#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1va5 n PHE 1 N 0.00 0.00 0.00 3.17 -0.00 -1.26 -4.60 117.46 114.77 1va5 n PHE 1 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1va5 n PHE 1 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.48 1va5 n PHE 1 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 1va5 n SER 2 N -0.09 0.00 -3.20 -2.13 7.64 -1.26 -4.67 113.62 109.91 1va5 n SER 2 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1va5 n SER 2 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1va5 n SER 2 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1va5 n ARG 3 N 0.00 -0.86 -0.14 1.43 5.12 -1.26 -4.75 116.66 116.20 1va5 n ARG 3 Ca 0.00 -0.43 0.09 0.00 -1.93 0.00 0.00 57.85 55.58 1va5 n ARG 3 Cb 0.00 0.77 0.16 0.00 -1.16 0.00 0.00 32.46 32.23 1va5 n ARG 3 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 1va5 n PRO 4 N -0.79 2.15 0.00 5.56 -0.04 -1.26 -4.88 135.00 135.74 1va5 n PRO 4 Ca 0.00 -1.98 0.00 0.00 -0.04 0.00 0.00 63.50 61.48 1va5 n PRO 4 Cb 0.00 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 1va5 n PRO 4 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1va5 n GLY 5 N 1.08 1.24 3.84 0.55 0.00 -1.26 -5.12 105.19 105.51 1va5 n GLY 5 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1va5 n GLY 5 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1va5 s LEU 6 N 0.00 3.76 -1.45 0.99 1.43 -1.26 -4.95 118.68 117.19 1va5 s LEU 6 Ca 0.00 1.55 -0.09 0.00 -1.03 0.00 0.00 54.13 54.56 1va5 s LEU 6 Cb 0.00 -4.45 -0.09 0.00 0.03 0.00 0.00 46.19 41.68 1va5 s LEU 6 CO 0.00 -0.48 2.85 -0.81 0.23 0.00 0.00 176.35 178.14 1va5 n PRO 7 N -1.21 3.38 -3.37 1.29 -0.04 -1.26 -4.91 135.00 128.88 1va5 n PRO 7 Ca 0.06 -2.03 -0.38 0.00 -0.04 0.00 0.00 63.50 61.11 1va5 n PRO 7 Cb 0.54 -2.71 -0.07 0.00 -0.04 0.00 0.00 33.50 31.21 1va5 n PRO 7 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1va5 s VAL 8 N 2.33 5.19 0.19 0.52 1.01 -1.26 -4.34 120.40 124.03 1va5 s VAL 8 Ca 0.65 0.74 0.06 0.00 0.00 0.00 0.00 61.98 63.43 1va5 s VAL 8 Cb 0.17 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 1va5 s VAL 8 CO -0.05 0.24 0.12 -1.61 0.00 0.00 0.00 175.10 173.80 1va5 s GLU 9 N 1.35 2.80 -0.24 2.72 2.02 0.17 -4.92 118.70 122.61 1va5 s GLU 9 Ca 0.20 -0.97 0.00 0.00 0.02 0.00 0.00 54.97 54.22 1va5 s GLU 9 Cb -0.15 -2.56 0.04 0.00 0.10 0.00 0.00 34.13 31.56 1va5 s GLU 9 CO 0.08 0.46 -0.11 0.71 0.02 0.00 0.00 175.26 176.42 1va5 s TYR 10 N -1.85 3.07 0.17 1.61 1.51 -1.26 -0.04 117.35 120.56 1va5 s TYR 10 Ca 0.31 -1.83 0.06 0.00 -1.01 0.00 0.00 57.07 54.60 1va5 s TYR 10 Cb -0.09 -1.99 -0.04 0.00 -0.11 0.00 0.00 41.96 39.73 1va5 s TYR 10 CO 0.23 -0.80 0.07 -0.51 -1.11 0.00 0.00 175.55 173.43 1va5 s LEU 11 N 1.24 3.57 -0.36 -1.29 1.43 0.93 -4.93 118.68 119.26 1va5 s LEU 11 Ca -0.02 -0.27 -0.00 0.00 -1.03 0.00 0.00 54.13 52.81 1va5 s LEU 11 Cb -0.17 -2.19 0.10 0.00 0.03 0.00 0.00 46.19 43.96 1va5 s LEU 11 CO -0.06 0.07 0.11 -1.10 0.23 0.00 0.00 176.35 175.59 1va5 s GLN 12 N -3.07 1.90 -0.34 1.70 -1.52 -1.26 -0.85 119.66 116.21 1va5 s GLN 12 Ca 0.29 -1.74 -0.11 0.00 -1.95 0.00 0.00 55.36 51.85 1va5 s GLN 12 Cb -0.10 -3.36 0.00 0.00 -0.22 0.00 0.00 33.01 29.33 1va5 s GLN 12 CO 0.21 -0.94 0.20 0.08 -0.25 0.00 0.00 175.29 174.60 1va5 s VAL 13 N 1.07 4.84 0.26 1.09 1.01 -0.30 -4.87 120.40 123.49 1va5 s VAL 13 Ca 0.06 -0.48 -0.31 0.00 0.00 0.00 0.00 61.98 61.26 1va5 s VAL 13 Cb -0.21 -3.55 -0.11 0.00 0.00 0.00 0.00 36.38 32.51 1va5 s VAL 13 CO -0.05 -0.05 1.60 -2.84 0.00 0.00 0.00 175.10 173.76 1va5 s PRO 14 N 1.64 4.15 -0.36 2.72 0.02 -1.26 -0.50 135.00 141.40 1va5 s PRO 14 Ca 0.04 2.53 -0.01 0.00 0.02 0.00 0.00 61.00 63.59 1va5 s PRO 14 Cb -0.18 -3.06 0.09 0.00 0.02 0.00 0.00 34.50 31.38 1va5 s PRO 14 CO 0.08 -0.63 0.11 0.45 -0.33 0.00 0.00 177.00 176.67 1va5 s SER 15 N 0.70 5.02 0.24 2.53 0.15 0.13 -4.85 113.70 117.61 1va5 s SER 15 Ca 0.66 -1.87 -0.06 0.00 0.70 0.00 0.00 55.95 55.38 1va5 s SER 15 Cb -0.47 -1.74 0.24 0.00 -1.71 0.00 0.00 66.02 62.33 1va5 s SER 15 CO 0.42 -0.43 1.82 0.00 1.20 0.00 0.00 173.24 176.25 1va5 h ALA 16 N 7.92 1.13 -0.22 5.45 0.00 -1.94 -0.03 119.26 131.56 1va5 h ALA 16 Ca -0.13 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 1va5 h ALA 16 Cb 1.04 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1va5 h ALA 16 CO 0.61 0.64 -0.16 0.66 0.00 0.00 0.00 179.25 180.99 1va5 h SER 17 N 1.12 0.36 0.02 0.00 4.64 -1.94 -2.95 113.55 114.80 1va5 h SER 17 Ca 0.26 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1va5 h SER 17 Cb 0.16 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1va5 h SER 17 CO -0.03 0.55 -0.50 0.23 -0.87 0.00 0.00 176.83 176.21 1va5 n MET 18 N -4.20 1.07 -2.62 4.77 2.81 -1.07 -4.87 117.12 113.02 1va5 n MET 18 Ca -0.00 -0.86 -0.18 0.00 -1.81 0.00 0.00 57.70 54.85 1va5 n MET 18 Cb 0.32 -1.48 0.01 0.00 -0.71 0.00 0.00 33.22 31.36 1va5 n MET 18 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1va5 n GLY 19 N 1.42 -0.33 3.84 3.03 0.00 -0.05 -4.80 105.19 108.30 1va5 n GLY 19 Ca 0.09 -0.09 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 1va5 n GLY 19 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1va5 s ARG 20 N -5.19 1.84 -0.06 1.61 1.70 -1.11 -5.02 118.95 112.72 1va5 s ARG 20 Ca 0.13 -1.07 -0.15 0.00 -0.47 0.00 0.00 55.73 54.17 1va5 s ARG 20 Cb -0.06 0.60 -0.05 0.00 -0.57 0.00 0.00 34.95 34.88 1va5 s ARG 20 CO 0.16 -0.84 0.39 -0.51 -1.08 0.00 0.00 175.30 173.42 1va5 s ASP 21 N -2.95 6.69 -0.24 -2.89 -0.00 -1.26 -0.70 116.67 115.33 1va5 s ASP 21 Ca 0.12 0.82 -0.08 0.00 -0.00 0.00 0.00 52.55 53.42 1va5 s ASP 21 Cb -0.06 -2.24 -0.03 0.00 -0.00 0.00 0.00 42.92 40.59 1va5 s ASP 21 CO 0.08 0.21 0.08 -0.63 -0.00 0.00 0.00 175.17 174.91 1va5 s ILE 22 N -0.40 4.47 0.25 0.77 -1.09 0.35 -4.88 121.20 120.67 1va5 s ILE 22 Ca 0.22 -0.12 -0.30 0.00 -2.23 0.00 0.00 60.65 58.23 1va5 s ILE 22 Cb -0.15 -3.08 -0.09 0.00 -1.58 0.00 0.00 42.46 37.56 1va5 s ILE 22 CO 0.10 0.35 1.15 -0.75 -1.23 0.00 0.00 174.94 174.57 1va5 s LYS 23 N 1.39 4.56 -0.04 2.79 2.20 -1.26 -1.15 119.74 128.23 1va5 s LYS 23 Ca 0.05 1.86 -0.00 0.00 -0.36 0.00 0.00 55.97 57.52 1va5 s LYS 23 Cb -0.15 -3.20 0.03 0.00 -1.51 0.00 0.00 37.83 33.00 1va5 s LYS 23 CO 0.04 0.07 0.02 0.08 -0.36 0.00 0.00 175.35 175.20 1va5 s VAL 24 N -0.74 0.12 -0.02 4.02 1.01 -0.03 -0.67 120.40 124.09 1va5 s VAL 24 Ca 0.48 0.18 -0.22 0.00 0.00 0.00 0.00 61.98 62.42 1va5 s VAL 24 Cb -0.33 -0.27 -0.05 0.00 0.00 0.00 0.00 36.38 35.73 1va5 s VAL 24 CO 0.40 0.17 0.65 -1.10 0.00 0.00 0.00 175.10 175.22 1va5 s GLN 25 N 1.46 4.38 -0.00 2.72 -0.21 0.18 -0.05 119.66 128.13 1va5 s GLN 25 Ca -0.04 0.81 0.00 0.00 0.02 0.00 0.00 55.36 56.16 1va5 s GLN 25 Cb -0.13 -3.38 0.00 0.00 1.00 0.00 0.00 33.01 30.50 1va5 s GLN 25 CO -0.03 0.26 -0.01 0.12 -2.12 0.00 0.00 175.29 173.51 1va5 s PHE 26 N 0.15 0.13 -0.16 0.91 5.36 0.94 -0.60 117.98 124.70 1va5 s PHE 26 Ca 0.34 -0.01 -0.01 0.00 -0.96 0.00 0.00 56.93 56.28 1va5 s PHE 26 Cb -0.18 -0.11 0.05 0.00 -0.34 0.00 0.00 43.02 42.44 1va5 s PHE 26 CO 0.18 -0.01 -0.02 -1.14 -1.46 0.00 0.00 175.22 172.77 1va5 s GLN 27 N 0.09 1.06 1.11 10.12 0.74 -0.57 0.43 119.66 132.64 1va5 s GLN 27 Ca -0.01 -0.40 -0.16 0.00 0.05 0.00 0.00 55.36 54.84 1va5 s GLN 27 Cb -0.02 -1.89 0.24 0.00 1.10 0.00 0.00 33.01 32.45 1va5 s GLN 27 CO -0.00 -0.48 1.11 0.20 -0.55 0.00 0.00 175.29 175.56 1va5 s GLY 28 N 1.75 1.58 0.00 2.59 0.00 -1.26 -0.49 107.32 111.49 1va5 s GLY 28 Ca 0.01 -0.71 0.00 0.00 0.00 0.00 0.00 44.72 44.01 