#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 3.23 -0.13 1.61 3.52 -0.82 -4.03 118.95 122.33 1va0 s ARG 3 Ca 0.00 -0.46 0.01 0.00 -0.13 0.00 0.00 55.73 55.15 1va0 s ARG 3 Cb 0.00 -2.95 -0.00 0.00 -1.56 0.00 0.00 34.95 30.44 1va0 s ARG 3 CO 0.00 0.63 -0.17 0.08 -0.81 0.00 0.00 175.30 175.03 1va0 s VAL 4 N -1.34 2.59 -0.30 7.11 1.01 -0.73 -0.24 120.40 128.50 1va0 s VAL 4 Ca 0.28 -0.81 -0.10 0.00 0.00 0.00 0.00 61.98 61.35 1va0 s VAL 4 Cb -0.12 -2.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 1va0 s VAL 4 CO 0.20 0.53 0.16 -0.31 0.00 0.00 0.00 175.10 175.69 1va0 s TYR 5 N 0.55 3.18 -0.51 5.22 2.02 -0.43 -0.88 117.35 126.50 1va0 s TYR 5 Ca -0.11 -0.39 -0.19 0.00 -0.37 0.00 0.00 57.07 56.01 1va0 s TYR 5 Cb -0.16 -2.36 0.07 0.00 -0.40 0.00 0.00 41.96 39.10 1va0 s TYR 5 CO 0.04 -0.39 0.60 -1.17 -1.57 0.00 0.00 175.55 173.07 1va0 s LEU 6 N 1.65 5.11 -0.11 -1.29 2.96 0.32 -0.35 118.68 126.98 1va0 s LEU 6 Ca 0.05 -1.03 -0.01 0.00 -0.22 0.00 0.00 54.13 52.92 1va0 s LEU 6 Cb -0.17 -2.39 -0.03 0.00 0.50 0.00 0.00 46.19 44.10 1va0 s LEU 6 CO 0.07 -0.88 -0.05 -0.69 -1.32 0.00 0.00 176.35 173.48 1va0 s VAL 7 N 2.50 3.80 -0.12 1.68 1.01 0.36 -0.54 120.40 129.09 1va0 s VAL 7 Ca 0.13 -0.42 -0.27 0.00 0.00 0.00 0.00 61.98 61.42 1va0 s VAL 7 Cb -0.21 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.55 1va0 s VAL 7 CO 0.10 0.56 0.88 -0.83 0.00 0.00 0.00 175.10 175.81 1va0 s GLY 8 N -0.31 2.34 0.01 4.51 0.00 -0.48 -0.98 107.32 112.41 1va0 s GLY 8 Ca 0.05 0.20 0.27 0.00 0.00 0.00 0.00 44.72 45.24 1va0 s GLY 8 CO 0.02 1.66 1.66 0.00 0.00 0.00 0.00 173.10 176.45 1va0 n ALA 9 N 4.80 2.92 0.00 3.20 0.00 0.11 -4.65 120.51 126.88 1va0 n ALA 9 Ca 0.05 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1va0 n ALA 9 Cb 0.49 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.65 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 -0.69 0.17 0.00 0.00 -0.79 -4.49 105.19 100.87 1va0 n GLY 10 Ca 0.06 -1.73 0.13 0.00 0.00 0.00 0.00 46.02 44.48 1va0 n GLY 10 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1va0 h PRO 11 N 0.00 0.00 0.00 1.61 0.13 -1.84 0.50 132.00 132.40 1va0 h PRO 11 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1va0 h PRO 11 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1va0 h PRO 11 CO 0.00 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.18 1va0 n GLY 12 N -0.01 1.59 3.65 1.56 0.00 -1.26 -4.74 105.19 105.98 1va0 n GLY 12 Ca 0.02 -0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 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 3.92 0.21 1.61 -0.08 -1.26 -4.65 116.55 116.29 1va0 n ASP 13 Ca 0.00 0.79 0.16 0.00 -1.51 0.00 0.00 54.79 54.24 1va0 n ASP 13 Cb 0.00 -1.51 0.82 0.00 2.34 0.00 0.00 41.12 42.77 1va0 n ASP 13 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1va0 h PRO 14 N 11.16 0.00 0.00 -0.67 0.13 -1.91 0.70 132.00 141.41 1va0 h PRO 14 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1va0 h PRO 14 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1va0 h PRO 14 CO 0.95 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 179.11 1va0 n GLU 15 N -3.90 0.16 -0.39 0.86 1.02 -1.26 -1.94 120.64 115.18 1va0 n GLU 15 Ca 0.01 0.46 0.08 0.00 -0.02 0.00 0.00 57.16 57.69 1va0 n GLU 15 Cb 0.30 -1.85 0.26 0.00 -0.02 0.00 0.00 31.44 30.13 1va0 n GLU 15 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1va0 n LEU 16 N -2.15 3.42 -4.80 -4.62 4.77 0.24 -4.89 117.00 108.97 1va0 n LEU 16 Ca 0.01 -1.72 -0.33 0.00 -0.03 0.00 0.00 56.01 53.95 1va0 n LEU 16 Cb 0.17 -0.45 0.02 0.00 -2.33 0.00 0.00 43.42 40.83 1va0 n LEU 16 CO 0.16 0.68 0.72 -0.76 -1.33 0.00 0.00 177.39 176.87 1va0 s LEU 17 N -1.30 3.47 0.64 2.23 1.43 -0.82 -4.51 118.68 119.83 1va0 s LEU 17 Ca 0.38 1.86 -0.10 0.00 -1.03 0.00 0.00 54.13 55.24 1va0 s LEU 17 Cb 0.23 -4.54 -0.00 0.00 0.03 0.00 0.00 46.19 41.91 1va0 s LEU 17 CO 0.22 -1.26 1.01 0.42 0.23 0.00 0.00 176.35 176.96 1va0 s THR 18 N -2.43 3.90 0.18 5.49 -4.23 -1.26 -4.91 115.64 112.38 1va0 s THR 18 Ca 0.64 0.44 -0.13 0.00 -1.18 0.00 0.00 61.69 61.46 1va0 s THR 18 Cb -0.17 -3.59 0.07 0.00 1.34 0.00 0.00 72.50 70.15 1va0 s THR 18 CO 0.38 -0.72 1.81 -0.07 -0.54 0.00 0.00 174.62 175.47 1va0 h LEU 19 N -0.40 0.46 -0.29 4.79 3.38 -1.97 -1.82 115.31 119.45 1va0 h LEU 19 Ca -0.45 0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.56 1va0 h LEU 19 Cb 1.24 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.87 1va0 h LEU 19 CO 0.63 0.32 0.10 0.50 0.09 0.00 0.00 178.44 180.08 1va0 h LYS 20 N 0.58 0.23 -0.68 1.13 3.64 -1.98 -1.97 116.57 117.51 1va0 h LYS 20 Ca 0.21 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.61 1va0 h LYS 20 Cb 0.05 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.77 1va0 h LYS 20 CO -0.11 0.15 0.42 0.00 -2.27 0.00 0.00 179.45 177.64 1va0 h ALA 21 N 1.18 0.90 -0.28 5.00 0.00 -1.84 -1.75 119.26 122.47 1va0 h ALA 21 Ca 0.13 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1va0 h ALA 21 Cb 0.10 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1va0 h ALA 21 CO -0.13 0.17 0.17 -0.92 0.00 0.00 0.00 179.25 178.54 1va0 h TYR 22 N 0.81 0.37 -0.49 0.00 3.20 -1.02 -0.12 116.97 119.72 1va0 h TYR 22 Ca 0.28 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.10 1va0 h TYR 22 Cb 0.05 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.18 1va0 h TYR 22 CO -0.05 0.27 0.11 0.00 -1.64 0.00 0.00 178.16 176.85 1va0 h ARG 23 N 0.37 0.79 -0.49 1.82 3.08 -1.19 -1.59 114.38 117.16 1va0 h ARG 23 Ca 0.10 -0.19 -0.06 0.00 0.07 0.00 0.00 59.98 59.90 1va0 h ARG 23 Cb 0.00 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 1va0 h ARG 23 CO -0.02 0.77 0.08 -0.07 -1.07 0.00 0.00 179.97 179.66 1va0 h LEU 24 N 0.67 0.72 -0.48 3.04 3.38 -1.13 -1.35 115.31 120.16 1va0 h LEU 24 Ca 0.15 -0.14 -0.14 0.00 0.09 0.00 0.00 57.88 57.84 1va0 h LEU 24 Cb 0.34 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1va0 h LEU 24 CO 0.00 0.74 -0.25 -0.07 0.09 0.00 0.00 178.44 178.96 1va0 h LEU 25 N 0.73 1.02 -0.73 1.67 3.38 -0.74 0.27 115.31 120.92 1va0 h LEU 25 Ca 0.16 -0.40 -0.11 0.00 0.09 0.00 0.00 57.88 57.62 1va0 h LEU 25 Cb 0.34 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1va0 h LEU 25 CO 0.01 1.20 -0.17 0.11 0.09 0.00 0.00 178.44 179.68 1va0 h LYS 26 N 0.85 0.79 0.00 1.13 1.79 -1.03 -3.31 116.57 116.80 1va0 h LYS 26 Ca 0.10 -0.29 0.00 0.00 -2.18 0.00 0.00 60.65 58.28 1va0 h LYS 26 Cb 0.83 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.43 1va0 h LYS 26 CO 0.07 0.91 -1.05 0.39 -1.08 0.00 0.00 179.45 178.69 1va0 n GLU 27 N -4.14 0.57 -2.02 3.15 1.02 -0.53 -4.56 120.64 114.13 1va0 n GLU 27 Ca 0.01 0.09 -0.41 0.00 -0.02 0.00 0.00 57.16 56.82 1va0 n GLU 27 Cb 0.40 -1.78 -0.02 0.00 -0.02 0.00 0.00 31.44 30.02 1va0 n GLU 27 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1va0 s ALA 28 N -3.35 3.64 0.30 0.62 0.00 0.95 -4.90 121.76 119.01 1va0 s ALA 28 Ca -0.00 1.31 0.10 0.00 0.00 0.00 0.00 51.96 53.37 1va0 s ALA 28 Cb 0.10 -3.56 0.44 0.00 0.00 0.00 0.00 23.12 20.11 1va0 s ALA 28 CO 0.79 -0.73 1.67 -1.00 0.00 0.00 0.00 175.76 176.50 1va0 h PRO 29 N 5.35 0.05 -3.68 0.00 0.13 -1.90 -3.35 132.00 128.61 1va0 h PRO 29 Ca -0.45 -0.03 -0.24 0.00 -0.87 0.00 0.00 66.00 64.41 1va0 h PRO 29 Cb 1.22 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.06 1va0 h PRO 29 CO 0.80 0.57 -0.71 0.08 -0.23 0.00 0.00 178.00 178.51 1va0 s VAL 30 N -3.82 -0.01 -0.25 1.56 1.01 -1.26 -0.04 120.40 117.59 1va0 s VAL 30 Ca -0.02 0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.01 1va0 s VAL 30 Cb 0.13 -0.03 0.06 0.00 0.00 0.00 0.00 36.38 36.54 