68 0.00 0.00 175.30 175.03 1va0 s PRO 213 N -1.59 3.12 0.46 3.54 0.04 -1.26 -4.48 135.00 134.83 1va0 s PRO 213 Ca 0.20 1.24 -0.07 0.00 0.04 0.00 0.00 61.00 62.40 1va0 s PRO 213 Cb -0.12 -2.00 -0.05 0.00 0.04 0.00 0.00 34.50 32.37 1va0 s PRO 213 CO 0.11 -0.97 0.79 -1.25 0.04 0.00 0.00 177.00 175.71 1va0 s PRO 214 N -4.17 3.63 -0.05 0.56 0.04 -1.26 -4.94 135.00 128.82 1va0 s PRO 214 Ca 0.64 0.32 -0.24 0.00 0.04 0.00 0.00 61.00 61.76 1va0 s PRO 214 Cb -0.17 -2.37 0.05 0.00 0.04 0.00 0.00 34.50 32.05 1va0 s PRO 214 CO 0.40 -0.15 0.54 0.00 0.04 0.00 0.00 177.00 177.83 1va0 s ALA 215 N -2.61 -1.40 -0.17 8.56 0.00 -1.26 -1.54 121.76 123.35 1va0 s ALA 215 Ca 0.49 1.00 -0.12 0.00 0.00 0.00 0.00 51.96 53.33 1va0 s ALA 215 Cb -0.10 -0.05 -0.05 0.00 0.00 0.00 0.00 23.12 22.92 1va0 s ALA 215 CO 0.40 -0.32 0.24 -1.17 0.00 0.00 0.00 175.76 174.90 1va0 s LEU 216 N -1.11 4.24 -0.21 0.00 2.96 -0.44 -4.39 118.68 119.73 1va0 s LEU 216 Ca -0.11 0.43 -0.01 0.00 -0.22 0.00 0.00 54.13 54.22 1va0 s LEU 216 Cb -0.02 -2.28 0.02 0.00 0.50 0.00 0.00 46.19 44.41 1va0 s LEU 216 CO 0.07 0.14 -0.12 0.86 -1.32 0.00 0.00 176.35 175.99 1va0 s TRP 217 N 0.34 2.94 -0.17 5.38 -0.00 -0.98 -0.08 118.94 126.38 1va0 s TRP 217 Ca 0.14 -1.51 -0.02 0.00 -0.00 0.00 0.00 56.10 54.70 1va0 s TRP 217 Cb -0.12 -2.00 -0.02 0.00 -0.00 0.00 0.00 33.47 31.33 1va0 s TRP 217 CO 0.02 -0.73 -0.08 0.42 -0.00 0.00 0.00 176.95 176.58 1va0 s ILE 218 N 1.33 3.36 -0.06 5.86 1.01 -0.17 -0.09 121.20 132.44 1va0 s ILE 218 Ca 0.03 -0.53 0.04 0.00 0.00 0.00 0.00 60.65 60.19 1va0 s ILE 218 Cb -0.15 -2.47 -0.02 0.00 0.01 0.00 0.00 42.46 39.83 1va0 s ILE 218 CO -0.08 0.48 -0.18 -0.76 0.00 0.00 0.00 174.94 174.40 1va0 s LEU 219 N 0.73 2.49 0.00 2.97 1.02 0.11 -0.92 118.68 125.06 1va0 s LEU 219 Ca -0.04 -0.33 0.00 0.00 0.02 0.00 0.00 54.13 53.78 1va0 s LEU 219 Cb -0.15 -1.49 0.00 0.00 0.02 0.00 0.00 46.19 44.57 1va0 s LEU 219 CO 0.02 0.29 0.00 0.61 0.02 0.00 0.00 176.35 177.29 1va0 n GLY 220 N 2.70 4.03 0.30 -3.19 0.00 -0.94 -0.88 105.19 107.20 1va0 n GLY 220 Ca -0.17 -1.63 0.17 0.00 0.00 0.00 0.00 46.02 44.39 1va0 n GLY 220 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1va0 h GLU 221 N 0.00 0.00 0.00 1.61 4.39 -1.82 -1.93 114.58 116.83 1va0 h GLU 221 Ca 0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1va0 h GLU 221 Cb 0.00 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1va0 h GLU 221 CO 0.00 0.00 -0.03 -0.39 -1.16 0.00 0.00 179.01 177.43 1va0 h VAL 222 N 0.00 0.13 -0.92 3.13 -1.51 -1.90 -2.55 116.25 112.63 1va0 h VAL 222 Ca 0.00 -0.35 0.06 0.00 -1.23 0.00 0.00 66.70 65.18 1va0 h VAL 222 Cb 0.28 1.30 -0.06 0.00 -2.13 0.00 0.00 31.29 30.69 1va0 h VAL 222 CO 0.00 0.03 0.60 0.58 -1.23 0.00 0.00 177.57 177.55 1va0 h VAL 223 N 0.00 1.07 -0.27 7.19 2.07 -1.67 -2.04 116.25 122.61 1va0 h VAL 223 Ca -0.00 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.16 1va0 h VAL 223 Cb 0.30 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.00 1va0 h VAL 223 CO 0.00 0.19 0.00 -2.11 0.02 0.00 0.00 177.57 175.68 1va0 n ARG 224 N -4.49 1.76 0.08 1.57 -4.01 -0.96 -3.59 116.66 107.01 1va0 n ARG 224 Ca 0.14 -1.16 -0.05 0.00 -1.04 0.00 0.00 57.85 55.73 1va0 n ARG 224 Cb 0.19 -1.32 -0.05 0.00 -3.04 0.00 0.00 32.46 28.24 1va0 n ARG 224 CO 0.00 0.00 0.00 0.28 -3.04 0.00 0.00 177.63 174.87 1va0 h VAL 225 N 2.05 1.64 0.00 8.89 2.07 -1.45 -3.53 116.25 125.92 1va0 h VAL 225 Ca 0.00 -3.11 0.00 0.00 0.82 0.00 0.00 66.70 64.41 1va0 h VAL 225 Cb 0.46 2.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.91 1va0 h VAL 225 CO 0.00 0.89 0.00 0.49 0.02 0.00 0.00 177.57 178.97