1va5 s GLY 28 CO -0.07 0.06 0.00 0.61 0.00 0.00 0.00 173.10 173.69 1va5 n GLY 29 N -1.08 -0.20 0.00 0.20 0.00 -1.26 -4.68 105.19 98.17 1va5 n GLY 29 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1va5 n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1va5 n GLY 30 N 0.00 2.74 0.25 -0.02 0.00 -1.26 -2.81 105.19 104.08 1va5 n GLY 30 Ca 0.00 -0.84 0.11 0.00 0.00 0.00 0.00 46.02 45.28 1va5 n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1va5 h PRO 31 N 0.00 0.00 -6.06 1.61 0.13 -1.84 -3.33 132.00 122.51 1va5 h PRO 31 Ca 0.00 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.49 1va5 h PRO 31 Cb 0.00 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.05 1va5 h PRO 31 CO 0.00 0.16 -0.57 -1.01 -0.23 0.00 0.00 178.00 176.34 1va5 s HIS 32 N -4.21 3.29 0.21 1.56 3.76 -1.26 0.10 115.29 118.73 1va5 s HIS 32 Ca -0.03 0.16 0.03 0.00 -0.15 0.00 0.00 55.06 55.08 1va5 s HIS 32 Cb 0.13 -1.69 -0.05 0.00 1.11 0.00 0.00 32.58 32.08 1va5 s HIS 32 CO 0.61 0.55 -0.01 0.00 -0.85 0.00 0.00 174.74 175.04 1va5 s ALA 33 N -1.33 1.65 -0.28 -1.40 0.00 -1.26 -0.98 121.76 118.15 1va5 s ALA 33 Ca 0.28 -1.70 -0.06 0.00 0.00 0.00 0.00 51.96 50.48 1va5 s ALA 33 Cb -0.12 0.48 0.01 0.00 0.00 0.00 0.00 23.12 23.49 1va5 s ALA 33 CO 0.20 -0.26 0.05 0.08 0.00 0.00 0.00 175.76 175.83 1va5 s VAL 34 N -3.48 3.82 -0.46 0.00 1.01 -0.34 -1.42 120.40 119.52 1va5 s VAL 34 Ca 0.26 -0.68 -0.25 0.00 0.00 0.00 0.00 61.98 61.31 1va5 s VAL 34 Cb 0.06 -2.94 0.03 0.00 0.00 0.00 0.00 36.38 33.52 1va5 s VAL 34 CO 0.07 0.14 0.92 -0.31 0.00 0.00 0.00 175.10 175.92 1va5 s TYR 35 N 1.49 2.93 -0.57 5.22 1.51 0.77 -1.28 117.35 127.41 1va5 s TYR 35 Ca 0.03 0.39 -0.18 0.00 -1.01 0.00 0.00 57.07 56.30 1va5 s TYR 35 Cb -0.17 -3.96 0.11 0.00 -0.11 0.00 0.00 41.96 37.84 1va5 s TYR 35 CO 0.01 -1.09 0.63 -0.51 -1.11 0.00 0.00 175.55 173.48 1va5 s LEU 36 N 3.74 5.65 0.37 -1.29 1.43 0.65 -0.74 118.68 128.49 1va5 s LEU 36 Ca 0.37 -1.54 -0.24 0.00 -1.03 0.00 0.00 54.13 51.68 1va5 s LEU 36 Cb -0.10 -2.27 -0.10 0.00 0.03 0.00 0.00 46.19 43.74 1va5 s LEU 36 CO 0.26 -1.02 0.96 -0.76 0.23 0.00 0.00 176.35 176.01 1va5 s LEU 37 N 2.31 4.19 0.84 1.79 1.43 0.55 -4.26 118.68 125.52 1va5 s LEU 37 Ca 0.09 1.81 -0.08 0.00 -1.03 0.00 0.00 54.13 54.92 1va5 s LEU 37 Cb -0.26 -4.20 0.16 0.00 0.03 0.00 0.00 46.19 41.92 1va5 s LEU 37 CO 0.05 -0.21 1.15 -0.62 0.23 0.00 0.00 176.35 176.96 1va5 s ASP 38 N -1.79 3.74 0.51 2.29 -1.08 -1.26 -4.32 116.67 114.76 1va5 s ASP 38 Ca 0.55 -0.09 -0.00 0.00 -0.52 0.00 0.00 52.55 52.49 1va5 s ASP 38 Cb -0.16 -0.12 0.05 0.00 -1.46 0.00 0.00 42.92 41.23 1va5 s ASP 38 CO 0.21 -2.29 0.35 0.61 0.52 0.00 0.00 175.17 174.56 1va5 n GLY 39 N -3.28 0.69 0.36 2.66 0.00 -1.26 -3.96 105.19 100.40 1va5 n GLY 39 Ca 0.15 -1.98 0.08 0.00 0.00 0.00 0.00 46.02 44.27 1va5 n GLY 39 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1va5 h LEU 40 N 0.00 0.89 -3.17 0.99 5.85 -1.95 -2.44 115.31 115.48 1va5 h LEU 40 Ca -0.11 0.06 -0.30 0.00 0.84 0.00 0.00 57.88 58.36 1va5 h LEU 40 Cb 0.42 -0.12 -0.16 0.00 0.37 0.00 0.00 40.66 41.17 1va5 h LEU 40 CO 0.12 0.45 0.38 0.54 -0.34 0.00 0.00 178.44 179.59 1va5 n ARG 41 N -4.65 1.72 -1.60 1.25 1.74 -1.26 -0.54 116.66 113.32 1va5 n ARG 41 Ca 0.19 -1.65 -0.53 0.00 -0.77 0.00 0.00 57.85 55.09 1va5 n ARG 41 Cb 0.38 -1.65 -0.06 0.00 -1.02 0.00 0.00 32.46 30.11 1va5 n ARG 41 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1va5 n ALA 42 N -0.28 -1.07 -2.02 7.54 0.00 -0.92 -4.96 120.51 118.80 1va5 n ALA 42 Ca 0.33 0.51 -0.19 0.00 0.00 0.00 0.00 53.44 54.09 1va5 n ALA 42 Cb 1.03 -2.07 0.02 0.00 0.00 0.00 0.00 19.45 18.43 1va5 n ALA 42 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1va5 s GLN 43 N 0.72 2.71 0.00 0.00 -0.21 -1.26 -3.75 119.66 117.87 1va5 s GLN 43 Ca 0.86 -0.98 0.24 0.00 0.02 0.00 0.00 55.36 55.50 1va5 s GLN 43 Cb -0.99 -2.62 0.35 0.00 1.00 0.00 0.00 33.01 30.76 1va5 s GLN 43 CO 0.49 -0.47 1.31 -0.25 -2.12 0.00 0.00 175.29 174.25 1va5 n ASP 44 N -2.09 1.29 -0.12 5.90 10.43 -1.26 -1.93 116.55 128.78 1va5 n ASP 44 Ca 0.07 -1.03 -0.24 0.00 2.57 0.00 0.00 54.79 56.16 1va5 n ASP 44 Cb 0.59 0.37 -0.11 0.00 1.84 0.00 0.00 41.12 43.81 1va5 n ASP 44 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 1va5 n ASP 45 N -0.65 1.90 -4.00 -2.24 3.85 -1.26 -4.78 116.55 109.37 1va5 n ASP 45 Ca 0.09 0.39 -0.09 0.00 -0.71 0.00 0.00 54.79 54.48 1va5 n ASP 45 Cb 0.38 -0.91 -0.11 0.00 -1.35 0.00 0.00 41.12 39.14 1va5 n ASP 45 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 1va5 s TYR 46 N -2.42 0.31 0.29 2.11 2.02 -1.26 -5.05 117.35 113.35 1va5 s TYR 46 Ca -0.32 -0.62 -0.29 0.00 -0.37 0.00 0.00 57.07 55.46 1va5 s TYR 46 Cb 0.09 -0.23 -0.10 0.00 -0.40 0.00 0.00 41.96 41.33 1va5 s TYR 46 CO 0.54 -0.22 1.13 1.21 -1.57 0.00 0.00 175.55 176.64 1va5 s ASN 47 N -1.72 7.15 0.47 2.29 3.84 -1.26 -4.28 114.94 121.43 1va5 s ASN 47 Ca -0.12 2.33 0.24 0.00 0.21 0.00 0.00 52.86 55.53 1va5 s ASN 47 Cb -0.07 -2.63 1.27 0.00 -0.55 0.00 0.00 41.25 39.27 1va5 s ASN 47 CO -0.03 -0.23 1.85 1.23 -2.79 0.00 0.00 177.10 177.13 1va5 h GLY 48 N 3.67 0.55 1.21 1.21 0.00 -1.92 -0.87 103.07 106.92 1va5 h GLY 48 Ca -0.47 -0.11 -0.05 0.00 0.00 0.00 0.00 47.33 46.70 1va5 h GLY 48 CO 0.66 -0.03 0.21 1.49 0.00 0.00 0.00 176.54 178.88 1va5 h TRP 49 N 0.23 1.02 -0.05 5.60 4.06 -1.91 -1.07 115.95 123.83 1va5 h TRP 49 Ca 0.48 -0.09 -0.21 0.00 2.06 0.00 0.00 58.89 61.13 1va5 h TRP 49 Cb 1.51 -0.30 0.00 0.00 -1.00 0.00 0.00 29.16 29.37 1va5 h TRP 49 CO -0.00 0.81 -0.85 0.22 -3.56 0.00 0.00 178.44 175.06 1va5 h ASP 50 N 0.96 0.58 -0.31 -3.49 -0.00 -1.40 -0.81 116.42 111.95 1va5 h ASP 50 Ca 0.22 -0.42 -0.06 0.00 -0.00 0.00 0.00 57.03 56.77 1va5 h ASP 50 Cb 0.26 -0.17 -0.01 0.00 -0.00 0.00 0.00 39.33 39.41 1va5 h ASP 50 CO -0.01 1.20 -0.04 0.40 -0.00 0.00 0.00 179.24 180.79 1va5 h ILE 51 N 0.29 1.27 -0.01 2.25 2.04 -1.20 -3.36 117.51 118.79 1va5 h ILE 51 Ca -0.06 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 64.75 1va5 h ILE 51 Cb 1.46 1.32 0.00 0.00 -0.74 0.00 0.00 36.82 38.86 1va5 h ILE 51 CO 0.15 0.34 -0.60 0.59 0.00 0.00 0.00 178.15 178.63 1va5 n ASN 52 N -4.50 1.32 -4.15 1.72 3.02 -0.43 -4.53 115.26 107.72 1va5 n ASN 52 Ca -0.03 -1.16 -0.11 0.00 -0.03 0.00 0.00 54.58 53.25 1va5 n ASN 52 Cb 0.30 0.73 -0.09 0.00 -0.61 0.00 0.00 39.78 40.10 1va5 n ASN 52 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1va5 s THR 53 N -2.38 0.03 -0.35 3.41 -4.23 -0.31 -4.72 115.64 107.10 1va5 s THR 53 Ca 0.11 -1.88 0.02 0.00 -1.18 0.00 0.00 61.69 58.76 1va5 s THR 53 Cb 0.14 -2.29 0.42 0.00 1.34 0.00 0.00 72.50 72.11 1va5 s THR 53 CO 0.59 -0.16 1.73 -2.65 -0.54 0.00 0.00 174.62 173.59 1va5 n PRO 54 N -0.22 1.93 -0.25 3.99 -0.02 -1.26 -4.06 135.00 135.11 1va5 n PRO 54 Ca -0.01 -2.12 0.01 0.00 -2.02 0.00 0.00 63.50 59.36 1va5 n PRO 54 Cb 0.65 -1.83 0.08 0.00 -0.02 0.00 0.00 33.50 32.37 1va5 n PRO 54 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1va5 h ALA 55 N 1.41 0.45 -0.59 3.55 0.00 -1.86 0.24 119.26 122.46 1va5 h ALA 55 Ca 0.44 0.27 -0.02 0.00 0.00 0.00 0.00 54.91 55.60 1va5 h ALA 55 Cb 1.94 0.55 -0.03 0.00 0.00 0.00 0.00 17.79 20.26 1va5 h ALA 55 CO 0.85 -0.42 0.31 0.74 0.00 0.00 0.00 179.25 180.72 1va5 h PHE 56 N -0.01 0.83 -0.56 0.00 0.05 -1.87 -1.75 116.94 113.62 1va5 h PHE 56 Ca 0.34 -0.03 -0.07 0.00 3.82 0.00 0.00 57.97 62.03 1va5 h PHE 56 Cb 0.52 -0.26 -0.02 0.00 2.00 0.00 0.00 35.95 38.19 1va5 h PHE 56 CO -0.58 0.61 0.06 1.49 -0.18 0.00 0.00 178.31 179.72 1va5 h GLU 57 