1va0 s VAL 30 CO 0.76 0.01 -0.05 -0.69 0.00 0.00 0.00 175.10 175.13 1va0 s VAL 31 N 0.19 1.68 -0.56 2.92 1.01 0.26 -1.68 120.40 124.22 1va0 s VAL 31 Ca -0.02 -1.38 -0.20 0.00 0.00 0.00 0.00 61.98 60.39 1va0 s VAL 31 Cb -0.02 -1.94 0.07 0.00 0.00 0.00 0.00 36.38 34.49 1va0 s VAL 31 CO -0.01 -0.13 0.72 -0.76 0.00 0.00 0.00 175.10 174.92 1va0 s LEU 32 N 1.31 4.95 0.23 3.92 1.43 0.96 -0.72 118.68 130.77 1va0 s LEU 32 Ca -0.05 -1.03 0.08 0.00 -1.03 0.00 0.00 54.13 52.09 1va0 s LEU 32 Cb -0.19 -2.43 -0.04 0.00 0.03 0.00 0.00 46.19 43.56 1va0 s LEU 32 CO -0.07 -1.06 0.09 -0.72 0.23 0.00 0.00 176.35 174.82 1va0 s TYR 33 N 2.95 2.94 0.51 0.29 1.13 0.33 -1.29 117.35 124.20 1va0 s TYR 33 Ca 0.16 -0.14 0.02 0.00 -1.41 0.00 0.00 57.07 55.70 1va0 s TYR 33 Cb -0.20 -1.34 -0.01 0.00 -1.10 0.00 0.00 41.96 39.31 1va0 s TYR 33 CO 0.11 0.55 0.04 0.16 -2.51 0.00 0.00 175.55 173.90 1va0 s ASP 34 N -3.56 4.16 0.40 -0.18 1.47 -1.19 0.13 116.67 117.90 1va0 s ASP 34 Ca 0.31 -1.60 0.22 0.00 1.18 0.00 0.00 52.55 52.66 1va0 s ASP 34 Cb -0.08 0.46 1.24 0.00 -0.34 0.00 0.00 42.92 44.21 1va0 s ASP 34 CO 0.22 -0.85 1.68 -0.09 0.68 0.00 0.00 175.17 176.81 1va0 h ARG 35 N 1.32 0.23 0.00 2.11 2.43 -1.93 -2.14 114.38 116.39 1va0 h ARG 35 Ca -0.43 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 1va0 h ARG 35 Cb 1.31 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 1va0 h ARG 35 CO 0.73 0.15 0.00 1.28 -1.51 0.00 0.00 179.97 180.62 1va0 n LEU 36 N -4.77 0.00 -4.72 3.80 4.77 -1.26 -4.78 117.00 110.03 1va0 n LEU 36 Ca 0.32 0.08 -0.35 0.00 -0.03 0.00 0.00 56.01 56.03 1va0 n LEU 36 Cb 1.15 -0.08 -0.08 0.00 -2.33 0.00 0.00 43.42 42.08 1va0 n LEU 36 CO 0.19 -0.06 -0.16 -0.69 -1.33 0.00 0.00 177.39 175.34 1va0 s VAL 37 N -2.16 5.39 0.27 4.08 1.01 -0.81 -4.16 120.40 124.03 1va0 s VAL 37 Ca 0.09 0.24 -0.29 0.00 0.00 0.00 0.00 61.98 62.01 1va0 s VAL 37 Cb 0.04 -3.50 -0.10 0.00 0.00 0.00 0.00 36.38 32.83 1va0 s VAL 37 CO 0.08 0.42 1.31 -0.62 0.00 0.00 0.00 175.10 176.30 1va0 s ASP 38 N 0.46 6.83 0.31 3.32 -1.08 -1.26 -4.96 116.67 120.30 1va0 s ASP 38 Ca 0.09 2.56 0.01 0.00 -0.52 0.00 0.00 52.55 54.70 1va0 s ASP 38 Cb -0.12 -2.63 0.56 0.00 -1.46 0.00 0.00 42.92 39.27 1va0 s ASP 38 CO -0.00 -0.53 1.93 -0.33 0.52 0.00 0.00 175.17 176.76 1va0 h GLU 39 N 4.30 0.96 -0.52 4.34 5.08 -1.97 -2.31 114.58 124.45 1va0 h GLU 39 Ca -0.47 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 57.80 1va0 h GLU 39 Cb 1.22 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 30.23 1va0 h GLU 39 CO 0.71 0.63 0.20 0.00 -1.00 0.00 0.00 179.01 179.55 1va0 h ARG 40 N 0.99 0.76 -0.24 2.33 3.08 -1.93 -0.81 114.38 118.55 1va0 h ARG 40 Ca 0.36 -0.12 -0.13 0.00 0.07 0.00 0.00 59.98 60.16 1va0 h ARG 40 Cb 0.16 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.07 1va0 h ARG 40 CO -0.12 0.64 -0.37 0.28 -1.07 0.00 0.00 179.97 179.33 1va0 h VAL 41 N 0.75 1.31 -0.73 2.04 2.07 -1.69 -3.21 116.25 116.79 1va0 h VAL 41 Ca 0.18 -1.57 -0.05 0.00 0.82 0.00 0.00 66.70 66.08 1va0 h VAL 41 Cb 0.17 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.64 1va0 h VAL 41 CO -0.01 0.49 0.26 -0.07 0.02 0.00 0.00 177.57 178.26 1va0 h LEU 42 N 0.40 1.04 -1.32 2.57 3.38 -1.11 -2.09 115.31 118.18 1va0 h LEU 42 Ca 0.02 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1va0 h LEU 42 Cb 0.96 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1va0 h LEU 42 CO 0.08 0.95 0.14 0.00 0.09 0.00 0.00 178.44 179.71 1va0 h ALA 43 N 1.13 1.10 0.00 1.53 0.00 -1.16 0.25 119.26 122.10 1va0 h ALA 43 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1va0 h ALA 43 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1va0 h ALA 43 CO -0.01 -0.10 -0.33 -0.07 0.00 0.00 0.00 179.25 178.73 1va0 h LEU 44 N 0.00 0.00 -9.04 0.00 3.38 -1.42 -3.44 115.31 104.79 1va0 h LEU 44 Ca 0.00 -0.11 -0.61 0.00 0.09 0.00 0.00 57.88 57.25 1va0 h LEU 44 Cb 0.28 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.91 1va0 h LEU 44 CO 0.00 0.05 -0.06 0.00 0.09 0.00 0.00 178.44 178.53 1va0 s ALA 45 N -3.14 3.57 -0.99 1.53 0.00 0.86 -4.49 121.76 119.09 1va0 s ALA 45 Ca 0.08 -0.55 0.25 0.00 0.00 0.00 0.00 51.96 51.74 1va0 s ALA 45 Cb 0.13 -2.82 0.42 0.00 0.00 0.00 0.00 23.12 20.84 1va0 s ALA 45 CO 0.67 -0.59 1.35 -0.35 0.00 0.00 0.00 175.76 176.84 1va0 n PRO 46 N 5.17 0.00 0.00 0.00 -0.04 -1.26 -4.93 135.00 133.94 1va0 n PRO 46 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1va0 n PRO 46 Cb 0.50 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 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 1.50 -1.36 3.67 0.55 0.00 -1.26 -4.97 105.19 103.31 1va0 n GLY 47 Ca 0.05 -1.58 -0.43 0.00 0.00 0.00 0.00 46.02 44.06 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 -1.57 4.28 -0.39 1.61 2.12 0.94 -4.88 118.70 120.81 1va0 s GLU 48 Ca 0.00 1.57 -0.14 0.00 0.36 0.00 0.00 54.97 56.75 1va0 s GLU 48 Cb 0.00 -3.67 0.01 0.00 0.26 0.00 0.00 34.13 30.73 1va0 s GLU 48 CO 0.00 -0.60 0.28 0.15 -0.54 0.00 0.00 175.26 174.55 1va0 s LYS 49 N 3.04 3.08 -0.19 4.30 1.02 -1.26 0.90 119.74 130.63 1va0 s LYS 49 Ca 0.52 -0.94 -0.02 0.00 0.02 0.00 0.00 55.97 55.55 1va0 s LYS 49 Cb -0.20 -3.93 -0.00 0.00 -0.52 0.00 0.00 37.83 33.17 1va0 s LYS 49 CO 0.14 -0.68 -0.10 0.08 -0.92 0.00 0.00 175.35 173.87 1va0 s VAL 50 N 1.68 2.99 -0.22 3.17 1.01 0.10 -4.97 120.40 124.16 1va0 s VAL 50 Ca 0.05 -0.64 -0.29 0.00 0.00 0.00 0.00 61.98 61.10 1va0 s VAL 50 Cb -0.19 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.87 1va0 s VAL 50 CO 0.10 0.47 1.28 -0.47 0.00 0.00 0.00 175.10 176.48 1va0 s TYR 51 N 1.16 2.78 0.30 5.22 6.14 -1.26 -0.52 117.35 131.17 1va0 s TYR 51 Ca 0.01 0.95 0.03 0.00 0.64 0.00 0.00 57.07 58.71 1va0 s TYR 51 Cb -0.14 -3.67 -0.01 0.00 0.42 0.00 0.00 41.96 38.55 1va0 s TYR 51 CO -0.03 -1.70 0.11 0.28 0.64 0.00 0.00 175.55 174.85 1va0 n VAL 52 N 5.74 0.00 -4.67 3.14 0.31 0.35 -4.89 118.33 118.30 1va0 n VAL 52 Ca 0.14 -1.76 0.00 0.00 -0.01 0.00 0.00 64.34 62.72 1va0 n VAL 52 Cb 0.46 0.64 0.00 0.00 -0.91 0.00 0.00 33.84 34.03 1va0 n VAL 52 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1va0 n GLU 63 N -0.67 0.00 0.00 5.55 2.13 -1.26 -3.93 120.64 122.46 1va0 n GLU 63 Ca -0.04 0.00 0.13 0.00 0.66 0.00 0.00 57.16 57.91 1va0 n GLU 63 Cb 0.45 0.00 0.37 0.00 0.27 0.00 0.00 31.44 32.53 1va0 n GLU 63 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1va0 n GLU 64 N -0.85 0.27 -0.04 5.31 -0.58 -1.26 -2.34 120.64 121.15 1va0 n GLU 64 Ca 0.00 -0.14 -0.20 0.00 -0.42 0.00 0.00 57.16 56.41 1va0 n GLU 64 Cb 0.00 -1.50 -0.13 0.00 -0.57 0.00 0.00 31.44 29.24 1va0 n GLU 64 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1va0 n ILE 65 N -1.25 1.68 -0.03 -3.67 5.41 -1.26 -3.64 119.36 116.61 1va0 n ILE 65 Ca 0.08 -0.64 -0.11 0.00 1.00 0.00 0.00 62.75 63.08 1va0 n ILE 65 Cb 0.33 -1.60 -0.05 0.00 -0.71 0.00 0.00 39.64 37.61 1va0 n ILE 65 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 176.55 177.00 1va0 h HIS 66 N 0.05 0.19 -0.19 1.39 3.86 -1.99 -2.34 115.15 116.12 1va0 h HIS 66 Ca -0.47 -0.01 -0.11 0.00 -1.16 0.00 0.00 60.37 58.62 1va0 h HIS 66 Cb 2.00 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 30.40 1va0 h HIS 66 CO 0.06 0.25 -0.34 0.00 0.86 0.00 0.00 177.93 178.76 1va0 h ARG 67 N 0.08 0.40 0.00 2.45 3.08 -1.66 -1.51 114.38 117.22 1va0 h ARG 67 Ca 0.04 -0.18 -0.03 0.00 0.07 0.00 0.00 59.98 59.89 1va0 h ARG 67 Cb 0.13 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.17 1va0 h ARG 67 CO -0.01 0.70 -0.13 1.25 -1.07 0.00 0.00 179.97 180.71 1va0 h LEU 68 N 0.34 0.00 0.09 3.04 5.85 -1.60 -2.35 115.31 120.68 1va0 h LEU 