N 0.80 0.91 -0.00 1.51 4.81 -1.56 -1.65 114.58 119.41 1va5 h GLU 57 Ca 0.21 -0.23 -0.08 0.00 -0.13 0.00 0.00 59.36 59.12 1va5 h GLU 57 Cb 0.08 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 1va5 h GLU 57 CO -0.03 0.87 -0.36 0.93 -0.73 0.00 0.00 179.01 179.69 1va5 h GLU 58 N 0.86 0.01 -0.23 1.92 5.08 -0.12 -3.04 114.58 119.05 1va5 h GLU 58 Ca 0.17 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1va5 h GLU 58 Cb 0.42 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1va5 h GLU 58 CO 0.01 0.37 0.00 0.66 -1.00 0.00 0.00 179.01 179.05 1va5 n TYR 59 N -4.11 0.29 -1.85 4.33 4.02 -0.70 -4.91 117.16 114.23 1va5 n TYR 59 Ca -0.02 -0.18 -0.42 0.00 -0.01 0.00 0.00 57.90 57.27 1va5 n TYR 59 Cb 0.40 -0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.69 1va5 n TYR 59 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 1va5 s TYR 60 N -1.38 2.94 -1.63 -0.72 6.04 -0.64 -1.79 117.35 120.18 1va5 s TYR 60 Ca 0.29 0.49 0.00 0.00 0.04 0.00 0.00 57.07 57.88 1va5 s TYR 60 Cb 0.18 -4.01 0.00 0.00 -1.04 0.00 0.00 41.96 37.09 1va5 s TYR 60 CO 0.25 -3.81 0.00 1.04 -1.54 0.00 0.00 175.55 171.49 1va5 n GLN 61 N 4.14 -1.36 0.04 4.97 6.02 -1.26 -4.87 117.38 125.05 1va5 n GLN 61 Ca 0.15 0.94 0.13 0.00 -0.01 0.00 0.00 57.00 58.20 1va5 n GLN 61 Cb 0.37 -5.36 0.33 0.00 1.02 0.00 0.00 30.24 26.61 1va5 n GLN 61 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1va5 n SER 62 N -1.24 0.52 0.00 1.08 3.41 -0.74 -4.90 113.62 111.75 1va5 n SER 62 Ca -0.20 0.18 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 1va5 n SER 62 Cb 0.64 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 1va5 n SER 62 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1va5 n GLY 63 N 1.41 0.75 3.18 5.00 0.00 -1.24 -4.98 105.19 109.31 1va5 n GLY 63 Ca 0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 1va5 n GLY 63 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1va5 s LEU 64 N 0.00 2.15 0.56 0.99 1.43 -1.12 -4.19 118.68 118.49 1va5 s LEU 64 Ca 0.00 -0.45 -0.08 0.00 -1.03 0.00 0.00 54.13 52.56 1va5 s LEU 64 Cb 0.00 -0.78 -0.04 0.00 0.03 0.00 0.00 46.19 45.40 1va5 s LEU 64 CO 0.00 0.11 0.93 -0.44 0.23 0.00 0.00 176.35 177.17 1va5 s SER 65 N -1.03 6.23 -0.10 2.29 0.01 -0.16 -4.31 113.70 116.63 1va5 s SER 65 Ca 0.05 1.20 0.02 0.00 1.31 0.00 0.00 55.95 58.52 1va5 s SER 65 Cb -0.08 -2.36 0.02 0.00 0.21 0.00 0.00 66.02 63.81 1va5 s SER 65 CO 0.01 -0.76 -0.13 -0.69 0.41 0.00 0.00 173.24 172.08 1va5 s VAL 66 N -3.00 1.34 -0.18 3.43 1.01 0.36 -1.20 120.40 122.16 1va5 s VAL 66 Ca 0.52 -0.55 -0.00 0.00 0.00 0.00 0.00 61.98 61.95 1va5 s VAL 66 Cb -0.11 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 35.04 1va5 s VAL 66 CO 0.50 0.41 -0.15 -0.63 0.00 0.00 0.00 175.10 175.23 1va5 s ILE 67 N 1.02 2.54 -0.47 2.22 1.01 -0.40 -1.51 121.20 125.60 1va5 s ILE 67 Ca -0.07 -0.79 0.04 0.00 0.00 0.00 0.00 60.65 59.83 1va5 s ILE 67 Cb -0.15 -2.09 0.12 0.00 0.01 0.00 0.00 42.46 40.36 1va5 s ILE 67 CO -0.01 0.51 0.21 -0.04 0.00 0.00 0.00 174.94 175.61 1va5 s MET 68 N 1.18 1.79 0.57 2.79 -1.94 0.23 -0.25 119.30 123.67 1va5 s MET 68 Ca 0.02 -2.39 -0.19 0.00 -1.71 0.00 0.00 55.69 51.41 1va5 s MET 68 Cb -0.14 -3.18 -0.05 0.00 2.01 0.00 0.00 34.83 33.48 1va5 s MET 68 CO -0.07 -1.08 1.19 -1.25 -0.01 0.00 0.00 175.02 173.80 1va5 s PRO 69 N 0.04 3.14 -0.10 2.03 0.04 -1.26 -0.65 135.00 138.24 1va5 s PRO 69 Ca 0.16 1.77 0.02 0.00 0.04 0.00 0.00 61.00 62.98 1va5 s PRO 69 Cb -0.24 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.29 1va5 s PRO 69 CO -0.02 -1.06 -0.15 0.08 0.04 0.00 0.00 177.00 175.89 1va5 s VAL 70 N -1.63 2.96 0.00 -0.36 1.01 0.15 -4.63 120.40 117.90 1va5 s VAL 70 Ca 0.75 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 62.01 1va5 s VAL 70 Cb -0.29 -2.20 0.00 0.00 0.00 0.00 0.00 36.38 33.89 1va5 s VAL 70 CO 0.32 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.58 1va5 n GLY 71 N 3.08 -1.19 1.59 4.51 0.00 -0.81 -4.33 105.19 108.04 1va5 n GLY 71 Ca -0.18 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.72 1va5 n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1va5 n GLY 72 N 0.00 0.73 3.57 -0.02 0.00 -1.26 -4.79 105.19 103.42 1va5 n GLY 72 Ca 0.00 -0.71 -0.50 0.00 0.00 0.00 0.00 46.02 44.81 1va5 n GLY 72 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1va5 n GLN 73 N -0.76 1.08 -1.90 1.61 7.27 -1.25 -1.03 117.38 122.41 1va5 n GLN 73 Ca 0.00 0.38 -0.12 0.00 0.07 0.00 0.00 57.00 57.34 1va5 n GLN 73 Cb 0.45 -1.91 -0.03 0.00 2.41 0.00 0.00 30.24 31.16 1va5 n GLN 73 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 1va5 n SER 74 N 2.12 -3.48 0.13 1.69 7.64 0.30 -4.85 113.62 117.18 1va5 n SER 74 Ca 0.16 0.25 0.12 0.00 1.01 0.00 0.00 58.87 60.41 1va5 n SER 74 Cb 0.22 -3.12 0.06 0.00 -1.01 0.00 0.00 64.21 60.36 1va5 n SER 74 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1va5 h SER 75 N 0.00 0.00 -0.75 6.43 4.64 -1.37 -3.48 113.55 119.02 1va5 h SER 75 Ca -0.26 -0.01 -0.30 0.00 -0.47 0.00 0.00 61.79 60.74 1va5 h SER 75 Cb 0.99 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.97 1va5 h SER 75 CO 0.35 0.01 -0.27 0.49 -0.87 0.00 0.00 176.83 176.53 1va5 n PHE 76 N -2.75 -0.03 -4.24 4.77 3.01 -1.26 -2.52 117.46 114.45 1va5 n PHE 76 Ca 0.01 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.10 1va5 n PHE 76 Cb 0.54 -3.01 -0.03 0.00 -0.01 0.00 0.00 39.48 36.96 1va5 n PHE 76 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1va5 n TYR 77 N -2.23 -1.68 -4.40 1.38 4.02 -1.26 -4.75 117.16 108.25 1va5 n TYR 77 Ca -0.15 0.78 -0.27 0.00 -0.01 0.00 0.00 57.90 58.25 1va5 n TYR 77 Cb 0.62 -2.79 -0.09 0.00 -0.02 0.00 0.00 39.34 37.06 1va5 n TYR 77 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 1va5 s THR 78 N -3.26 2.05 -0.36 -0.72 -1.32 -1.05 -3.29 115.64 107.69 1va5 s THR 78 Ca 0.75 -1.85 -0.18 0.00 -1.21 0.00 0.00 61.69 59.20 1va5 s THR 78 Cb -0.42 -2.91 0.00 0.00 -1.51 0.00 0.00 72.50 67.67 1va5 s THR 78 CO 0.93 0.00 0.52 -1.81 -2.21 0.00 0.00 174.62 172.04 1va5 s ASP 79 N -3.83 6.30 0.56 8.08 1.11 -1.26 -2.48 116.67 125.16 1va5 s ASP 79 Ca 0.35 -0.12 -0.16 0.00 0.18 0.00 0.00 52.55 52.80 1va5 s ASP 79 Cb 0.06 -2.27 -0.05 0.00 1.07 0.00 0.00 42.92 41.73 1va5 s ASP 79 CO 0.19 -0.52 1.03 0.26 1.18 0.00 0.00 175.17 177.31 1va5 s TRP 80 N 2.40 3.18 0.19 4.23 0.52 0.04 -4.94 118.94 124.58 1va5 s TRP 80 Ca 0.18 1.49 -0.03 0.00 0.02 0.00 0.00 56.10 57.77 1va5 s TRP 80 Cb -0.15 -2.92 0.11 0.00 -1.15 0.00 0.00 33.47 29.36 1va5 s TRP 80 CO 0.14 -0.81 1.50 1.88 0.02 0.00 0.00 176.95 179.67 1va5 h TYR 81 N 0.62 0.67 -2.74 -1.98 0.05 -1.00 -3.46 116.97 109.14 1va5 h TYR 81 Ca -0.47 -0.25 0.10 0.00 0.05 0.00 0.00 58.73 58.17 1va5 h TYR 81 Cb 1.21 -0.12 -0.05 0.00 1.01 0.00 0.00 36.73 38.77 1va5 h TYR 81 CO 0.61 0.98 0.35 1.14 -1.05 0.00 0.00 178.16 180.19 1va5 s GLN 82 N -3.94 1.61 0.54 4.88 -2.07 -0.99 -5.07 119.66 114.62 1va5 s GLN 82 Ca -0.07 -0.93 -0.21 0.00 -1.82 0.00 0.00 55.36 52.33 1va5 s GLN 82 Cb 0.11 0.52 -0.06 0.00 -1.09 0.00 0.00 33.01 32.50 1va5 s GLN 82 CO 0.84 -0.74 1.18 -2.30 -1.32 0.00 0.00 175.29 172.95 1va5 n PRO 83 N -0.49 1.40 -1.64 9.60 -0.02 -1.26 -4.66 135.00 137.93 1va5 n PRO 83 Ca -0.05 0.52 -0.43 0.00 -2.02 0.00 0.00 63.50 61.52 1va5 n PRO 83 Cb 0.60 -2.36 -0.03 0.00 -0.02 0.00 0.00 33.50 31.69 1va5 n PRO 83 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1va5 s SER 84 N -0.97 5.64 -1.09 2.55 0.15 -1.26 -4.87 113.70 113.85 1va5 s SER 84 Ca 0.71 1.98 -0.22 0.00 0.70 0.00 0.00 55.95 59.12 1va5 s SER 84 Cb -0.44 -2.51 0.05 0.00 -1.71 0.00 0.00 66.02 61.40 1va5 s SER 84 CO 0.50 -1.80 1.57 -1.10 1.20 0.00 0.00 173.24 173.61 1va5 s GLN 85 N 6.00 3.61 0.00 5.44 -1.52 -1.26 -3.84 119.66 128.09 1va5 s GLN 85 Ca 0.97 -1.30 0.00 0.00 -1.95 0.00 0.00 55.36 53.08 1va5 s GLN 85 Cb -0.34 -5.39 0.00 0.00 -0.22 0.00 0.00 33.01 27.06 1va5 s GLN 85 CO 0.36 -2.34 0.00 -1.13 -0.25 0.00 0.00 175.29 171.93 1va5 n SER 86 N 9.20 0.00 -1.35 5.90 3.41 -1.26 -4.78 113.62 124.73 1va5 n SER 86 Ca 0.38 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 59.08 1va5 n SER 86 Cb 0.49 0.00 0.32 0.00 -0.26 0.00 0.00 64.21 64.76 1va5 n SER 86 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1va5 n ASN 87 N 0.00 4.32 -0.55 4.04 0.23 -1.25 -4.96 115.26 117.08 1va5 n ASN 87 Ca 0.00 -2.38 -0.07 0.00 -0.53 0.00 0.00 54.58 51.60 1va5 n ASN 87 Cb 0.00 -0.51 -0.03 0.00 -2.08 0.00 0.00 39.78 37.16 1va5 n ASN 87 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1va5 n GLY 88 N 0.96 0.92 3.70 4.83 0.00 -1.26 -4.97 105.19 109.37 1va5 n GLY 88 Ca 0.23 -0.72 -0.44 0.00 0.00 0.00 0.00 46.02 45.09 1va5 n GLY 88 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1va5 n GLN 89 N -2.77 2.53 -0.86 1.61 7.27 -1.25 -4.87 117.38 119.03 1va5 n GLN 89 Ca -0.07 0.91 0.06 0.00 0.07 0.00 0.00 57.00 57.97 1va5 n GLN 89 Cb 0.24 -2.73 0.38 0.00 2.41 0.00 0.00 30.24 30.54 1va5 n GLN 89 CO 0.00 0.00 0.00 0.27 0.07 0.00 0.00 177.06 177.40 1va5 n ASN 90 N 3.87 5.44 -3.64 1.69 2.04 -1.26 -4.52 115.26 118.89 1va5 n ASN 90 Ca 0.17 -2.98 -0.10 0.00 -0.44 0.00 0.00 54.58 51.22 1va5 n ASN 90 Cb 0.32 -0.68 -0.04 0.00 -2.53 0.00 0.00 39.78 36.86 1va5 n ASN 90 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 1va5 s TYR 91 N -2.81 -0.23 -0.20 -2.53 -0.85 -1.26 -5.08 117.35 104.39 1va5 s TYR 91 Ca 0.53 -0.08 -0.13 0.00 -0.52 0.00 0.00 57.07 56.87 1va5 s TYR 91 Cb 0.41 0.37 -0.04 0.00 0.38 0.00 0.00 41.96 43.08 1va5 s TYR 91 CO 0.15 -0.82 0.28 0.99 -1.52 0.00 0.00 175.55 174.63 1va5 s THR 92 N -3.82 5.29 0.19 -3.49 2.01 -1.26 -4.36 115.64 110.19 1va5 s THR 92 Ca 0.05 0.48 -0.32 0.00 0.31 0.00 0.00 61.69 62.22 1va5 s THR 92 Cb 0.00 -3.62 -0.11 0.00 0.01 0.00 0.00 72.50 68.78 1va5 s THR 92 CO -0.08 0.33 1.66 -0.31 -0.69 0.00 0.00 174.62 175.53 1va5 s TYR 93 N 0.93 2.96 -0.38 4.92 2.02 -1.26 -4.63 117.35 121.91 1va5 s TYR 93 Ca 0.14 0.46 0.13 0.00 -0.37 0.00 0.00 57.07 57.43 1va5 s TYR 93 Cb -0.14 -4.05 0.40 0.00 -0.40 0.00 0.00 41.96 37.77 1va5 s TYR 93 CO 0.05 -3.95 0.87 1.63 -1.57 0.00 0.00 175.55 172.59 1va5 n LYS 94 N 4.01 1.50 0.22 -0.62 4.76 -1.26 -0.78 118.16 125.99 1va5 n LYS 94 Ca 0.15 -3.59 0.08 0.00 -2.87 0.00 0.00 58.31 52.08 1va5 n LYS 94 Cb 0.37 -1.64 0.48 0.00 -1.84 0.00 0.00 35.03 32.40 1va5 n LYS 94 CO 0.00 0.00 0.00 -1.49 -1.37 0.00 0.00 177.40 174.54 1va5 h TRP 95 N 2.96 0.00 -0.21 2.13 4.06 -1.76 -1.96 115.95 121.16 1va5 h TRP 95 Ca 0.05 0.00 -0.18 0.00 2.06 0.00 0.00 58.89 60.81 1va5 h TRP 95 Cb 1.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.16 1va5 h TRP 95 CO 0.55 0.26 -0.58 1.49 -3.56 0.00 0.00 178.44 176.61 1va5 h GLU 96 N 0.00 0.76 -0.61 0.49 4.81 -1.66 -1.82 114.58 116.56 1va5 h GLU 96 Ca -0.00 -0.54 -0.04 0.00 -0.13 0.00 0.00 59.36 58.65 1va5 h GLU 96 Cb 0.67 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.11 1va5 h GLU 96 CO 0.03 1.16 0.23 1.15 -0.73 0.00 0.00 179.01 180.85 1va5 h THR 97 N 0.50 1.23 0.07 0.32 2.02 -1.87 -1.52 112.91 113.67 1va5 h THR 97 Ca -0.01 -0.76 -0.00 0.00 0.77 0.00 0.00 66.41 66.41 1va5 h THR 97 Cb 1.19 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 1va5 h THR 97 CO 0.12 0.29 -0.03 0.15 0.37 0.00 0.00 175.52 176.42 1va5 h PHE 98 N 0.85 -0.09 -0.06 3.16 3.57 -1.30 -0.02 116.94 123.06 1va5 h PHE 98 Ca 0.20 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.61 1va5 h PHE 98 Cb 0.23 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 1va5 h PHE 98 CO 0.01 0.04 -0.39 -0.07 -2.23 0.00 0.00 178.31 175.68 1va5 h LEU 99 N -0.20 0.12 0.00 0.59 3.38 -1.28 0.32 115.31 118.25 1va5 h LEU 99 Ca -0.01 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1va5 h LEU 99 Cb 0.17 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1va5 h LEU 99 CO 0.02 0.50 -1.32 0.35 0.09 0.00 0.00 178.44 178.08 1va5 n THR 100 N -4.06 0.00 0.10 0.22 -2.24 -0.58 -4.37 114.28 103.35 1va5 n THR 100 Ca -0.02 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1va5 n THR 100 Cb 0.44 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 1va5 n THR 100 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1va5 n ARG 101 N -1.75 0.00 0.13 -0.78 1.74 -0.04 -4.84 116.66 111.12 1va5 n ARG 101 Ca 0.01 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.96 1va5 n ARG 101 Cb 0.41 -0.24 -0.08 0.00 -1.02 0.00 0.00 32.46 31.53 1va5 n ARG 101 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1va5 h GLU 102 N 0.00 -0.32 0.03 5.56 5.08 -1.29 -2.83 114.58 120.81 1va5 h GLU 102 Ca 0.00 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1va5 h GLU 102 Cb 0.00 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1va5 h GLU 102 CO 0.00 -0.01 -0.02 1.98 -1.00 0.00 0.00 179.01 179.96 1va5 h MET 103 N -0.64 -0.04 -0.70 2.33 4.05 -0.65 -2.50 114.93 116.77 1va5 h MET 103 Ca -0.03 0.00 0.05 0.00 -0.28 0.00 0.00 59.70 59.44 1va5 h MET 103 Cb 0.46 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.22 1va5 h MET 103 CO 0.06 0.17 0.46 -1.00 0.23 0.00 0.00 176.91 176.83 1va5 h PRO 104 N -0.25 0.75 -0.52 0.39 0.13 -1.75 -0.46 132.00 130.30 1va5 h PRO 104 Ca -0.00 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 65.03 1va5 h PRO 104 Cb 0.23 -0.17 -0.02 0.00 0.13 0.00 0.00 31.00 31.17 1va5 h PRO 104 CO 0.01 0.50 0.14 0.00 -0.23 0.00 0.00 178.00 178.42 1va5 h ALA 105 N 1.61 0.68 0.05 -0.56 0.00 -1.41 -1.12 119.26 118.50 1va5 h ALA 105 Ca 0.29 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1va5 h ALA 105 Cb 0.18 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1va5 h ALA 105 CO -0.09 0.36 -0.02 2.35 0.00 0.00 0.00 179.25 181.84 1va5 h TRP 106 N 0.71 -0.06 -0.14 0.00 7.01 -0.85 -1.49 115.95 121.13 1va5 h TRP 106 Ca 0.16 -0.00 -0.05 0.00 2.11 0.00 0.00 58.89 61.12 1va5 h TRP 106 Cb 0.31 0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.38 1va5 h TRP 106 CO 0.02 0.05 -0.13 -0.07 -2.79 0.00 0.00 178.44 175.52 1va5 h LEU 107 N -0.15 0.20 0.06 0.65 3.38 -1.03 -1.79 115.31 116.63 1va5 h LEU 107 Ca -0.01 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1va5 h LEU 107 Cb 0.13 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1va5 h LEU 107 CO 0.01 0.36 -0.03 -0.61 0.09 0.00 0.00 178.44 178.26 1va5 h GLN 108 N 0.21 -0.08 -0.56 1.13 4.15 -1.03 -1.12 115.11 117.81 1va5 h GLN 108 Ca 0.04 0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.49 1va5 h GLN 108 Cb 0.36 0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.03 1va5 h GLN 108 CO 0.02 0.48 0.34 0.00 -1.93 0.00 0.00 178.83 177.74 1va5 h ALA 109 N 0.10 0.73 0.00 3.38 0.00 -1.19 -1.31 119.26 120.96 1va5 h ALA 109 Ca -0.01 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 1va5 h ALA 109 Cb 0.60 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1va5 h ALA 109 CO 0.01 0.07 -1.51 0.09 0.00 0.00 0.00 179.25 177.91 1va5 n ASN 110 N -4.76 0.60 0.00 0.00 3.02 -0.68 -4.64 115.26 108.79 1va5 n ASN 110 Ca 0.05 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.84 1va5 n ASN 110 Cb 0.08 0.71 0.00 0.00 -0.61 0.00 0.00 39.78 39.95 1va5 n ASN 110 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1va5 n LYS 111 N -2.68 3.00 -0.89 3.52 5.02 -0.47 -5.03 118.16 120.63 1va5 n LYS 111 Ca -0.08 -0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.14 1va5 n LYS 111 Cb 0.73 -0.41 0.00 0.00 -0.02 0.00 0.00 35.03 35.33 1va5 n LYS 111 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1va5 n GLY 112 N 0.45 0.47 3.69 0.72 0.00 -0.49 -4.98 105.19 105.05 1va5 n GLY 112 Ca 0.00 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.84 1va5 n GLY 112 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1va5 s VAL 113 N -2.00 4.71 0.24 1.61 1.01 -1.00 -4.70 120.40 120.27 1va5 s VAL 113 Ca 0.00 1.98 -0.30 0.00 0.00 0.00 0.00 61.98 63.66 1va5 s VAL 113 Cb 0.00 -4.27 -0.10 0.00 0.00 0.00 0.00 36.38 32.01 1va5 s VAL 113 CO 0.00 0.03 1.39 -0.55 0.00 0.00 0.00 175.10 175.97 1va5 s SER 114 N 1.13 6.75 0.09 3.32 0.15 0.12 -3.43 113.70 121.82 1va5 s SER 114 Ca 0.50 2.57 0.21 0.00 0.70 0.00 0.00 55.95 59.94 1va5 s SER 114 Cb -0.20 -2.62 0.86 0.00 -1.71 0.00 0.00 66.02 62.35 1va5 s SER 114 CO 0.20 -0.63 1.66 -2.65 1.20 0.00 0.00 173.24 173.03 1va5 n PRO 115 N 2.35 0.08 -4.45 5.44 -0.02 -1.26 -4.80 135.00 132.34 1va5 n PRO 115 Ca 0.06 0.24 -0.22 0.00 -2.02 0.00 0.00 63.50 61.56 1va5 n PRO 115 Cb 0.41 -1.64 -0.10 0.00 -0.02 0.00 0.00 33.50 32.15 1va5 n PRO 115 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1va5 s THR 116 N -3.10 2.06 -0.48 3.45 -4.23 -1.26 -4.45 115.64 107.64 1va5 s THR 116 Ca 0.08 -2.26 -0.01 0.00 -1.18 0.00 0.00 61.69 58.33 1va5 s THR 116 Cb 0.12 -2.35 0.00 0.00 1.34 0.00 0.00 72.50 71.61 1va5 s THR 116 CO 0.39 -0.38 0.13 0.61 -0.54 0.00 0.00 174.62 174.83 1va5 n GLY 117 N -0.59 0.26 3.79 3.99 0.00 -0.56 -4.90 105.19 107.18 1va5 n GLY 117 Ca -0.06 -0.54 -0.25 0.00 0.00 0.00 0.00 46.02 45.17 1va5 n GLY 117 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1va5 n ASN 118 N 0.57 2.67 -4.19 1.61 3.02 -0.18 -4.64 115.26 114.12 1va5 n ASN 118 Ca -0.04 -2.83 -0.27 0.00 -0.03 0.00 0.00 54.58 51.40 1va5 n ASN 118 Cb 0.54 -0.09 -0.16 0.00 -0.61 0.00 0.00 39.78 39.47 1va5 n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1va5 s ALA 119 N -2.77 1.67 -0.21 5.41 0.00 -0.51 -3.07 121.76 122.28 1va5 s ALA 119 Ca 0.35 -0.83 -0.06 0.00 0.00 0.00 0.00 51.96 51.42 1va5 s ALA 119 Cb -0.03 -0.47 -0.03 0.00 0.00 0.00 0.00 23.12 22.60 1va5 s ALA 119 CO 0.22 0.37 0.02 0.00 0.00 0.00 0.00 175.76 176.37 1va5 s ALA 120 N -0.30 3.07 -0.12 0.00 0.00 -0.39 -0.16 121.76 123.85 1va5 s ALA 120 Ca 0.04 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 51.01 1va5 s ALA 120 Cb -0.09 -1.83 0.02 0.00 0.00 0.00 0.00 23.12 21.21 1va5 s ALA 120 CO 0.00 -0.19 -0.15 0.08 0.00 0.00 0.00 175.76 175.50 1va5 s VAL 121 N 1.08 1.55 0.18 0.00 1.01 0.09 -0.56 120.40 123.74 1va5 s VAL 121 Ca 0.03 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.36 1va5 s VAL 121 Cb -0.14 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 34.76 1va5 s VAL 121 CO 0.02 0.45 0.01 -0.83 0.00 0.00 0.00 175.10 174.75 1va5 s GLY 122 N 1.11 1.26 0.02 4.51 0.00 -0.73 -0.33 107.32 113.16 1va5 s GLY 122 Ca -0.04 -1.61 -0.04 0.00 0.00 0.00 0.00 44.72 43.04 1va5 s GLY 122 CO -0.04 -1.53 0.05 0.48 0.00 0.00 0.00 173.10 172.06 1va5 s LEU 123 N -3.18 1.95 0.00 0.66 -0.00 -1.26 -0.89 118.68 115.95 1va5 s LEU 123 Ca 0.25 -0.45 0.00 0.00 -0.00 0.00 0.00 54.13 53.92 1va5 s LEU 123 Cb 0.06 0.40 0.00 0.00 -0.00 0.00 0.00 46.19 46.65 1va5 s LEU 123 CO 0.05 -0.39 0.00 -0.24 -0.00 0.00 0.00 176.35 175.76 1va5 n SER 124 N 1.25 0.00 -0.26 1.48 2.88 0.19 -1.64 113.62 117.53 1va5 n SER 124 Ca -0.22 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.31 1va5 n SER 124 Cb 0.56 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 64.08 1va5 n SER 124 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 1va5 h MET 125 N 0.00 -0.06 -0.00 -1.46 1.85 -1.85 -1.43 114.93 111.97 1va5 h MET 125 Ca 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 1va5 h MET 125 Cb 0.00 0.01 0.00 0.00 0.43 0.00 0.00 31.60 32.04 1va5 h MET 125 CO 0.00 -0.04 0.00 -1.13 -0.40 0.00 0.00 176.91 175.34 1va5 n SER 126 N -5.47 0.13 0.02 1.39 3.41 -0.65 -3.85 113.62 108.59 1va5 n SER 126 Ca 0.08 -1.05 -0.11 0.00 -0.26 0.00 0.00 58.87 57.53 1va5 n SER 126 Cb 0.38 -0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.27 1va5 n SER 126 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1va5 h GLY 127 N 4.99 0.07 1.19 5.00 0.00 -1.26 -0.76 103.07 112.29 1va5 h GLY 127 Ca 0.00 -0.01 -0.09 0.00 0.00 0.00 0.00 47.33 47.23 1va5 h GLY 127 CO 0.00 0.01 0.02 -1.33 0.00 0.00 0.00 176.54 175.24 1va5 h GLY 128 N 0.05 1.05 0.70 4.60 0.00 -1.74 -2.97 103.07 104.76 1va5 h GLY 128 Ca 0.02 -0.73 0.06 0.00 0.00 0.00 0.00 47.33 46.68 1va5 h GLY 128 CO -0.03 0.68 0.48 1.76 0.00 0.00 0.00 176.54 179.42 1va5 h SER 129 N 0.90 0.73 -0.60 0.19 0.02 -1.60 -0.19 113.55 113.01 1va5 h SER 129 Ca 0.17 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1va5 h SER 129 Cb 0.50 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.88 1va5 h SER 129 CO 0.02 0.47 0.37 0.00 -1.14 0.00 0.00 176.83 176.55 1va5 h ALA 130 N 1.39 0.77 -0.46 3.77 0.00 -1.00 0.11 119.26 123.84 1va5 h ALA 130 Ca 0.35 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.08 1va5 h ALA 130 Cb 0.18 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1va5 h ALA 130 CO -0.18 0.24 -0.16 -0.07 0.00 0.00 0.00 179.25 179.08 1va5 h LEU 131 N 0.82 0.88 -0.73 0.00 3.38 -1.31 -2.18 115.31 116.16 1va5 h LEU 131 Ca 0.22 -0.30 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 1va5 h LEU 131 Cb -0.03 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1va5 h LEU 131 CO -0.04 1.04 -0.07 0.40 0.09 0.00 0.00 178.44 179.85 1va5 h ILE 132 N 0.78 1.26 -0.59 1.22 1.08 -0.67 0.48 117.51 121.07 1va5 h ILE 132 Ca 0.12 -1.17 -0.02 0.00 -0.39 0.00 0.00 64.86 63.40 1va5 h ILE 132 Cb 0.69 0.95 -0.03 0.00 -3.07 0.00 0.00 36.82 35.37 1va5 h ILE 132 CO 0.05 0.41 0.30 -0.07 -0.69 0.00 0.00 178.15 178.15 1va5 h LEU 133 N 0.81 0.75 -0.57 1.44 3.38 -0.58 -1.64 115.31 118.89 1va5 h LEU 133 Ca 0.14 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 1va5 h LEU 133 Cb 0.58 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1va5 h LEU 133 CO 0.04 0.64 -0.18 0.00 0.09 0.00 0.00 178.44 179.03 1va5 h ALA 134 N 1.13 0.77 -0.70 1.53 0.00 -1.12 0.15 119.26 121.01 1va5 h ALA 134 Ca 0.20 -0.37 0.03 0.00 0.00 0.00 0.00 54.91 54.78 1va5 h ALA 134 Cb 0.08 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 1va5 h ALA 134 CO -0.03 0.66 0.44 0.00 0.00 0.00 0.00 179.25 180.32 1va5 h ALA 135 N 0.95 0.93 0.00 0.00 0.00 -0.46 -2.79 119.26 117.89 1va5 h ALA 135 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1va5 h ALA 135 Cb 0.74 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1va5 h ALA 135 CO 0.06 0.20 -1.34 0.66 0.00 0.00 0.00 179.25 178.83 1va5 n TYR 136 N -4.68 0.07 -3.16 0.00 4.02 -0.66 -4.58 117.16 108.18 1va5 n TYR 136 Ca 0.08 0.02 -0.23 0.00 -0.01 0.00 0.00 57.90 57.76 1va5 n TYR 136 Cb 0.10 -0.28 -0.05 0.00 -0.02 0.00 0.00 39.34 39.09 1va5 n TYR 136 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1va5 n TYR 137 N -1.87 1.71 -0.27 -0.72 4.02 0.50 -4.96 117.16 115.56 1va5 n TYR 137 Ca 0.01 -3.87 0.06 0.00 -0.01 0.00 0.00 57.90 54.09 1va5 n TYR 137 Cb 0.44 -0.45 0.29 0.00 -0.02 0.00 0.00 39.34 39.60 1va5 n TYR 137 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1va5 h PRO 138 N 3.42 0.87 -0.54 -0.72 0.13 -1.70 -0.57 132.00 132.89 1va5 h PRO 138 Ca 0.12 -0.05 -0.11 0.00 -0.87 0.00 0.00 66.00 65.09 1va5 h PRO 138 Cb 