68 Ca 0.04 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.60 1va0 h LEU 68 Cb 0.77 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.82 1va0 h LEU 68 CO 0.06 0.13 -0.70 -0.07 -0.34 0.00 0.00 178.44 177.52 1va0 h LEU 69 N 0.00 0.46 -0.50 2.25 3.38 -0.75 -3.31 115.31 116.84 1va0 h LEU 69 Ca -0.00 -0.89 0.07 0.00 0.09 0.00 0.00 57.88 57.15 1va0 h LEU 69 Cb 0.46 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 1va0 h LEU 69 CO 0.02 1.31 0.17 0.25 0.09 0.00 0.00 178.44 180.27 1va0 h LEU 70 N -0.32 0.15 -0.95 1.67 5.85 -1.00 -1.71 115.31 118.99 1va0 h LEU 70 Ca -0.11 0.06 0.10 0.00 0.84 0.00 0.00 57.88 58.77 1va0 h LEU 70 Cb 1.49 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 42.50 1va0 h LEU 70 CO 0.13 0.11 0.59 -0.09 -0.34 0.00 0.00 178.44 178.85 1va0 h ARG 71 N 0.33 0.95 0.05 1.25 2.43 -1.52 -2.17 114.38 115.70 1va0 h ARG 71 Ca 0.24 -0.06 -0.25 0.00 -0.81 0.00 0.00 59.98 59.10 1va0 h ARG 71 Cb 0.27 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1va0 h ARG 71 CO -0.26 0.63 -1.22 0.45 -1.51 0.00 0.00 179.97 178.06 1va0 h HIS 72 N 0.98 0.20 -0.74 2.20 3.86 -1.59 -2.83 115.15 117.22 1va0 h HIS 72 Ca 0.45 -0.14 0.04 0.00 -1.16 0.00 0.00 60.37 59.56 1va0 h HIS 72 Cb 0.38 -0.01 -0.04 0.00 1.06 0.00 0.00 27.41 28.80 1va0 h HIS 72 CO -0.02 1.13 0.49 0.00 0.86 0.00 0.00 177.93 180.39 1va0 h ALA 73 N 0.82 1.59 0.02 2.45 0.00 -0.86 -2.18 119.26 121.09 1va0 h ALA 73 Ca -0.11 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.55 1va0 h ALA 73 Cb 1.89 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 19.43 1va0 h ALA 73 CO 0.15 0.33 -0.97 0.00 0.00 0.00 0.00 179.25 178.76 1va0 h ARG 74 N 0.88 0.29 0.00 0.00 3.08 -1.43 1.65 114.38 118.86 1va0 h ARG 74 Ca 0.30 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 1va0 h ARG 74 Cb 0.09 0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.24 1va0 h ARG 74 CO -0.09 1.06 -0.03 0.00 -1.07 0.00 0.00 179.97 179.85 1va0 h ALA 75 N 0.81 1.10 -2.30 0.04 0.00 -1.14 -3.38 119.26 114.38 1va0 h ALA 75 Ca -0.07 -0.03 -0.39 0.00 0.00 0.00 0.00 54.91 54.42 1va0 h ALA 75 Cb 1.62 -0.00 -0.14 0.00 0.00 0.00 0.00 17.79 19.27 1va0 h ALA 75 CO 0.16 0.03 -0.59 -1.01 0.00 0.00 0.00 179.25 177.85 1va0 s HIS 76 N -4.07 1.58 0.41 0.00 3.76 -1.12 -5.03 115.29 110.83 1va0 s HIS 76 Ca -0.03 -1.26 0.11 0.00 -0.15 0.00 0.00 55.06 53.73 1va0 s HIS 76 Cb 0.12 -0.90 0.86 0.00 1.11 0.00 0.00 32.58 33.77 1va0 s HIS 76 CO 0.49 -0.41 1.95 -1.35 -0.85 0.00 0.00 174.74 174.58 1va0 h PRO 77 N 2.28 0.16 -1.72 8.40 0.11 -1.88 -2.42 132.00 136.94 1va0 h PRO 77 Ca -0.36 -0.03 0.12 0.00 0.11 0.00 0.00 66.00 65.83 1va0 h PRO 77 Cb 1.25 -0.02 -0.21 0.00 0.11 0.00 0.00 31.00 32.13 1va0 h PRO 77 CO 0.57 0.31 0.58 -0.59 -0.21 0.00 0.00 178.00 178.66 1va0 s PHE 78 N -4.72 -0.32 0.10 0.65 -0.12 -1.26 -1.95 117.98 110.36 1va0 s PHE 78 Ca -0.05 0.43 -0.00 0.00 -0.05 0.00 0.00 56.93 57.26 1va0 s PHE 78 Cb 0.16 0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 42.99 1va0 s PHE 78 CO 0.72 -0.36 0.00 0.14 -0.05 0.00 0.00 175.22 175.67 1va0 s VAL 79 N -1.78 0.29 -0.17 -2.49 -7.23 0.67 -4.52 120.40 105.17 1va0 s VAL 79 Ca 0.02 -1.89 -0.02 0.00 -1.81 0.00 0.00 61.98 58.28 1va0 s VAL 79 Cb -0.01 -1.82 -0.01 0.00 0.56 0.00 0.00 36.38 35.10 1va0 s VAL 79 CO -0.02 -0.71 -0.08 -0.69 -0.31 0.00 0.00 175.10 173.28 1va0 s VAL 80 N -3.90 3.27 -0.39 1.32 1.01 -0.68 -1.31 120.40 119.72 1va0 s VAL 80 Ca 0.16 -0.56 -0.07 0.00 0.00 0.00 0.00 61.98 61.52 1va0 s VAL 80 Cb 0.07 -2.43 0.07 0.00 0.00 0.00 0.00 36.38 34.10 1va0 s VAL 80 CO -0.03 0.48 0.20 -0.60 0.00 0.00 0.00 175.10 175.15 1va0 s ARG 81 N 0.84 2.49 -0.24 2.72 6.06 0.53 -0.02 118.95 131.33 1va0 s ARG 81 Ca -0.03 -1.46 -0.13 0.00 -2.50 0.00 0.00 55.73 51.61 1va0 s ARG 81 Cb -0.15 -3.64 -0.04 0.00 0.06 0.00 0.00 34.95 31.17 1va0 s ARG 81 CO 0.01 -0.90 0.29 -1.17 -2.50 0.00 0.00 175.30 171.04 1va0 s LEU 82 N 1.36 4.10 0.13 -0.88 2.96 -0.41 -0.49 118.68 125.46 1va0 s LEU 82 Ca 0.02 0.28 0.09 0.00 -0.22 0.00 0.00 54.13 54.30 1va0 s LEU 82 Cb -0.22 -2.32 -0.04 0.00 0.50 0.00 0.00 46.19 44.11 1va0 s LEU 82 CO 0.01 -0.05 -0.20 -0.54 -1.32 0.00 0.00 176.35 174.24 1va0 s LYS 83 N 1.45 1.23 0.59 1.98 1.02 -0.15 -3.17 119.74 122.67 1va0 s LYS 83 Ca 0.13 -1.29 -0.19 0.00 0.02 0.00 0.00 55.97 54.64 1va0 s LYS 83 Cb -0.15 -1.43 -0.04 0.00 -0.52 0.00 0.00 37.83 35.69 1va0 s LYS 83 CO 0.08 0.32 1.21 0.20 -0.92 0.00 0.00 175.35 176.23 1va0 s GLY 84 N -2.26 2.74 0.00 -3.33 0.00 -1.26 0.06 107.32 103.28 1va0 s GLY 84 Ca 0.11 1.01 0.00 0.00 0.00 0.00 0.00 44.72 45.85 1va0 s GLY 84 CO 0.06 1.40 0.00 0.61 0.00 0.00 0.00 173.10 175.17 1va0 n GLY 85 N 0.50 3.46 3.57 0.20 0.00 0.16 -4.36 105.19 108.73 1va0 n GLY 85 Ca 0.13 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 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 4.97 0.57 1.61 -1.08 -1.26 -1.89 116.67 115.60 1va0 s ASP 86 Ca 0.00 -0.03 0.34 0.00 -0.52 0.00 0.00 52.55 52.34 1va0 s ASP 86 Cb 0.00 -1.66 1.72 0.00 -1.46 0.00 0.00 42.92 41.53 1va0 s ASP 86 CO 0.00 0.24 2.14 1.55 0.52 0.00 0.00 175.17 179.62 1va0 h PRO 87 N 6.17 0.00 -0.11 4.34 0.13 -1.84 -3.21 132.00 137.48 1va0 h PRO 87 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 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 0.60 0.05 0.00 -1.33 -0.23 0.00 0.00 178.00 177.10 1va0 n MET 88 N -3.33 1.55 -4.24 0.86 2.81 -1.26 -3.68 117.12 109.82 1va0 n MET 88 Ca -0.02 -0.82 -0.20 0.00 -1.81 0.00 0.00 57.70 54.86 1va0 n MET 88 Cb 0.21 -1.39 -0.16 0.00 -0.71 0.00 0.00 33.22 31.17 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 -1.86 0.62 -1.78 2.03 -7.23 -1.21 -4.85 120.40 106.11 1va0 s VAL 89 Ca 0.32 -0.20 0.00 0.00 -1.81 0.00 0.00 61.98 60.30 1va0 s VAL 89 Cb 0.17 -0.61 0.00 0.00 0.56 0.00 0.00 36.38 36.50 1va0 s VAL 89 CO 0.26 0.23 0.00 0.49 -0.31 0.00 0.00 175.10 175.77 1va0 n PHE 90 N 3.82 -0.96 -1.51 2.82 3.72 -1.26 -4.81 117.46 119.27 1va0 n PHE 90 Ca -0.23 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.17 1va0 n PHE 90 Cb 0.52 -3.89 0.00 0.00 -0.94 0.00 0.00 39.48 35.17 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 -0.96 -1.16 2.41 1.37 0.00 -1.26 -4.99 105.19 100.59 1va0 n GLY 91 Ca -0.24 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.72 -0.21 1.61 1.74 -1.26 -4.87 116.66 111.95 1va0 n ARG 92 Ca 0.00 0.99 -0.08 0.00 -0.77 0.00 0.00 57.85 57.99 1va0 n ARG 92 Cb 0.58 -5.65 0.06 0.00 -1.02 0.00 0.00 32.46 26.43 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 1.13 0.81 -0.13 0.00 -1.90 -2.67 103.07 100.31 1va0 h GLY 93 Ca -0.48 -0.79 0.05 0.00 0.00 0.00 0.00 47.33 46.11 1va0 h GLY 93 CO 0.57 0.73 0.60 -1.33 0.00 0.00 0.00 176.54 177.11 1va0 h GLY 94 N 1.02 1.39 0.88 4.60 0.00 -1.89 -0.83 103.07 108.23 1va0 h GLY 94 Ca 0.18 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 1va0 h GLY 94 CO 0.02 0.35 0.07 0.83 0.00 0.00 0.00 176.54 177.81 1va0 h GLU 95 N 1.13 0.25 -0.77 4.80 5.08 -1.88 -1.89 114.58 121.30 1va0 h GLU 95 Ca 0.39 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.69 1va0 h GLU 95 Cb 0.08 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 1va0 h GLU 95 CO -0.15 0.34 0.42 0.93 -1.00 0.00 0.00 179.01 179.56 1va0 h GLU 96 N 0.11 1.07 0.12 2.33 5.08 -1.18 -2.02 114.58 120.10 1va0 h GLU 96 Ca 0.06 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1va0 h GLU 96 Cb 0.18 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1va0 h GLU 96 CO -0.00 0.78 -0.06 0.28 -1.00 0.00 0.00 179.01 179.01 1va0 h VAL 97 N 1.08 0.95 0.26 3.13 2.07 -0.94 -2.13 116.25 120.67 1va0 h VAL 97 Ca 0.27 