0.77 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 31.69 1va5 h PRO 138 CO 0.64 0.58 -0.09 1.96 -0.23 0.00 0.00 178.00 180.85 1va5 h GLN 139 N 0.90 1.00 0.02 0.86 1.08 -1.93 -2.82 115.11 114.23 1va5 h GLN 139 Ca 0.39 -0.36 -0.25 0.00 -1.45 0.00 0.00 58.65 56.99 1va5 h GLN 139 Cb 0.34 -0.07 0.01 0.00 -0.05 0.00 0.00 27.48 27.71 1va5 h GLN 139 CO -0.16 1.04 -1.03 0.37 -0.95 0.00 0.00 178.83 178.10 1va5 h GLN 140 N 0.90 0.51 -2.81 1.46 4.15 -1.69 -1.49 115.11 116.13 1va5 h GLN 140 Ca 0.14 -0.58 -0.61 0.00 0.77 0.00 0.00 58.65 58.38 1va5 h GLN 140 Cb 0.65 0.17 -0.41 0.00 0.21 0.00 0.00 27.48 28.10 1va5 h GLN 140 CO 0.04 1.21 -0.68 1.19 -1.93 0.00 0.00 178.83 178.66 1va5 n PHE 141 N -3.77 2.21 1.26 3.99 3.72 -0.25 -1.01 117.46 123.61 1va5 n PHE 141 Ca -0.09 -4.05 0.12 0.00 -0.05 0.00 0.00 57.45 53.39 1va5 n PHE 141 Cb 0.88 -0.40 0.64 0.00 -0.94 0.00 0.00 39.48 39.66 1va5 n PHE 141 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1va5 n PRO 142 N 2.06 0.47 -4.29 -1.08 -0.04 -1.07 -4.61 135.00 126.44 1va5 n PRO 142 Ca 0.23 0.04 -0.20 0.00 -0.04 0.00 0.00 63.50 63.53 1va5 n PRO 142 Cb 0.39 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.19 1va5 n PRO 142 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1va5 s TYR 143 N -2.40 0.85 -0.06 0.54 6.14 -1.21 -1.09 117.35 120.12 1va5 s TYR 143 Ca 0.27 -0.23 -0.04 0.00 0.64 0.00 0.00 57.07 57.71 1va5 s TYR 143 Cb 0.16 -0.67 0.03 0.00 0.42 0.00 0.00 41.96 41.90 1va5 s TYR 143 CO 0.34 -0.15 0.15 0.00 0.64 0.00 0.00 175.55 176.54 1va5 s ALA 144 N 0.53 -0.34 -0.04 3.97 0.00 -0.46 -1.27 121.76 124.15 1va5 s ALA 144 Ca -0.08 0.56 0.05 0.00 0.00 0.00 0.00 51.96 52.49 1va5 s ALA 144 Cb -0.11 -0.35 -0.01 0.00 0.00 0.00 0.00 23.12 22.65 1va5 s ALA 144 CO 0.01 -0.11 -0.20 0.00 0.00 0.00 0.00 175.76 175.45 1va5 s ALA 145 N 0.58 1.77 -0.17 0.00 0.00 0.28 -1.35 121.76 122.87 1va5 s ALA 145 Ca -0.04 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.08 1va5 s ALA 145 Cb -0.06 -0.54 0.03 0.00 0.00 0.00 0.00 23.12 22.54 1va5 s ALA 145 CO -0.03 0.35 -0.16 0.45 0.00 0.00 0.00 175.76 176.37 1va5 s SER 146 N -0.13 3.06 -0.33 0.00 0.15 0.05 -1.77 113.70 114.73 1va5 s SER 146 Ca -0.01 -0.65 -0.07 0.00 0.70 0.00 0.00 55.95 55.92 1va5 s SER 146 Cb -0.12 -1.34 0.04 0.00 -1.71 0.00 0.00 66.02 62.89 1va5 s SER 146 CO 0.02 -0.05 0.11 -0.76 1.20 0.00 0.00 173.24 173.76 1va5 s LEU 147 N 1.37 4.28 -1.44 3.45 1.43 -0.07 -1.10 118.68 126.60 1va5 s LEU 147 Ca 0.04 -1.08 -0.09 0.00 -1.03 0.00 0.00 54.13 51.96 1va5 s LEU 147 Cb -0.14 -1.88 0.05 0.00 0.03 0.00 0.00 46.19 44.26 1va5 s LEU 147 CO -0.11 -0.31 0.95 -1.20 0.23 0.00 0.00 176.35 175.91 1va5 n SER 148 N 4.83 -4.10 -4.90 2.29 7.64 0.10 -0.64 113.62 118.84 1va5 n SER 148 Ca -0.13 -0.74 -0.29 0.00 1.01 0.00 0.00 58.87 58.73 1va5 n SER 148 Cb 0.45 -4.17 0.09 0.00 -1.01 0.00 0.00 64.21 59.56 1va5 n SER 148 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1va5 s GLY 149 N -3.61 1.60 -0.63 0.23 0.00 -1.26 -3.17 107.32 100.49 1va5 s GLY 149 Ca 0.47 -0.68 -0.07 0.00 0.00 0.00 0.00 44.72 44.43 1va5 s GLY 149 CO 0.80 -0.20 0.49 -1.36 0.00 0.00 0.00 173.10 172.83 1va5 s PHE 150 N -3.54 3.51 -1.69 1.90 0.08 -1.26 -4.83 117.98 112.15 1va5 s PHE 150 Ca 0.62 -2.30 0.06 0.00 0.12 0.00 0.00 56.93 55.43 1va5 s PHE 150 Cb -0.11 -3.44 0.20 0.00 -0.57 0.00 0.00 43.02 39.11 1va5 s PHE 150 CO 0.49 -0.92 1.09 1.28 -0.10 0.00 0.00 175.22 177.05 1va5 n LEU 151 N 4.03 1.47 -2.83 -0.37 4.77 -1.26 -4.09 117.00 118.72 1va5 n LEU 151 Ca 0.05 -0.74 -0.11 0.00 -0.03 0.00 0.00 56.01 55.18 1va5 n LEU 151 Cb 0.41 -0.25 0.05 0.00 -2.33 0.00 0.00 43.42 41.30 1va5 n LEU 151 CO 0.36 0.31 0.09 -3.20 -1.33 0.00 0.00 177.39 173.62 1va5 n ASN 152 N 0.15 -0.35 -0.01 -1.43 5.15 -1.26 -1.58 115.26 115.93 1va5 n ASN 152 Ca 0.07 -2.97 0.22 0.00 -0.60 0.00 0.00 54.58 51.30 1va5 n ASN 152 Cb 0.27 0.36 0.72 0.00 -0.53 0.00 0.00 39.78 40.60 1va5 n ASN 152 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1va5 h PRO 153 N 2.78 0.00 -0.01 1.20 0.13 -1.90 -1.78 132.00 132.43 1va5 h PRO 153 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 1va5 h PRO 153 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1va5 h PRO 153 CO 0.29 0.00 -0.23 -1.13 -0.23 0.00 0.00 178.00 176.70 1va5 n SER 154 N -4.11 0.73 -4.84 1.44 3.41 -1.26 -2.85 113.62 106.14 1va5 n SER 154 Ca 0.11 -0.64 -0.36 0.00 -0.26 0.00 0.00 58.87 57.71 1va5 n SER 154 Cb 0.69 0.05 -0.06 0.00 -0.26 0.00 0.00 64.21 64.64 1va5 n SER 154 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1va5 s GLU 155 N -2.58 4.01 1.34 4.33 -6.30 -0.67 -4.83 118.70 114.00 1va5 s GLU 155 Ca 0.24 0.53 0.00 0.00 -2.50 0.00 0.00 54.97 53.24 1va5 s GLU 155 Cb 0.19 -2.99 0.00 0.00 0.00 0.00 0.00 34.13 31.33 1va5 s GLU 155 CO 0.53 0.51 0.00 0.41 0.02 0.00 0.00 175.26 176.73 1va5 n GLY 156 N 0.98 2.54 0.43 -1.50 0.00 -1.26 -1.45 105.19 104.92 1va5 n GLY 156 Ca -0.06 0.23 0.13 0.00 0.00 0.00 0.00 46.02 46.31 1va5 n GLY 156 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1va5 n TRP 157 N 14.00 0.08 -0.19 1.61 8.01 -1.26 -4.33 117.44 135.35 1va5 n TRP 157 Ca 0.00 -0.04 -0.04 0.00 -1.31 0.00 0.00 57.50 56.11 1va5 n TRP 157 Cb 0.00 0.00 0.06 0.00 -2.01 0.00 0.00 31.31 29.36 1va5 n TRP 157 CO 0.00 0.00 0.00 -1.49 -1.01 0.00 0.00 177.69 175.19 1va5 h TRP 158 N 1.91 0.58 -0.83 -5.99 4.06 -1.50 -0.88 115.95 113.31 1va5 h TRP 158 Ca 0.00 0.02 0.08 0.00 2.06 0.00 0.00 58.89 61.06 1va5 h TRP 158 Cb 0.41 -0.18 -0.07 0.00 -1.00 0.00 0.00 29.16 28.32 1va5 h TRP 158 CO 0.04 0.30 0.49 -1.35 -3.56 0.00 0.00 178.44 174.36 1va5 h PRO 159 N 0.61 0.82 -0.28 0.49 0.11 -1.72 0.22 132.00 132.25 1va5 h PRO 159 Ca 0.24 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.26 1va5 h PRO 159 Cb 0.11 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 1va5 h PRO 159 CO -0.14 0.54 -0.01 1.15 -0.21 0.00 0.00 178.00 179.32 1va5 h THR 160 N 0.84 1.26 -0.68 -1.15 2.02 -1.73 -0.84 112.91 112.63 1va5 h THR 160 Ca 0.39 -0.96 -0.05 0.00 0.77 0.00 0.00 66.41 66.56 1va5 h THR 160 Cb 0.31 1.34 -0.03 0.00 -1.74 0.00 0.00 68.15 68.03 1va5 h THR 160 CO -0.22 0.31 0.23 -0.07 0.37 0.00 0.00 175.52 176.13 1va5 h LEU 161 N 0.28 0.98 -0.71 2.58 3.38 -0.63 -1.21 115.31 119.98 1va5 h LEU 161 Ca 0.08 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 1va5 h LEU 161 Cb 0.45 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1va5 h LEU 161 CO 0.02 0.92 0.07 0.40 0.09 0.00 0.00 178.44 179.94 1va5 h ILE 162 N 0.99 1.26 -0.73 1.22 2.04 -0.50 -0.84 117.51 120.95 1va5 h ILE 162 Ca 0.22 -1.06 -0.03 0.00 1.00 0.00 0.00 64.86 64.99 1va5 h ILE 162 Cb 0.28 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 1va5 h ILE 162 CO -0.01 0.39 0.34 1.23 0.00 0.00 0.00 178.15 180.10 1va5 h GLY 163 N 1.03 1.13 1.50 5.37 0.00 -0.71 -0.25 103.07 111.14 1va5 h GLY 163 Ca 0.19 -0.57 -0.14 0.00 0.00 0.00 0.00 47.33 46.80 1va5 h GLY 163 CO 0.02 0.54 -0.47 1.41 0.00 0.00 0.00 176.54 178.04 1va5 h LEU 164 N 1.02 0.59 -0.46 3.11 3.38 -0.97 -1.94 115.31 120.04 1va5 h LEU 164 Ca 0.25 -0.28 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 1va5 h LEU 164 Cb 0.14 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1va5 h LEU 164 CO -0.03 0.97 -0.16 0.00 0.09 0.00 0.00 178.44 179.31 1va5 h ALA 165 N 1.05 0.64 -0.59 1.53 0.00 -0.85 -1.85 119.26 119.19 1va5 h ALA 165 Ca 0.02 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 1va5 h ALA 165 Cb 0.99 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1va5 h ALA 165 CO 0.09 0.58 0.18 0.52 0.00 0.00 0.00 179.25 180.62 1va5 h MET 166 N 0.77 0.89 -0.48 0.00 2.86 -0.94 -1.18 114.93 116.85 1va5 h MET 166 Ca 0.11 -0.17 -0.13 0.00 -2.06 0.00 0.00 59.70 57.45 1va5 h MET 166 Cb 0.72 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 1va5 h MET 166 CO 0.06 0.77 -0.21 -0.97 1.06 0.00 0.00 176.91 177.62 1va5 h ASN 167 N 0.86 1.01 0.47 1.22 -1.24 -1.14 -1.96 115.58 114.80 1va5 h ASN 167 Ca 0.19 -0.39 -0.05 0.00 0.71 0.00 0.00 56.30 56.76 1va5 h ASN 167 Cb 0.25 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.02 1va5 h ASN 167 CO -0.01 1.18 -0.25 -0.78 -1.29 0.00 0.00 177.43 176.28 1va5 h ASP 168 N 0.84 0.00 -3.30 1.15 1.82 -0.93 0.24 116.42 116.24 1va5 h ASP 168 Ca 0.11 0.00 -0.76 0.00 -0.39 0.00 0.00 57.03 55.99 1va5 h ASP 168 Cb 0.79 0.00 -0.31 0.00 0.68 0.00 0.00 39.33 40.49 1va5 h ASP 168 CO 0.07 0.25 0.29 -0.24 -1.61 0.00 0.00 179.24 177.99 1va5 n SER 169 N -3.80 5.17 0.00 2.28 2.88 -0.48 -4.60 113.62 115.07 1va5 n SER 169 Ca -0.01 -3.16 0.00 0.00 -1.33 0.00 0.00 58.87 54.37 1va5 n SER 169 Cb 0.35 -1.22 0.00 0.00 -0.75 0.00 0.00 64.21 62.59 1va5 n SER 169 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1va5 n GLY 170 N 2.22 0.66 2.21 0.46 0.00 -1.25 -4.27 105.19 105.22 1va5 n GLY 170 Ca 0.24 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.16 1va5 n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1va5 n GLY 171 N -2.01 0.32 3.81 -0.02 0.00 0.07 -4.82 105.19 102.55 1va5 n GLY 171 Ca 0.00 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.17 1va5 n GLY 171 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1va5 s TYR 172 N -2.44 3.17 -0.29 1.61 1.51 -0.77 -3.82 117.35 116.33 1va5 s TYR 172 Ca 0.00 1.54 -0.05 0.00 -1.01 0.00 0.00 57.07 57.55 1va5 s TYR 172 Cb 0.00 -2.94 0.02 0.00 -0.11 0.00 0.00 41.96 38.93 1va5 s TYR 172 CO 0.00 -0.64 0.03 1.21 -1.11 0.00 0.00 175.55 175.05 1va5 s ASN 173 N -2.50 4.89 0.53 2.29 3.84 -1.26 -2.84 114.94 119.89 1va5 s ASN 173 Ca 0.63 -0.88 0.21 0.00 0.21 0.00 0.00 52.86 53.03 1va5 s ASN 173 Cb -0.13 -1.80 1.39 0.00 -0.55 0.00 0.00 41.25 40.16 1va5 s ASN 173 CO 0.26 -0.20 2.10 0.00 -2.79 0.00 0.00 177.10 176.47 1va5 h ALA 174 N 8.14 2.12 -0.11 1.71 0.00 -1.91 -1.11 119.26 128.10 1va5 h ALA 174 Ca -0.29 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1va5 h ALA 174 Cb 1.11 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1va5 h ALA 174 CO 0.59 -0.25 -0.19 -0.91 0.00 0.00 0.00 179.25 178.50 1va5 h ASN 175 N 0.00 0.17 1.34 0.00 4.21 -1.94 -1.41 115.58 117.94 1va5 h ASN 175 Ca 0.09 -0.04 -0.05 0.00 1.21 0.00 0.00 56.30 57.51 1va5 h ASN 175 Cb 0.38 -0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 37.53 1va5 h ASN 175 CO -0.00 0.37 -0.26 0.28 -1.29 0.00 0.00 177.43 176.53 1va5 h SER 176 N 0.17 0.00 0.00 5.81 0.02 -1.52 -1.08 113.55 116.95 1va5 h SER 176 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1va5 h SER 176 Cb 0.43 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.97 1va5 h SER 176 CO 0.03 0.26 0.00 0.80 -1.14 0.00 0.00 176.83 176.77 1va5 n MET 177 N -3.25 0.00 -0.17 3.45 0.00 -0.60 -2.17 117.12 114.38 1va5 n MET 177 Ca 0.02 0.40 0.06 0.00 0.00 0.00 0.00 57.70 58.17 1va5 n MET 177 Cb 0.54 -0.94 0.14 0.00 0.00 0.00 0.00 33.22 32.96 1va5 n MET 177 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 175.97 176.88 1va5 n TRP 178 N -1.69 0.37 -4.33 1.12 8.01 -0.80 -2.28 117.44 117.83 1va5 n TRP 178 Ca 0.00 -0.69 0.00 0.00 -1.31 0.00 0.00 57.50 55.50 1va5 n TRP 178 Cb 0.00 -0.13 0.00 0.00 -2.01 0.00 0.00 31.31 29.17 1va5 n TRP 178 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1va5 n GLY 179 N -0.38 -1.32 3.73 6.99 0.00 -0.41 -4.43 105.19 109.38 1va5 n GLY 179 Ca 0.12 -1.23 -0.32 0.00 0.00 0.00 0.00 46.02 44.58 1va5 n GLY 179 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1va5 s PRO 180 N 0.00 2.00 0.65 1.61 0.04 -1.26 -4.34 135.00 133.70 1va5 s PRO 180 Ca 0.00 1.46 0.29 0.00 0.04 0.00 0.00 61.00 62.78 1va5 s PRO 180 Cb 0.00 -1.85 1.56 0.00 0.04 0.00 0.00 34.50 34.25 1va5 s PRO 180 CO 0.00 -1.88 1.89 0.66 0.04 0.00 0.00 177.00 177.71 1va5 h SER 181 N -0.90 0.00 1.04 6.66 4.64 -1.98 0.25 113.55 123.27 1va5 h SER 181 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1va5 h SER 181 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1va5 h SER 181 CO 0.49 0.00 -0.15 -1.54 -0.87 0.00 0.00 176.83 174.76 1va5 n SER 182 N -3.01 0.39 -4.77 4.97 3.41 -1.26 -4.80 113.62 108.55 1va5 n SER 182 Ca -0.00 0.36 -0.40 0.00 -0.26 0.00 0.00 58.87 58.57 1va5 n SER 182 Cb 0.44 -0.39 -0.01 0.00 -0.26 0.00 0.00 64.21 63.99 1va5 n SER 182 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1va5 s ASP 183 N -3.58 6.38 0.45 4.04 -1.08 0.88 -4.89 116.67 118.88 1va5 s ASP 183 Ca 0.12 2.74 0.31 0.00 -0.52 0.00 0.00 52.55 55.19 1va5 s ASP 183 Cb 0.16 -2.65 1.61 0.00 -1.46 0.00 0.00 42.92 40.59 1va5 s ASP 183 CO 0.60 -0.81 1.94 1.55 0.52 0.00 0.00 175.17 178.97 1va5 h PRO 184 N 2.85 0.00 0.00 4.34 0.13 -1.88 -2.63 132.00 134.81 1va5 h PRO 184 Ca -0.50 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.60 1va5 h PRO 184 Cb 1.24 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 1va5 h PRO 184 CO 0.63 0.00 -0.15 0.00 -0.23 0.00 0.00 178.00 178.26 1va5 h ALA 185 N 2.03 1.74 -0.46 -0.56 0.00 -1.90 -1.69 119.26 118.41 1va5 h ALA 185 Ca 0.00 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1va5 h ALA 185 Cb 0.07 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1va5 h ALA 185 CO 0.00 0.18 0.08 -1.49 0.00 0.00 0.00 179.25 178.03 1va5 h TRP 186 N 0.00 0.79 -0.00 0.00 4.06 -1.68 -2.35 115.95 116.77 1va5 h TRP 186 Ca -0.00 -0.11 -0.18 0.00 2.06 0.00 0.00 58.89 60.67 1va5 h TRP 186 Cb 0.26 -0.22 -0.02 0.00 -1.00 0.00 0.00 29.16 28.18 1va5 h TRP 186 CO 0.00 0.74 -0.81 0.87 -3.56 0.00 0.00 178.44 175.68 1va5 h LYS 187 N 0.61 0.06 -0.62 0.49 1.57 -1.69 -2.88 116.57 114.11 1va5 h LYS 187 Ca 0.14 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1va5 h LYS 187 Cb 0.37 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.67 1va5 h LYS 187 CO 0.01 0.84 0.35 -0.09 -0.57 0.00 0.00 179.45 179.99 1va5 h ARG 188 N 0.04 0.85 -0.52 3.15 1.12 -1.14 -2.62 114.38 115.25 1va5 h ARG 188 Ca -0.02 -0.08 -0.02 0.00 -1.11 0.00 0.00 59.98 58.75 1va5 h ARG 188 Cb 1.43 -0.18 -0.01 0.00 -0.01 0.00 0.00 29.97 31.20 1va5 h ARG 188 CO 0.11 0.61 0.02 0.09 -3.11 0.00 0.00 179.97 177.70 1va5 n ASN 189 N -4.39 5.28 -4.48 -3.80 3.02 -0.90 -4.89 115.26 105.09 1va5 n ASN 189 Ca 0.06 -2.99 -0.42 0.00 -0.03 0.00 0.00 54.58 51.20 1va5 n ASN 189 Cb 0.09 -0.66 -0.10 0.00 -0.61 0.00 0.00 39.78 38.50 1va5 n ASN 189 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1va5 s ASP 190 N -1.07 6.12 0.26 6.41 -1.08 -0.99 -4.86 116.67 121.47 1va5 s ASP 190 Ca 0.52 -0.71 -0.01 0.00 -0.52 0.00 0.00 52.55 51.83 1va5 s ASP 190 Cb 0.40 -2.17 0.55 0.00 -1.46 0.00 0.00 42.92 40.24 1va5 s ASP 190 CO 0.14 -0.42 1.75 -0.65 0.52 0.00 0.00 175.17 176.52 1va5 h PRO 191 N 8.61 0.58 -0.22 4.34 0.11 -1.87 -0.73 132.00 142.80 1va5 h PRO 191 Ca -0.28 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 65.84 1va5 h PRO 191 Cb 1.13 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 32.07 1va5 h PRO 191 CO 0.72 0.38 -0.05 1.98 -0.21 0.00 0.00 178.00 180.82 1va5 h MET 192 N 0.59 0.00 -0.03 1.05 4.05 -1.67 -1.40 114.93 117.53 1va5 h MET 192 Ca 0.47 -0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 59.83 1va5 h MET 192 Cb 0.69 -0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.48 