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 1va0 h VAL 97 Cb 0.02 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 1va0 h VAL 97 CO -0.04 0.06 -0.46 -0.07 0.02 0.00 0.00 177.57 177.08 1va0 h LEU 98 N -0.28 -1.32 -0.78 2.57 3.38 -1.12 -0.32 115.31 117.45 1va0 h LEU 98 Ca -0.02 0.12 0.17 0.00 0.09 0.00 0.00 57.88 58.25 1va0 h LEU 98 Cb 0.22 0.46 -0.14 0.00 0.09 0.00 0.00 40.66 41.29 1va0 h LEU 98 CO 0.03 -0.53 -0.09 0.15 0.09 0.00 0.00 178.44 178.08 1va0 h PHE 99 N -0.77 -0.23 -0.53 1.13 3.04 -1.38 0.13 116.94 118.33 1va0 h PHE 99 Ca -0.03 0.06 -0.06 0.00 3.98 0.00 0.00 57.97 61.92 1va0 h PHE 99 Cb 0.71 0.22 -0.02 0.00 2.56 0.00 0.00 35.95 39.43 1va0 h PHE 99 CO -0.34 -0.30 0.09 -0.07 -2.02 0.00 0.00 178.31 175.67 1va0 h LEU 100 N 0.04 0.84 -0.80 0.59 3.38 -0.95 -2.57 115.31 115.84 1va0 h LEU 100 Ca 0.41 -0.26 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 1va0 h LEU 100 Cb 0.69 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1va0 h LEU 100 CO -0.75 0.88 -0.09 -0.07 0.09 0.00 0.00 178.44 178.50 1va0 h LEU 101 N 0.76 0.79 -1.10 1.67 3.38 0.22 0.92 115.31 121.97 1va0 h LEU 101 Ca 0.16 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1va0 h LEU 101 Cb 0.39 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1va0 h LEU 101 CO 0.01 0.91 0.00 0.03 0.09 0.00 0.00 178.44 179.48 1va0 h ARG 102 N 0.73 0.00 -0.44 1.13 3.08 -0.52 -1.14 114.38 117.22 1va0 h ARG 102 Ca 0.13 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.96 1va0 h ARG 102 Cb 0.57 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.49 1va0 h ARG 102 CO 0.04 0.00 0.03 0.72 -1.07 0.00 0.00 179.97 179.69 1va0 n HIS 103 N -2.40 1.38 -0.26 3.04 8.25 -0.87 -4.94 115.22 119.42 1va0 n HIS 103 Ca 0.01 -1.60 0.00 0.00 -0.26 0.00 0.00 57.72 55.87 1va0 n HIS 103 Cb 0.19 -0.55 0.00 0.00 1.12 0.00 0.00 29.99 30.74 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 -1.08 0.41 3.65 -1.41 0.00 -0.43 -4.94 105.19 101.39 1va0 n GLY 104 Ca 0.37 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.47 3.83 0.50 1.61 1.01 0.27 -4.94 120.40 121.20 1va0 s VAL 105 Ca 0.00 1.00 -0.22 0.00 0.00 0.00 0.00 61.98 62.75 1va0 s VAL 105 Cb 0.00 -3.68 -0.06 0.00 0.00 0.00 0.00 36.38 32.64 1va0 s VAL 105 CO 0.00 -0.13 1.25 -2.84 0.00 0.00 0.00 175.10 173.38 1va0 s PRO 106 N 3.97 3.46 -0.03 2.72 0.02 -1.26 -3.76 135.00 140.12 1va0 s PRO 106 Ca 0.67 1.98 0.01 0.00 0.02 0.00 0.00 61.00 63.68 1va0 s PRO 106 Cb -0.28 -2.33 0.01 0.00 0.02 0.00 0.00 34.50 31.93 1va0 s PRO 106 CO 0.25 -0.85 -0.04 0.08 -0.33 0.00 0.00 177.00 176.10 1va0 s VAL 107 N -1.44 0.46 -0.12 3.83 1.01 -1.26 -1.77 120.40 121.12 1va0 s VAL 107 Ca 0.67 -0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.54 1va0 s VAL 107 Cb -0.34 -0.46 0.01 0.00 0.00 0.00 0.00 36.38 35.59 1va0 s VAL 107 CO 0.40 0.18 -0.20 -0.70 0.00 0.00 0.00 175.10 174.78 1va0 s GLU 108 N 0.55 2.78 -0.10 2.72 2.12 -0.06 -4.98 118.70 121.72 1va0 s GLU 108 Ca -0.07 -0.77 -0.16 0.00 0.36 0.00 0.00 54.97 54.33 1va0 s GLU 108 Cb -0.10 -2.23 -0.05 0.00 0.26 0.00 0.00 34.13 32.01 1va0 s GLU 108 CO -0.00 0.02 0.42 0.08 -0.54 0.00 0.00 175.26 175.23 1va0 s VAL 109 N 0.75 5.18 -0.34 3.70 1.01 -1.26 -0.52 120.40 128.91 1va0 s VAL 109 Ca -0.10 0.83 0.02 0.00 0.00 0.00 0.00 61.98 62.73 1va0 s VAL 109 Cb -0.16 -3.75 0.09 0.00 0.00 0.00 0.00 36.38 32.56 1va0 s VAL 109 CO 0.01 0.40 0.06 -0.69 0.00 0.00 0.00 175.10 174.88 1va0 s VAL 110 N 0.20 2.54 0.89 2.92 1.01 0.30 -4.93 120.40 123.32 1va0 s VAL 110 Ca 0.23 -2.13 -0.13 0.00 0.00 0.00 0.00 61.98 59.95 1va0 s VAL 110 Cb -0.15 -2.76 0.03 0.00 0.00 0.00 0.00 36.38 33.50 1va0 s VAL 110 CO 0.09 -0.51 0.53 -2.65 0.00 0.00 0.00 175.10 172.56 1va0 n PRO 111 N 4.37 -0.15 -3.88 2.72 -0.02 -1.26 -1.39 135.00 135.40 1va0 n PRO 111 Ca -0.01 0.01 -0.17 0.00 -2.02 0.00 0.00 63.50 61.31 1va0 n PRO 111 Cb 0.42 -1.92 -0.07 0.00 -0.02 0.00 0.00 33.50 31.91 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 1.39 3.10 3.56 -1.23 0.00 -1.26 -4.41 105.19 106.34 1va0 n GLY 112 Ca 0.08 -1.87 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 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 4.31 0.56 1.61 1.01 -1.26 -4.47 120.40 119.03 1va0 s VAL 113 Ca 0.33 0.74 -0.19 0.00 0.00 0.00 0.00 61.98 62.85 1va0 s VAL 113 Cb 0.02 -4.56 -0.05 0.00 0.00 0.00 0.00 36.38 31.79 1va0 s VAL 113 CO 0.23 -1.05 1.14 0.28 0.00 0.00 0.00 175.10 175.71 1va0 s THR 114 N 4.18 3.06 0.46 3.92 -1.32 -1.26 -3.19 115.64 121.50 1va0 s THR 114 Ca 0.38 0.66 0.30 0.00 -1.21 0.00 0.00 61.69 61.83 1va0 s THR 114 Cb -0.10 -3.26 0.33 0.00 -1.51 0.00 0.00 72.50 67.97 1va0 s THR 114 CO 0.25 -0.15 2.14 0.77 -2.21 0.00 0.00 174.62 175.43 1va0 h SER 115 N 1.11 0.00 -0.50 8.08 4.64 -1.91 -1.76 113.55 123.22 1va0 h SER 115 Ca -0.50 0.00 0.14 0.00 -0.47 0.00 0.00 61.79 60.96 1va0 h SER 115 Cb 1.27 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.34 1va0 h SER 115 CO 0.56 0.07 0.42 -0.07 -0.87 0.00 0.00 176.83 176.95 1va0 h LEU 116 N 0.00 0.00 -2.94 5.97 3.38 -2.01 0.15 115.31 119.86 1va0 h LEU 116 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1va0 h LEU 116 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1va0 h LEU 116 CO 0.01 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.72 1va0 n LEU 117 N -4.05 3.88 0.00 1.67 4.77 -0.66 -4.58 117.00 118.03 1va0 n LEU 117 Ca 0.09 -2.20 0.14 0.00 -0.03 0.00 0.00 56.01 54.01 1va0 n LEU 117 Cb 0.63 -0.44 0.70 0.00 -2.33 0.00 0.00 43.42 41.97 1va0 n LEU 117 CO 0.33 0.84 0.99 0.00 -1.33 0.00 0.00 177.39 178.22 1va0 n ALA 118 N 1.01 2.41 0.16 -1.18 0.00 0.52 -3.70 120.51 119.72 1va0 n ALA 118 Ca 0.21 -0.12 0.09 0.00 0.00 0.00 0.00 53.44 53.61 1va0 n ALA 118 Cb 0.66 -1.48 0.07 0.00 0.00 0.00 0.00 19.45 18.71 1va0 n ALA 118 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1va0 h SER 119 N 0.00 0.00 0.00 0.00 4.64 -1.81 -3.42 113.55 112.96 1va0 h SER 119 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1va0 h SER 119 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1va0 h SER 119 CO 0.00 0.14 0.00 0.61 -0.87 0.00 0.00 176.83 176.71 1va0 n GLY 120 N 1.17 1.88 3.80 -0.77 0.00 -1.24 -5.03 105.19 105.01 1va0 n GLY 120 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 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 0.00 3.80 -0.55 0.99 1.43 -1.26 -4.98 118.68 118.11 1va0 s LEU 121 Ca 0.00 1.89 -0.28 0.00 -1.03 0.00 0.00 54.13 54.71 1va0 s LEU 121 Cb 0.00 -4.55 0.03 0.00 0.03 0.00 0.00 46.19 41.70 1va0 s LEU 121 CO 0.00 -0.80 1.14 -2.16 0.23 0.00 0.00 176.35 174.76 1va0 s PRO 122 N -3.37 3.55 0.47 1.29 0.04 -1.26 -4.86 135.00 130.86 1va0 s PRO 122 Ca 0.66 0.27 0.23 0.00 0.04 0.00 0.00 61.00 62.21 1va0 s PRO 122 Cb -0.16 -3.99 1.17 0.00 0.04 0.00 0.00 34.50 31.57 1va0 s PRO 122 CO 0.22 -1.57 1.96 -0.07 0.04 0.00 0.00 177.00 177.59 1va0 h LEU 123 N 11.60 0.00 -8.69 -3.56 3.38 -1.95 -3.39 115.31 112.70 1va0 h LEU 123 Ca -0.25 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.04 1va0 h LEU 123 Cb 1.06 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 41.54 1va0 h LEU 123 CO 1.16 0.20 -0.81 0.42 0.09 0.00 0.00 178.44 179.49 1va0 s THR 124 N -4.07 2.70 -0.21 0.22 -4.23 -1.26 -4.70 115.64 104.09 1va0 s THR 124 Ca -0.02 -0.83 -0.16 0.00 -1.18 0.00 0.00 61.69 59.50 1va0 s THR 124 Cb 0.13 -2.05 0.06 0.00 1.34 0.00 0.00 72.50 71.97 1va0 s THR 124 CO 0.63 0.57 0.54 -2.28 -0.54 0.00 0.00 174.62 173.53 1va0 s HIS 125 N -0.26 -0.68 -0.16 3.99 2.46 -0.10 -4.94 115.29 115.59 1va0 s HIS 125 Ca 0.01 1.54 -0.39 0.00 0.47 0.00 0.00 55.06 56.69 1va0 s HIS 125 Cb -0.13 0.30 -0.15 0.00 -0.13 0.00 0.00 32.58 32.46 1va0 s HIS 125 CO 0.03 -0.34 1.65 -2.13 -2.47 0.00 0.00 174.74 171.48 1va0 n ARG 126 N 3.41 1.27 -0.23 2.88 0.63 -1.26 -0.51 116.66 122.84 1va0 n ARG 126 Ca -0.17 0.46 0.00 0.00 -0.92 0.00 0.00 57.85 57.22 1va0 n ARG 126 Cb 0.56 -2.16 0.00 0.00 0.45 0.00 0.00 32.46 31.32 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 3.79 2.26 0.02 5.14 0.00 -1.26 -4.77 105.19 110.36 1va0 n GLY 127 Ca 0.24 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.23 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 2.62 -3.64 0.99 4.77 0.33 -5.07 117.00 117.00 1va0 n LEU 128 Ca 0.00 -0.02 -0.07 0.00 -0.03 0.00 0.00 56.01 55.89 1va0 n LEU 128 Cb 0.00 -0.11 -0.07 0.00 -2.33 0.00 0.00 43.42 40.91 1va0 n LEU 128 CO 0.00 0.50 0.38 0.00 -1.33 0.00 0.00 177.39 176.94 1va0 s ALA 129 N -2.08 -1.91 -1.84 -1.18 0.00 -0.26 -4.79 121.76 109.70 1va0 s ALA 129 Ca -0.05 2.39 0.18 0.00 0.00 0.00 0.00 51.96 54.49 1va0 s ALA 129 Cb 0.01 -1.44 0.36 0.00 0.00 0.00 0.00 23.12 22.05 1va0 s ALA 129 CO 0.09 -0.38 1.28 -2.39 0.00 0.00 0.00 175.76 174.37 1va0 n HIS 130 N 4.20 0.46 -3.83 0.00 1.44 -1.26 -0.92 115.22 115.30 1va0 n HIS 130 Ca -0.20 -0.30 0.01 0.00 -2.01 0.00 0.00 57.72 55.22 1va0 n HIS 130 Cb 0.59 -0.01 0.01 0.00 0.12 0.00 0.00 29.99 30.70 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 -1.22 -0.18 0.24 -1.39 0.00 -1.26 -5.02 107.32 98.49 1va0 s GLY 131 Ca 0.32 0.18 -0.11 0.00 0.00 0.00 0.00 44.72 45.11 1va0 s GLY 131 CO 0.25 2.90 0.43 -0.11 0.00 0.00 0.00 173.10 176.56 1va0 s PHE 132 N -2.25 0.50 0.09 1.90 -0.12 -1.26 -4.00 117.98 112.83 1va0 s PHE 132 Ca 0.22 -0.84 0.02 0.00 -0.05 0.00 0.00 56.93 56.28 1va0 s PHE 132 Cb 0.01 0.07 -0.04 0.00 -0.63 0.00 0.00 43.02 42.43 1va0 s PHE 132 CO -0.00 -0.94 -0.07 0.00 -0.05 0.00 0.00 175.22 174.15 1va0 s ALA 133 N -4.02 0.92 -0.01 1.99 0.00 -0.89 -5.01 121.76 114.74 1va0 s ALA 133 Ca 0.25 -1.27 0.01 0.00 0.00 0.00 0.00 51.96 50.95 1va0 s ALA 133 Cb 0.00 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.27 1va0 s ALA 133 CO 0.10 -0.21 -0.03 0.00 0.00 0.00 0.00 175.76 175.61 1va0 s ALA 134 N -3.35 0.35 0.04 0.00 0.00 -1.26 -1.24 121.76 116.31 1va0 s ALA 134 Ca 0.09 -0.12 -0.05 0.00 0.00 0.00 0.00 51.96 51.88 1va0 s ALA 134 Cb 0.03 -0.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.00 1va0 s ALA 134 CO -0.04 0.06 0.09 0.54 0.00 0.00 0.00 175.76 176.41 1va0 s VAL 135 N 0.12 0.14 -0.10 0.00 0.11 -0.27 -4.97 120.40 115.43 1va0 s VAL 135 Ca -0.01 -1.17 -0.06 0.00 -2.93 0.00 0.00 61.98 57.82 1va0 s VAL 135 Cb -0.04 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.77 1va0 s VAL 135 CO -0.00 -0.64 0.12 -0.55 -3.33 0.00 0.00 175.10 170.69 1va0 s SER 136 N -2.27 6.16 0.00 3.54 0.15 -1.26 -0.99 113.70 119.03 1va0 s SER 136 Ca -0.03 0.39 0.28 0.00 0.70 0.00 0.00 55.95 57.30 1va0 s SER 136 Cb 0.00 -1.95 1.09 0.00 -1.71 0.00 0.00 66.02 63.46 1va0 s SER 136 CO -0.06 0.39 1.82 0.61 1.20 0.00 0.00 173.24 177.20 1va0 n GLY 137 N 1.92 -1.40 2.87 9.45 0.00 0.15 -4.41 105.19 113.78 1va0 n GLY 137 Ca -0.19 -0.17 -0.20 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.94 0.47 0.43 1.61 1.01 -1.23 -4.34 120.40 115.42 1va0 s VAL 138 Ca 0.15 -0.07 0.04 0.00 0.00 0.00 0.00 61.98 62.10 1va0 s VAL 138 Cb 0.19 -0.52 0.01 0.00 0.00 0.00 0.00 36.38 36.06 1va0 s VAL 138 CO 0.56 0.22 0.62 -0.76 0.00 0.00 0.00 175.10 175.73 1va0 s LEU 139 N 1.03 3.66 0.23 3.92 1.43 -0.54 -4.96 118.68 123.44 1va0 s LEU 139 Ca -0.09 -0.08 -0.31 0.00 -1.03 0.00 0.00 54.13 52.62 1va0 s LEU 139 Cb -0.14 -2.86 -0.11 0.00 0.03 0.00 0.00 46.19 43.11 1va0 s LEU 139 CO -0.01 -0.74 1.60 -1.61 0.23 0.00 0.00 176.35 175.82 1va0 s GLU 140 N -4.45 4.17 0.00 1.70 8.01 -1.26 -0.75 118.70 126.12 1va0 s GLU 140 Ca 0.51 2.49 0.00 0.00 0.01 0.00 0.00 54.97 57.98 1va0 s GLU 140 Cb -0.10 -3.08 0.00 0.00 -4.31 0.00 0.00 34.13 26.64 1va0 s GLU 140 CO 0.35 -0.62 0.00 0.41 0.01 0.00 0.00 175.26 175.41 1va0 n GLY 141 N 3.03 0.85 1.28 -1.39 0.00 -1.26 -4.42 105.19 103.27 1va0 n GLY 141 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.86 0.93 3.64 -0.02 0.00 0.07 -5.07 105.19 102.89 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 -1.65 1.59 0.06 -0.02 0.00 -1.25 -4.63 107.32 101.43 1va0 s GLY 143 Ca 0.00 -0.81 -0.10 0.00 0.00 0.00 0.00 44.72 43.81 1va0 s GLY 143 CO 0.00 -0.01 0.39 -0.19 0.00 0.00 0.00 173.10 173.29 1va0 s TYR 144 N -3.07 3.60 0.49 1.90 1.51 -1.26 -1.47 117.35 119.06 1va0 s TYR 144 Ca 0.69 0.80 -0.20 0.00 -1.01 0.00 0.00 57.07 57.35 1va0 s TYR 144 Cb -0.12 -2.16 -0.08 0.00 -0.11 0.00 0.00 41.96 39.49 1va0 s TYR 144 CO 0.56 0.55 1.02 -1.25 -1.11 0.00 0.00 175.55 175.32 1va0 s PRO 145 N -1.77 3.81 -0.46 -1.71 0.04 -1.26 -4.89 135.00 128.75 1va0 s PRO 145 Ca 0.31 1.28 -0.24 0.00 0.04 0.00 0.00 61.00 62.39 1va0 s PRO 145 Cb -0.14 -2.10 0.03 0.00 0.04 0.00 0.00 34.50 32.33 1va0 s PRO 145 CO 0.17 -0.41 0.86 0.34 0.04 0.00 0.00 177.00 177.99 1va0 s ASP 146 N -2.18 6.44 0.00 6.66 2.15 -1.26 -4.90 116.67 123.58 1va0 s ASP 146 Ca 0.66 -0.04 0.27 0.00 0.43 0.00 0.00 52.55 53.86 1va0 s ASP 146 Cb -0.15 -2.42 0.83 0.00 -0.30 0.00 0.00 42.92 40.89 1va0 s ASP 146 CO 0.22 -1.00 1.62 0.18 -0.17 0.00 0.00 175.17 176.02 1va0 n LEU 147 N 6.96 0.66 -0.24 -1.34 4.77 -1.26 -4.42 117.00 122.13 1va0 n LEU 147 Ca 0.04 -0.06 -0.01 0.00 -0.03 0.00 0.00 56.01 55.95 1va0 n LEU 147 Cb 0.48 -0.20 0.11 0.00 -2.33 0.00 0.00 43.42 41.47 1va0 n LEU 147 CO 0.61 0.13 1.10 -0.09 -1.33 0.00 0.00 177.39 177.82 1va0 h ARG 148 N 0.61 0.70 0.00 3.23 2.43 -1.97 0.25 114.38 119.62 1va0 h ARG 148 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1va0 h ARG 148 Cb 0.47 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 1va0 h ARG 148 CO 0.00 0.46 0.00 -1.35 -1.51 0.00 0.00 179.97 177.57 1va0 h PRO 149 N 0.72 0.00 0.00 0.20 0.11 -2.02 -3.17 132.00 127.83 1va0 h PRO 149 Ca 0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.42 1va0 h PRO 149 Cb 0.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.30 1va0 h PRO 149 CO -0.18 0.00 -1.47 1.19 -0.21 0.00 0.00 178.00 177.33 1va0 n PHE 150 N -2.45 0.00 -0.27 0.65 3.72 -0.42 -4.72 117.46 113.98 1va0 n PHE 150 Ca 0.02 0.00 0.23 0.00 -0.05 0.00 0.00 57.45 57.65 1va0 n PHE 150 Cb 0.25 -0.27 0.56 0.00 -0.94 0.00 0.00 39.48 39.08 1va0 n PHE 150 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1va0 h ALA 151 N 1.83 2.38 -0.35 4.37 0.00 -0.54 -2.87 119.26 124.08 1va0 h ALA 151 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1va0 h ALA 151 Cb 0.66 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1va0 h ALA 151 CO 0.00 -0.71 0.00 0.54 0.00 0.00 0.00 179.25 179.08 1va0 n ARG 152 N -4.49 2.99 -2.13 0.00 5.12 -1.26 -4.60 116.66 112.29 1va0 n ARG 152 Ca 0.22 -2.44 -0.41 0.00 -1.93 0.00 0.00 57.85 53.29 1va0 n ARG 152 Cb 0.84 -1.55 -0.03 0.00 -1.16 0.00 0.00 32.46 30.56 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 -1.77 2.88 0.27 1.55 1.01 -1.09 -4.90 120.40 118.36 1va0 s VAL 153 Ca 0.33 0.78 -0.00 0.00 0.00 0.00 0.00 61.98 63.09 1va0 s VAL 153 Cb 0.23 -3.50 0.26 0.00 0.00 0.00 0.00 36.38 33.37 1va0 s VAL 153 CO 0.14 0.14 1.81 1.55 0.00 0.00 0.00 175.10 178.75 1va0 h PRO 154 N 4.60 0.84 -5.23 2.72 0.13 -1.89 -3.38 132.00 129.80 1va0 h PRO 154 Ca -0.46 -0.05 -0.68 0.00 -0.87 0.00 0.00 66.00 63.94 1va0 h PRO 154 Cb 1.22 -0.19 -0.33 0.00 0.13 0.00 0.00 31.00 31.82 1va0 h PRO 154 CO 0.73 0.56 -0.87 0.99 -0.23 0.00 0.00 178.00 179.18 1va0 s THR 155 N -5.97 2.12 -0.06 1.56 2.01 -1.26 -4.47 115.64 109.56 1va0 s THR 155 Ca -0.12 -0.97 0.04 0.00 0.31 0.00 0.00 61.69 60.95 1va0 s THR 155 Cb 0.22 -1.84 0.00 0.00 0.01 0.00 0.00 72.50 70.89 1va0 s THR 155 CO 0.80 0.55 -0.18 -0.22 -0.69 0.00 0.00 174.62 174.88 1va0 s LEU 156 N 0.71 1.88 -0.11 4.42 2.96 -0.39 -2.10 118.68 126.06 1va0 s LEU 156 Ca -0.09 -0.39 0.02 0.00 -0.22 0.00 0.00 54.13 53.45 1va0 s LEU 156 Cb -0.16 -1.04 -0.01 0.00 0.50 0.00 0.00 46.19 45.48 1va0 s LEU 156 CO 0.00 0.12 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.29 1va0 s VAL 157 N 0.29 2.66 -0.12 1.68 1.01 -0.37 -0.33 120.40 125.22 1va0 s VAL 157 Ca -0.11 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.09 1va0 s VAL 157 Cb -0.14 -2.07 0.00 0.00 0.00 0.00 0.00 36.38 34.17 1va0 s VAL 157 CO 0.04 0.55 -0.21 -0.69 0.00 0.00 0.00 175.10 174.79 1va0 s VAL 158 N 0.20 2.24 0.10 2.92 1.01 0.59 -1.11 120.40 126.36 1va0 s VAL 158 Ca -0.11 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 60.99 1va0 s VAL 158 Cb -0.16 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 1va0 s VAL 158 CO 0.06 0.55 0.00 -0.76 0.00 0.00 0.00 175.10 174.95 1va0 s LEU 159 N 0.56 3.47 -1.49 3.92 1.43 -0.16 -1.94 118.68 124.46 1va0 s LEU 159 Ca -0.13 -0.19 -0.10 0.00 -1.03 0.00 0.00 54.13 52.69 1va0 s LEU 159 Cb -0.17 -2.19 0.07 0.00 0.03 0.00 0.00 46.19 43.93 1va0 s LEU 159 CO 0.04 0.17 0.85 0.23 0.23 0.00 0.00 176.35 177.87 1va0 n MET 160 N 0.50 -4.94 -0.04 1.70 2.81 -1.26 -0.67 117.12 115.21 1va0 n MET 160 Ca -0.11 0.56 0.02 0.00 -1.81 0.00 0.00 57.70 56.37 1va0 n MET 160 Cb 0.52 -5.29 0.05 0.00 -0.71 0.00 0.00 33.22 27.79 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 -1.66 1.20 0.28 3.03 0.00 -1.26 -2.90 105.19 103.88 1va0 n GLY 161 Ca -0.06 -0.15 -0.14 0.00 0.00 0.00 0.00 46.02 45.66 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 0.89 0.43 -0.88 1.61 2.07 -1.90 0.01 116.25 118.48 1va0 h VAL 162 Ca 0.00 -0.39 0.08 0.00 0.82 0.00 0.00 66.70 67.21 1va0 h VAL 162 Cb 0.42 0.59 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 1va0 h VAL 162 CO 0.00 0.06 0.57 1.23 0.02 0.00 0.00 177.57 179.45 1va0 h GLY 163 N -0.91 1.27 -3.49 2.17 0.00 -1.92 -1.89 103.07 98.30 1va0 h GLY 163 Ca -0.07 -0.38 -0.05 0.00 0.00 0.00 0.00 47.33 46.83 1va0 h GLY 163 CO 0.11 0.25 0.06 0.54 0.00 0.00 0.00 176.54 177.50 1va0 n ARG 164 N -4.51 4.56 -0.31 4.80 1.74 -1.22 -4.69 116.66 117.03 1va0 n ARG 164 Ca 0.14 -3.14 0.07 0.00 -0.77 0.00 0.00 57.85 54.14 1va0 n ARG 164 Cb 0.25 -2.24 0.27 0.00 -1.02 0.00 0.00 32.46 29.72 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 3.60 0.91 0.08 5.56 0.11 -0.12 -0.26 114.38 124.26 1va0 h ARG 165 Ca 0.06 -0.05 -0.00 0.00 0.10 0.00 0.00 59.98 60.08 1va0 h ARG 165 Cb 2.05 -0.21 0.00 0.00 1.11 0.00 0.00 29.97 32.92 1va0 h ARG 165 CO 0.54 0.60 -0.04 0.28 0.10 0.00 0.00 179.97 181.45 1va0 h VAL 166 N 0.94 1.05 -0.62 0.08 2.07 -1.84 0.95 116.25 118.89 1va0 h VAL 166 Ca 0.43 -0.48 0.01 0.00 0.82 0.00 0.00 66.70 67.49 1va0 h VAL 166 Cb 0.41 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 1va0 h VAL 166 CO -0.19 0.12 0.40 -0.25 0.02 0.00 0.00 177.57 177.67 1va0 h TRP 167 N -0.32 0.76 -0.28 1.57 7.01 -1.80 0.43 115.95 123.31 1va0 h TRP 167 Ca -0.01 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.00 1va0 h TRP 167 Cb 0.28 -0.25 -0.01 0.00 -2.10 0.00 0.00 29.16 27.07 1va0 h TRP 167 CO -0.00 0.46 0.14 0.82 -2.79 0.00 0.00 178.44 177.07 1va0 h ILE 168 N 0.81 1.15 -0.42 2.65 2.04 -0.91 -0.03 117.51 122.80 1va0 h ILE 168 Ca 0.24 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.68 1va0 h ILE 168 Cb -0.06 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1va0 h ILE 168 CO -0.07 0.15 0.27 0.00 0.00 0.00 0.00 178.15 178.50 1va0 h ALA 169 N 1.00 0.54 -0.72 1.87 0.00 -0.44 0.18 119.26 121.68 1va0 h ALA 169 Ca 0.10 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1va0 h ALA 169 Cb 0.11 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1va0 h ALA 169 CO -0.01 0.01 0.24 0.87 0.00 0.00 0.00 179.25 180.36 1va0 h LYS 170 N 0.57 1.10 -0.42 0.00 1.57 -0.72 -0.75 116.57 117.92 1va0 h LYS 170 Ca 0.15 -0.22 -0.07 0.00 -1.87 0.00 0.00 60.65 58.64 1va0 h LYS 170 Cb -0.03 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 1va0 h LYS 170 CO -0.03 0.93 -0.02 1.49 -0.57 0.00 0.00 179.45 181.25 1va0 h GLU 171 N 1.06 0.76 -0.51 3.15 4.57 -0.55 -0.05 114.58 123.02 1va0 h GLU 171 Ca 0.24 -0.25 -0.07 0.00 -1.18 0.00 0.00 59.36 58.10 1va0 h GLU 171 Cb 0.28 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.78 1va0 h GLU 171 CO -0.01 0.84 0.04 -0.07 -1.18 0.00 0.00 179.01 178.63 1va0 h LEU 172 N 0.59 0.79 -0.49 1.64 3.38 -0.71 0.38 115.31 120.89 1va0 h LEU 172 Ca 0.12 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1va0 h LEU 172 Cb 0.51 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1va0 h LEU 172 CO 0.03 0.83 0.19 -0.07 0.09 0.00 0.00 178.44 179.50 1va0 h LEU 173 N 0.78 0.69 -1.63 1.67 3.38 -0.90 -1.10 115.31 118.19 1va0 h LEU 173 Ca 0.16 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1va0 h LEU 173 Cb 0.41 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1va0 h LEU 173 CO 0.01 0.68 0.13 -0.09 0.09 0.00 0.00 178.44 179.27 1va0 h ARG 174 N 0.66 0.37 -0.31 1.13 2.43 -0.33 -1.35 114.38 116.97 1va0 h ARG 174 Ca 0.16 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1va0 h ARG 174 Cb 0.22 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1va0 h ARG 174 CO -0.01 0.29 0.00 1.28 -1.51 0.00 0.00 179.97 180.02 1va0 n LEU 175 N -4.45 1.64 0.00 3.80 4.77 0.06 -4.92 117.00 117.91 1va0 n LEU 175 Ca 0.01 -0.82 0.00 0.00 -0.03 0.00 0.00 56.01 55.17 1va0 n LEU 175 Cb 0.11 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 1va0 n LEU 175 CO 0.36 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.43 1va0 n GLY 176 N 0.97 0.73 3.80 -0.72 0.00 -0.51 -4.81 105.19 104.65 1va0 n GLY 176 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1va0 n GLY 176 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1va0 s ARG 177 N -0.97 3.66 -0.08 1.61 0.52 -0.48 -4.95 118.95 118.26 1va0 s ARG 177 Ca 0.00 1.32 -0.30 0.00 -0.52 0.00 0.00 55.73 56.24 1va0 s ARG 177 Cb 0.00 -2.08 -0.05 0.00 0.52 0.00 0.00 34.95 33.34 1va0 s ARG 177 CO 0.00 -0.54 1.65 0.34 0.02 0.00 0.00 175.30 176.77 1va0 s ASP 178 N -2.21 6.62 0.65 0.23 -1.08 -1.26 -4.60 116.67 115.02 1va0 s ASP 178 Ca 0.66 2.14 0.44 0.00 -0.52 0.00 0.00 52.55 55.27 1va0 s ASP 178 Cb -0.16 -2.53 2.39 0.00 -1.46 0.00 0.00 42.92 41.15 1va0 s ASP 178 CO 0.25 -0.98 2.35 1.55 0.52 0.00 0.00 175.17 178.85 1va0 h PRO 179 N 9.76 0.00 -0.03 4.34 0.13 -1.96 -0.11 132.00 144.13 1va0 h PRO 179 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1va0 h PRO 179 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1va0 h PRO 179 CO 0.96 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 179.27 1va0 n ARG 180 N -3.04 2.12 -1.65 0.86 5.12 -1.26 -1.26 116.66 117.55 1va0 n ARG 180 Ca -0.03 -1.63 -0.47 0.00 -1.93 0.00 0.00 57.85 53.80 1va0 n ARG 180 Cb 0.07 -1.47 -0.04 0.00 -1.16 0.00 0.00 32.46 29.86 1va0 n ARG 180 CO 0.00 0.00 0.00 -1.91 -1.93 0.00 0.00 177.63 173.79 1va0 n GLU 181 N 0.98 1.88 -2.55 5.56 2.13 -0.06 -4.70 120.64 123.87 1va0 n GLU 181 Ca 0.16 0.67 -0.40 0.00 0.66 0.00 0.00 57.16 58.25 1va0 n GLU 181 Cb 0.52 -2.36 -0.05 0.00 0.27 0.00 0.00 31.44 29.82 1va0 n GLU 181 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1va0 s PRO 182 N 0.32 4.68 0.13 5.31 0.04 -1.26 -1.04 135.00 143.17 1va0 s PRO 182 Ca 0.76 1.71 0.03 0.00 0.04 0.00 0.00 61.00 63.54 1va0 s PRO 182 Cb -0.73 -3.19 -0.04 0.00 0.04 0.00 0.00 34.50 30.58 1va0 s PRO 182 CO 0.44 0.28 -0.09 0.95 0.04 0.00 0.00 177.00 178.63 1va0 s THR 183 N -1.19 0.99 -0.02 1.26 -4.23 0.12 -2.20 115.64 110.36 1va0 s THR 183 Ca 0.44 -2.01 -0.00 0.00 -1.18 0.00 0.00 61.69 58.93 1va0 s THR 183 Cb -0.30 -1.79 0.03 0.00 1.34 0.00 0.00 72.50 71.78 1va0 s THR 183 CO 0.38 -0.79 0.04 -0.22 -0.54 0.00 0.00 174.62 173.49 1va0 s LEU 184 N -3.12 1.00 -0.18 4.79 2.96 0.13 -1.86 118.68 122.40 1va0 s LEU 184 Ca 0.15 0.06 -0.06 0.00 -0.22 0.00 0.00 54.13 54.07 1va0 s LEU 184 Cb 0.04 -0.04 -0.03 0.00 0.50 0.00 0.00 46.19 46.66 1va0 s LEU 184 CO -0.01 -0.14 0.02 -0.36 -1.32 0.00 0.00 176.35 174.54 1va0 s PHE 185 N 1.14 3.15 -0.33 5.38 0.08 0.22 0.09 117.98 127.70 1va0 s PHE 185 Ca -0.08 -0.11 0.01 0.00 0.12 0.00 0.00 56.93 56.86 1va0 s PHE 185 Cb -0.13 -2.04 0.08 0.00 -0.57 0.00 0.00 43.02 40.36 1va0 s PHE 185 CO -0.03 0.04 0.05 0.08 -0.10 0.00 0.00 175.22 175.25 1va0 s VAL 186 N 0.46 2.68 0.27 -0.44 1.01 0.57 0.03 120.40 124.99 1va0 s VAL 186 Ca 0.00 -1.90 -0.29 0.00 0.00 0.00 0.00 61.98 59.80 1va0 s VAL 186 Cb -0.13 -2.76 -0.09 0.00 0.00 0.00 0.00 36.38 33.39 1va0 s VAL 186 CO 0.02 -0.39 0.95 -1.61 0.00 0.00 0.00 175.10 174.07 1va0 s GLU 187 N 1.09 4.74 -1.32 2.72 2.02 0.12 -1.11 118.70 126.95 1va0 s GLU 187 Ca 0.03 1.46 -0.18 0.00 0.02 0.00 0.00 54.97 56.29 1va0 s GLU 187 Cb -0.20 -3.10 0.03 0.00 0.10 0.00 0.00 34.13 30.95 1va0 s GLU 187 CO -0.05 0.40 0.34 0.54 0.02 0.00 0.00 175.26 176.52 1va0 n ARG 188 N 1.13 -0.56 -1.77 1.61 1.74 -0.84 -2.08 116.66 115.89 1va0 n ARG 188 Ca -0.00 0.05 -0.38 0.00 -0.77 0.00 0.00 57.85 56.75 1va0 n ARG 188 Cb 0.48 -2.83 0.05 0.00 -1.02 0.00 0.00 32.46 29.14 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 -3.94 2.62 0.00 7.54 0.00 -1.26 -2.62 121.76 124.10 1va0 s ALA 189 Ca 0.25 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.49 1va0 s ALA 189 Cb -0.14 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.42 1va0 s ALA 189 CO 0.95 -1.47 0.00 0.45 0.00 0.00 0.00 175.76 175.69 1va0 n SER 190 N -1.43 0.00 -4.71 0.00 2.88 -1.26 -4.61 113.62 104.49 1va0 n SER 190 Ca 0.13 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.41 1va0 n SER 190 Cb 0.46 0.00 0.10 0.00 -0.75 0.00 0.00 64.21 64.03 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 -0.63 2.19 0.19 2.46 -4.23 -1.08 -4.27 115.64 110.26 1va0 s THR 191 Ca 0.00 -0.28 0.32 0.00 -1.18 0.00 0.00 61.69 60.56 1va0 s THR 191 Cb 0.00 -2.91 0.36 0.00 1.34 0.00 0.00 72.50 71.29 1va0 s THR 191 CO 0.00 0.00 2.00 -0.65 -0.54 0.00 0.00 174.62 175.43 1va0 h PRO 192 N -0.81 0.00 -0.59 3.99 0.11 -1.95 -2.35 132.00 130.40 1va0 h PRO 192 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1va0 h PRO 192 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1va0 h PRO 192 CO 0.52 0.05 0.00 1.63 -0.21 0.00 0.00 178.00 179.99 1va0 n LYS 193 N -3.19 2.77 -1.71 1.05 4.76 -1.26 -4.94 118.16 115.65 1va0 n LYS 193 Ca -0.00 -1.92 -0.42 0.00 -2.87 0.00 0.00 58.31 53.10 1va0 n LYS 193 Cb 0.30 -1.65 -0.03 0.00 -1.84 0.00 0.00 35.03 31.81 1va0 n LYS 193 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1va0 s GLU 194 N -1.70 4.14 -0.09 1.97 2.12 -0.89 -4.69 118.70 119.56 1va0 s GLU 194 Ca 0.35 2.60 0.00 0.00 0.36 0.00 0.00 54.97 58.28 1va0 s GLU 194 Cb 0.22 -3.69 0.02 0.00 0.26 0.00 0.00 34.13 30.94 1va0 s GLU 194 CO 0.17 -0.86 -0.07 0.50 -0.54 0.00 0.00 175.26 174.46 1va0 s ARG 195 N 3.02 1.38 -0.13 4.30 3.52 -0.88 -4.97 118.95 125.19 1va0 s ARG 195 Ca 0.82 -0.22 -0.13 0.00 -0.13 0.00 0.00 55.73 56.06 1va0 s ARG 195 Cb -0.45 -1.41 -0.05 0.00 -1.56 0.00 0.00 34.95 31.48 1va0 s ARG 195 CO 0.37 -0.20 0.30 1.03 -0.81 0.00 0.00 175.30 175.99 1va0 s ARG 196 N 1.48 4.13 -0.18 5.12 0.52 -1.26 -0.70 118.95 128.05 1va0 s ARG 196 Ca -0.00 0.12 0.01 0.00 -0.52 0.00 0.00 55.73 55.34 1va0 s ARG 196 Cb -0.13 -3.37 0.03 0.00 0.52 0.00 0.00 34.95 32.00 1va0 s ARG 196 CO -0.05 0.35 -0.14 0.08 0.02 0.00 0.00 175.30 175.56 1va0 s VAL 197 N 0.11 1.76 -0.07 3.52 1.01 0.10 -4.98 120.40 121.86 1va0 s VAL 197 Ca 0.17 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 61.10 1va0 s VAL 197 Cb -0.13 -1.72 -0.05 0.00 0.00 0.00 0.00 36.38 34.47 1va0 s VAL 197 CO 0.05 0.33 0.31 -1.00 0.00 0.00 0.00 175.10 174.79 1va0 s HIS 198 N 1.37 3.62 -0.15 5.22 3.76 -1.26 -0.61 115.29 127.25 1va0 s HIS 198 Ca 0.02 0.77 -0.29 0.00 -0.15 0.00 0.00 55.06 55.40 1va0 s HIS 198 Cb -0.15 -2.21 0.10 0.00 1.11 0.00 0.00 32.58 31.44 1va0 s HIS 198 CO -0.10 0.56 0.88 0.00 -0.85 0.00 0.00 174.74 175.23 1va0 s ALA 199 N -0.66 -1.87 0.58 -1.40 0.00 -0.78 -5.02 121.76 112.61 1va0 s ALA 199 Ca 0.20 1.57 -0.14 0.00 0.00 0.00 0.00 51.96 53.59 1va0 s ALA 199 Cb -0.14 -0.61 -0.06 0.00 0.00 0.00 0.00 23.12 22.31 1va0 s ALA 199 CO 0.08 -0.32 1.01 1.03 0.00 0.00 0.00 175.76 177.57 1va0 s ARG 200 N -0.85 3.72 0.23 0.00 0.52 -1.26 0.15 118.95 121.46 1va0 s ARG 200 Ca -0.04 0.86 -0.06 0.00 -0.52 0.00 0.00 55.73 55.97 1va0 s ARG 200 Cb -0.01 -2.10 0.36 0.00 0.52 0.00 0.00 34.95 33.72 1va0 s ARG 200 CO 0.03 -0.47 1.79 1.25 0.02 0.00 0.00 175.30 177.93 1va0 h LEU 201 N 0.22 0.53 -1.31 2.53 5.85 -1.09 -2.10 115.31 119.94 1va0 h LEU 201 Ca -0.45 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.32 1va0 h LEU 201 Cb 1.19 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.15 1va0 h LEU 201 CO 0.61 0.30 0.37 1.05 -0.34 0.00 0.00 178.44 180.44 1va0 h GLU 202 N 0.66 0.84 -0.00 1.25 4.11 -1.48 -0.83 114.58 119.13 1va0 h GLU 202 Ca 0.37 -0.07 -0.05 0.00 0.07 0.00 0.00 59.36 59.68 1va0 h GLU 202 Cb 0.37 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1va0 h GLU 202 CO -0.26 0.59 -0.23 0.93 0.07 0.00 0.00 179.01 180.11 1va0 h GLU 203 N 0.85 0.01 -0.08 1.06 5.08 -1.64 -0.02 114.58 119.83 1va0 h GLU 203 Ca 0.22 -0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.46 1va0 h GLU 203 Cb -0.03 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.22 1va0 h GLU 203 CO -0.04 0.24 -0.43 0.28 -1.00 0.00 0.00 179.01 178.05 1va0 h VAL 204 N 0.01 1.40 0.00 3.13 2.07 -1.00 -1.76 116.25 120.09 1va0 h VAL 204 Ca -0.00 -1.81 -0.02 0.00 0.82 0.00 0.00 66.70 65.69 1va0 h VAL 204 Cb 0.41 2.29 -0.00 0.00 -1.52 0.00 0.00 31.29 32.46 1va0 h VAL 204 CO 0.03 0.53 -0.11 0.00 0.02 0.00 0.00 177.57 178.04 1va0 h ALA 205 N 0.44 1.59 -0.09 1.67 0.00 -0.91 -0.94 119.26 121.02 1va0 h ALA 205 Ca -0.03 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1va0 h ALA 205 Cb 1.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1va0 h ALA 205 CO 0.09 0.13 0.00 0.39 0.00 0.00 0.00 179.25 179.86 1va0 n GLU 206 N -4.08 1.32 -2.33 0.00 1.02 -0.06 -4.85 120.64 111.67 1va0 n GLU 206 Ca -0.02 -0.49 -0.15 0.00 -0.02 0.00 0.00 57.16 56.47 1va0 n GLU 206 Cb 0.19 -1.29 -0.00 0.00 -0.02 0.00 0.00 31.44 30.32 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 0.89 -0.24 0.02 0.62 0.00 -0.36 -4.91 105.19 101.21 1va0 n GLY 207 Ca 0.13 -0.24 0.11 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.50 0.24 -3.47 1.61 5.02 -0.67 -4.92 118.16 113.48 1va0 n LYS 208 Ca -0.17 -0.02 -0.38 0.00 -2.02 0.00 0.00 58.31 55.72 1va0 n LYS 208 Cb 0.63 -1.56 -0.09 0.00 -0.02 0.00 0.00 35.03 33.99 1va0 n LYS 208 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1va0 s VAL 209 N -3.17 5.23 -0.25 -0.18 1.01 -1.25 -5.03 120.40 116.76 1va0 s VAL 209 Ca 0.04 0.47 -0.19 0.00 0.00 0.00 0.00 61.98 62.30 1va0 s VAL 209 Cb 0.15 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.86 1va0 s VAL 209 CO 0.82 0.23 0.57 -0.70 0.00 0.00 0.00 175.10 176.01 1va0 s GLU 210 N 1.65 4.09 -0.05 2.72 2.12 -1.26 -5.04 118.70 122.94 1va0 s GLU 210 Ca 0.13 0.43 -0.11 0.00 0.36 0.00 0.00 54.97 55.78 1va0 s GLU 210 Cb -0.15 -3.65 0.02 0.00 0.26 0.00 0.00 34.13 30.61 1va0 s GLU 210 CO 0.09 -0.37 0.26 0.08 -0.54 0.00 0.00 175.26 174.78 1va0 s VAL 211 N 2.36 0.04 0.08 3.70 1.01 -1.26 -5.03 120.40 121.30 1va0 s VAL 211 Ca 0.24 -0.31 0.08 0.00 0.00 0.00 0.00 61.98 61.99 1va0 s VAL 211 Cb -0.16 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.71 1va0 s VAL 211 CO 0.09 -0.17 -0.22 -0.13 0.00 0.00 0.00 175.10 174.66 1va0 s ARG 212 N -0.69 1.34 0.57 2.72 0.52 -1.26 -4.95 118.95 117.20 1va0 s ARG 212 Ca -0.08 -1.11 -0.15 0.00 -0.52 0.00 0.00 55.73 53.88 1va0 s ARG 212 Cb -0.04 -1.58 -0.05 0.00 0.52 0.00 0.00 34.95 33.79 1va0 s ARG 212 CO 0.02 0.39 1.02 -1.25 0.02 0.00 0.00 175.30 175.49 1va0 s PRO 213 N -1.59 3.67 0.24 3.54 0.04 -1.26 -4.27 135.00 135.37 1va0 s PRO 213 Ca 0.09 0.96 -0.21 0.00 0.04 0.00 0.00 61.00 61.87 1va0 s PRO 213 Cb -0.10 -2.09 -0.09 0.00 0.04 0.00 0.00 34.50 32.27 1va0 s PRO 213 CO 0.03 -0.51 0.77 -1.25 0.04 0.00 0.00 177.00 176.09 1va0 s PRO 214 N -4.40 4.34 -0.06 0.56 0.04 -1.26 -4.99 135.00 129.22 1va0 s PRO 214 Ca 0.59 0.98 -0.11 0.00 0.04 0.00 0.00 61.00 62.50 1va0 s PRO 214 Cb -0.12 -2.88 0.02 0.00 0.04 0.00 0.00 34.50 31.57 1va0 s PRO 214 CO 0.39 0.38 0.27 0.00 0.04 0.00 0.00 177.00 178.08 1va0 s ALA 215 N -1.53 -0.67 0.03 8.56 0.00 -1.26 -1.99 121.76 124.91 1va0 s ALA 215 Ca 0.44 0.49 -0.18 0.00 0.00 0.00 0.00 51.96 52.71 1va0 s ALA 215 Cb -0.17 -0.19 -0.06 0.00 0.00 0.00 0.00 23.12 22.70 1va0 s ALA 215 CO 0.22 -0.19 0.50 -1.17 0.00 0.00 0.00 175.76 175.12 1va0 s LEU 216 N -0.60 4.49 -0.19 0.00 2.96 -0.27 -4.41 118.68 120.67 1va0 s LEU 216 Ca -0.07 1.12 0.01 0.00 -0.22 0.00 0.00 54.13 54.96 1va0 s LEU 216 Cb -0.04 -2.76 0.04 0.00 0.50 0.00 0.00 46.19 43.93 1va0 s LEU 216 CO 0.02 0.27 -0.11 0.86 -1.32 0.00 0.00 176.35 176.07 1va0 s TRP 217 N -0.95 2.36 -0.14 5.38 -0.00 -0.82 -0.32 118.94 124.46 1va0 s TRP 217 Ca 0.27 -1.52 -0.02 0.00 -0.00 0.00 0.00 56.10 54.83 1va0 s TRP 217 Cb -0.18 -1.62 -0.02 0.00 -0.00 0.00 0.00 33.47 31.65 1va0 s TRP 217 CO 0.16 -0.73 -0.07 0.42 -0.00 0.00 0.00 176.95 176.73 1va0 s ILE 218 N 1.42 3.58 -0.10 5.86 1.01 0.11 -0.30 121.20 132.78 1va0 s ILE 218 Ca -0.00 -0.48 0.03 0.00 0.00 0.00 0.00 60.65 60.21 1va0 s ILE 218 Cb -0.16 -2.54 0.00 0.00 0.01 0.00 0.00 42.46 39.78 1va0 s ILE 218 CO -0.08 0.51 -0.22 -0.76 0.00 0.00 0.00 174.94 174.39 1va0 s LEU 219 N 0.23 2.03 0.00 2.97 1.02 0.55 0.19 118.68 125.67 1va0 s LEU 219 Ca -0.05 -0.53 0.00 0.00 0.02 0.00 0.00 54.13 53.57 1va0 s LEU 219 Cb -0.14 -1.34 0.00 0.00 0.02 0.00 0.00 46.19 44.73 1va0 s LEU 219 CO 0.04 0.13 0.00 0.61 0.02 0.00 0.00 176.35 177.14 1va0 n GLY 220 N 3.68 3.91 0.30 -3.19 0.00 -0.94 -1.26 105.19 107.70 1va0 n GLY 220 Ca -0.20 -1.35 0.13 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.01 1.61 4.39 -1.80 -2.16 114.58 116.61 1va0 h GLU 221 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 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 0.27 -0.39 -1.16 0.00 0.00 179.01 177.73 1va0 h VAL 222 N 0.00 0.01 -0.44 3.13 -1.51 -1.91 0.23 116.25 115.76 1va0 h VAL 222 Ca 0.06 0.00 0.04 0.00 -1.23 0.00 0.00 66.70 65.56 1va0 h VAL 222 Cb 0.25 0.74 -0.02 0.00 -2.13 0.00 0.00 31.29 30.12 1va0 h VAL 222 CO -0.00 0.00 0.29 0.58 -1.23 0.00 0.00 177.57 177.21 1va0 h VAL 223 N 0.00 1.01 -0.64 7.19 2.07 -1.71 -2.47 116.25 121.70 1va0 h VAL 223 Ca 0.01 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1va0 h VAL 223 Cb 0.54 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1va0 h VAL 223 CO -0.00 0.08 0.00 0.54 0.02 0.00 0.00 177.57 178.21 1va0 n ARG 224 N -4.48 2.65 -0.35 1.57 1.74 0.07 -4.65 116.66 113.22 1va0 n ARG 224 Ca 0.05 -2.55 0.11 0.00 -0.77 0.00 0.00 57.85 54.68 1va0 n ARG 224 Cb 0.18 -1.56 0.30 0.00 -1.02 0.00 0.00 32.46 30.36 1va0 n ARG 224 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 1va0 h VAL 225 N 4.37 0.81 -0.48 1.55 3.04 -1.52 -2.40 116.25 121.62 1va0 h VAL 225 Ca 0.00 -0.29 0.00 0.00 -1.01 0.00 0.00 66.70 65.40 1va0 h VAL 225 Cb 0.99 -0.11 0.00 0.00 -2.01 0.00 0.00 31.29 30.16 1va0 h VAL 225 CO 0.00 0.15 0.00 0.49 -1.01 0.00 0.00 177.57 177.20 1va0 n PHE 226 N -4.67 1.65 -2.87 3.17 3.72 -1.26 -4.95 117.46 112.25 1va0 n PHE 226 Ca 0.21 -0.76 -0.41 0.00 -0.05 0.00 0.00 57.45 56.43 1va0 n PHE 226 Cb 0.47 -0.42 -0.04 0.00 -0.94 0.00 0.00 39.48 38.55 1va0 n PHE 226 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1va0 s ALA 227 N -2.68 3.36 0.77 4.37 0.00 -0.91 -1.66 121.76 125.02 1va0 s ALA 227 Ca 0.50 0.22 -0.15 0.00 0.00 0.00 0.00 51.96 52.53 1va0 s ALA 227 Cb 0.38 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 20.29 1va0 s ALA 227 CO 0.14 -0.38 0.53 0.39 0.00 0.00 0.00 175.76 176.45 1va0 n GLU 228 N 4.45 0.18 0.04 0.00 -0.58 -0.14 -4.92 120.64 119.67 1va0 n GLU 228 Ca 0.04 0.11 -0.22 0.00 -0.42 0.00 0.00 57.16 56.66 1va0 n GLU 228 Cb 0.50 -1.87 -0.14 0.00 -0.57 0.00 0.00 31.44 29.36 1va0 n GLU 228 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1va0 h LYS 229 N -0.63 0.30 0.00 3.49 1.57 -1.95 -3.34 116.57 116.02 1va0 h LYS 229 Ca -0.45 -0.52 0.00 0.00 -1.87 0.00 0.00 60.65 57.81 1va0 h LYS 229 Cb 1.33 0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.84 1va0 h LYS 229 CO 0.41 1.25 0.00 0.39 -0.57 0.00 0.00 179.45 180.93 1va0 n GLU 230 N -3.83 0.46 0.00 3.15 -0.58 -1.26 -4.92 120.64 113.66 1va0 n GLU 230 Ca -0.24 0.05 0.00 0.00 -0.42 0.00 0.00 57.16 56.55 1va0 n GLU 230 Cb 0.96 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 30.33 1va0 n GLU 230 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1va0 n ALA 231 N -1.15 0.00 -0.89 0.62 0.00 -1.25 -5.05 120.51 112.79 1va0 n ALA 231 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.24 1va0 n ALA 231 Cb 0.12 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.53 1va0 n ALA 231 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1va0 n PRO 232 N -0.07 1.62 -4.66 0.00 -0.04 -1.26 -3.90 135.00 126.69 1va0 n PRO 232 Ca 0.00 -1.58 -0.33 0.00 -0.04 0.00 0.00 63.50 61.55 1va0 n PRO 232 Cb 0.00 -2.65 -0.15 0.00 -0.04 0.00 0.00 33.50 30.65 1va0 n PRO 232 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1va0 s VAL 233 N 4.38 2.72 -0.85 0.52 1.01 -1.26 -4.99 120.40 121.92 1va0 s VAL 233 Ca 0.47 -0.76 -0.25 0.00 0.00 0.00 0.00 61.98 61.44 1va0 s VAL 233 Cb 0.12 -2.14 0.04 0.00 0.00 0.00 0.00 36.38 34.40 1va0 s VAL 233 CO 0.05 0.52 1.34 -0.62 0.00 0.00 0.00 175.10 176.39 1va0 s ASP 234 N 0.65 6.31 0.50 3.32 -1.08 -1.26 -0.97 116.67 124.13 1va0 s ASP 234 Ca -0.08 -0.90 0.18 0.00 -0.52 0.00 0.00 52.55 51.23 1va0 s ASP 234 Cb -0.16 -2.56 1.23 0.00 -1.46 0.00 0.00 42.92 39.98 1va0 s ASP 234 CO 0.02 -1.68 2.06 0.00 0.52 0.00 0.00 175.17 176.09 1va0 h ALA 235 N 9.90 2.14 -0.11 3.66 0.00 -1.68 -2.83 119.26 130.34 1va0 h ALA 235 Ca -0.08 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1va0 h ALA 235 Cb 1.03 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1va0 h ALA 235 CO 1.33 -0.22 -0.12 1.25 0.00 0.00 0.00 179.25 181.50 1va0 h LEU 236 N 0.12 0.29 -1.51 0.00 5.85 -1.90 -3.23 115.31 114.94 1va0 h LEU 236 Ca 0.15 -0.49 0.01 0.00 0.84 0.00 0.00 57.88 58.39 1va0 h LEU 236 Cb 0.43 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 1va0 h LEU 236 CO -0.02 0.72 0.34 0.00 -0.34 0.00 0.00 178.44 179.15 1va0 h ALA 237 N 0.58 1.66 -0.03 1.25 0.00 -1.89 -3.55 119.26 117.27 1va0 h ALA 237 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1va0 h ALA 237 Cb 0.65 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1va0 h ALA 237 CO 0.03 0.31 0.00 1.28 0.00 0.00 0.00 179.25 180.87