1va5 h MET 192 CO -0.38 0.00 -0.28 0.28 0.23 0.00 0.00 176.91 176.76 1va5 h VAL 193 N 0.00 1.21 -0.44 -5.77 2.07 -1.55 -2.84 116.25 108.93 1va5 h VAL 193 Ca 0.11 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.62 1va5 h VAL 193 Cb 0.16 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1va5 h VAL 193 CO -0.23 0.29 0.00 0.00 0.02 0.00 0.00 177.57 177.66 1va5 n GLN 194 N -4.19 2.08 -0.33 1.57 1.13 -0.39 -4.40 117.38 112.85 1va5 n GLN 194 Ca -0.02 -1.67 0.11 0.00 -1.94 0.00 0.00 57.00 53.47 1va5 n GLN 194 Cb 0.34 -1.38 0.28 0.00 0.11 0.00 0.00 30.24 29.59 1va5 n GLN 194 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 1va5 h ILE 195 N 2.80 0.72 -0.62 5.09 2.04 -1.03 -0.56 117.51 125.95 1va5 h ILE 195 Ca 0.00 -0.25 0.11 0.00 1.00 0.00 0.00 64.86 65.73 1va5 h ILE 195 Cb 0.64 -0.07 -0.04 0.00 -0.74 0.00 0.00 36.82 36.61 1va5 h ILE 195 CO 0.00 0.13 0.42 -0.65 0.00 0.00 0.00 178.15 178.05 1va5 h PRO 196 N 0.72 0.35 -0.25 2.37 0.11 -1.85 -0.63 132.00 132.84 1va5 h PRO 196 Ca 0.54 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 66.46 1va5 h PRO 196 Cb 0.80 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.83 1va5 h PRO 196 CO -0.37 0.23 -0.48 0.00 -0.21 0.00 0.00 178.00 177.17 1va5 h ARG 197 N 0.36 0.77 -0.44 1.05 3.08 -1.43 -0.46 114.38 117.31 1va5 h ARG 197 Ca 0.29 -0.49 -0.04 0.00 0.07 0.00 0.00 59.98 59.80 1va5 h ARG 197 Cb 0.65 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.74 1va5 h ARG 197 CO -0.08 1.12 0.09 -0.07 -1.07 0.00 0.00 179.97 179.96 1va5 h LEU 198 N 0.51 0.61 0.08 3.04 3.38 -1.09 -0.91 115.31 120.92 1va5 h LEU 198 Ca 0.01 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1va5 h LEU 198 Cb 1.09 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1va5 h LEU 198 CO 0.11 0.62 -0.04 0.58 0.09 0.00 0.00 178.44 179.80 1va5 h VAL 199 N 0.64 1.19 -0.92 1.22 2.07 -1.07 -1.44 116.25 117.93 1va5 h VAL 199 Ca 0.14 -1.34 0.15 0.00 0.82 0.00 0.00 66.70 66.48 1va5 h VAL 199 Cb 0.26 2.01 -0.09 0.00 -1.52 0.00 0.00 31.29 31.95 1va5 h VAL 199 CO -0.00 0.31 0.53 0.00 0.02 0.00 0.00 177.57 178.43 1va5 h ALA 200 N 0.03 1.44 -0.00 1.67 0.00 -0.96 0.12 119.26 121.55 1va5 h ALA 200 Ca -0.01 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1va5 h ALA 200 Cb 0.59 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1va5 h ALA 200 CO 0.02 -0.00 -0.09 0.09 0.00 0.00 0.00 179.25 179.27 1va5 n ASN 201 N -4.78 0.44 -3.67 0.00 3.02 -0.36 -4.92 115.26 104.99 1va5 n ASN 201 Ca 0.19 -0.62 -0.28 0.00 -0.03 0.00 0.00 54.58 53.85 1va5 n ASN 201 Cb 0.45 -0.08 0.02 0.00 -0.61 0.00 0.00 39.78 39.56 1va5 n ASN 201 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1va5 n ASN 202 N -0.93 -4.81 -4.77 6.41 5.15 0.42 -4.90 115.26 111.82 1va5 n ASN 202 Ca 0.15 -0.62 -0.40 0.00 -0.60 0.00 0.00 54.58 53.11 1va5 n ASN 202 Cb 0.26 -3.87 0.01 0.00 -0.53 0.00 0.00 39.78 35.66 1va5 n ASN 202 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1va5 s THR 203 N -3.20 2.02 -0.35 -0.44 2.01 -0.61 -4.94 115.64 110.13 1va5 s THR 203 Ca 0.56 0.02 -0.22 0.00 0.31 0.00 0.00 61.69 62.36 1va5 s THR 203 Cb -0.28 -3.01 0.00 0.00 0.01 0.00 0.00 72.50 69.22 1va5 s THR 203 CO 0.69 0.00 0.70 -0.60 -0.69 0.00 0.00 174.62 174.73 1va5 s ARG 204 N -2.39 3.75 0.00 4.92 3.00 -0.25 -4.65 118.95 123.34 1va5 s ARG 204 Ca 0.59 0.22 0.06 0.00 -1.00 0.00 0.00 55.73 55.61 1va5 s ARG 204 Cb -0.45 -3.79 -0.03 0.00 0.00 0.00 0.00 34.95 30.68 1va5 s ARG 204 CO 0.59 -0.76 -0.19 0.96 0.00 0.00 0.00 175.30 175.90 1va5 s ILE 205 N 2.86 2.71 -0.28 4.11 -4.36 -0.82 -1.35 121.20 124.08 1va5 s ILE 205 Ca 0.28 -1.04 0.03 0.00 -0.26 0.00 0.00 60.65 59.66 1va5 s ILE 205 Cb -0.14 -2.08 0.07 0.00 1.25 0.00 0.00 42.46 41.56 1va5 s ILE 205 CO 0.15 0.46 -0.05 0.86 0.24 0.00 0.00 174.94 176.60 1va5 s TRP 206 N -0.80 3.14 -0.19 1.37 -0.11 -0.45 -0.78 118.94 121.11 1va5 s TRP 206 Ca 0.13 -2.34 -0.03 0.00 1.22 0.00 0.00 56.10 55.08 1va5 s TRP 206 Cb -0.10 -2.08 -0.01 0.00 -1.50 0.00 0.00 33.47 29.77 1va5 s TRP 206 CO 0.02 -0.87 -0.07 0.08 -4.62 0.00 0.00 176.95 171.49 1va5 s VAL 207 N 1.14 3.22 0.11 5.86 1.01 0.31 -0.77 120.40 131.28 1va5 s VAL 207 Ca -0.03 -0.56 0.07 0.00 0.00 0.00 0.00 61.98 61.46 1va5 s VAL 207 Cb -0.19 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.72 1va5 s VAL 207 CO -0.07 0.46 -0.18 -0.47 0.00 0.00 0.00 175.10 174.84 1va5 s TYR 208 N 1.15 1.60 -0.29 5.22 6.14 -0.26 -0.78 117.35 130.13 1va5 s TYR 208 Ca 0.02 -0.45 -0.16 0.00 0.64 0.00 0.00 57.07 57.11 1va5 s TYR 208 Cb -0.14 -0.86 0.14 0.00 0.42 0.00 0.00 41.96 41.51 1va5 s TYR 208 CO -0.02 0.18 0.95 0.00 0.64 0.00 0.00 175.55 177.30 1va5 n GLY 210 N 3.69 -1.30 0.13 0.00 0.00 -1.26 -4.28 105.19 102.17 1va5 n GLY 210 Ca -0.18 -1.67 0.01 0.00 0.00 0.00 0.00 46.02 44.18 1va5 n GLY 210 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1va5 n ASN 211 N -3.25 1.51 0.00 1.61 6.94 -1.07 -4.66 115.26 116.35 1va5 n ASN 211 Ca 0.05 -1.36 0.00 0.00 -0.02 0.00 0.00 54.58 53.25 1va5 n ASN 211 Cb 0.16 -0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.56 1va5 n ASN 211 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1va5 n GLY 212 N 0.06 0.51 3.55 4.83 0.00 0.37 -4.26 105.19 110.26 1va5 n GLY 212 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1va5 n GLY 212 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1va5 s THR 213 N -2.11 5.02 0.56 2.61 2.01 -1.23 -4.66 115.64 117.84 1va5 s THR 213 Ca 0.00 0.29 -0.20 0.00 0.31 0.00 0.00 61.69 62.09 1va5 s THR 213 Cb 0.00 -3.97 -0.05 0.00 0.01 0.00 0.00 72.50 68.50 1va5 s THR 213 CO 0.00 -0.23 1.20 -2.16 -0.69 0.00 0.00 174.62 172.74 1va5 s PRO 214 N 2.38 3.19 0.00 4.92 0.04 -1.26 0.05 135.00 144.31 1va5 s PRO 214 Ca 0.18 1.82 0.00 0.00 0.04 0.00 0.00 61.00 63.04 1va5 s PRO 214 Cb -0.16 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.33 1va5 s PRO 214 CO 0.13 -1.03 0.00 -1.13 0.04 0.00 0.00 177.00 175.02 1va5 n SER 215 N -1.29 0.91 0.00 6.66 3.41 -1.26 -4.79 113.62 117.25 1va5 n SER 215 Ca 0.12 -0.37 0.07 0.00 -0.26 0.00 0.00 58.87 58.43 1va5 n SER 215 Cb 0.49 0.00 0.33 0.00 -0.26 0.00 0.00 64.21 64.77 1va5 n SER 215 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1va5 n ASP 216 N -0.77 0.00 0.16 4.04 8.00 -1.26 -2.26 116.55 124.45 1va5 n ASP 216 Ca 0.00 0.30 0.13 0.00 0.71 0.00 0.00 54.79 55.93 1va5 n ASP 216 Cb 0.00 -0.40 0.51 0.00 -0.02 0.00 0.00 41.12 41.21 1va5 n ASP 216 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1va5 h LEU 217 N 0.00 0.00 0.00 0.64 3.38 -1.99 -3.49 115.31 113.85 1va5 h LEU 217 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1va5 h LEU 217 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1va5 h LEU 217 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1va5 n GLY 218 N 0.21 0.37 2.34 0.83 0.00 -0.96 -4.83 105.19 103.15 1va5 n GLY 218 Ca 0.02 -1.55 -0.12 0.00 0.00 0.00 0.00 46.02 44.37 1va5 n GLY 218 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1va5 n GLY 219 N 0.00 -0.07 3.44 -0.02 0.00 -1.26 -4.41 105.19 102.87 1va5 n GLY 219 Ca 0.00 -0.33 -0.44 0.00 0.00 0.00 0.00 46.02 45.25 1va5 n GLY 219 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1va5 s ASP 220 N -2.63 6.69 -0.04 1.61 2.15 -1.26 -4.62 116.67 118.56 1va5 s ASP 220 Ca 0.08 -2.20 -0.14 0.00 0.43 0.00 0.00 52.55 50.72 1va5 s ASP 220 Cb -0.03 -2.38 0.02 0.00 -0.30 0.00 0.00 42.92 40.23 1va5 s ASP 220 CO 0.10 -0.98 0.31 0.54 -0.17 0.00 0.00 175.17 174.96 1va5 s ASN 221 N 3.41 -0.22 0.21 -0.34 2.20 -1.26 -5.07 114.94 113.85 1va5 s ASN 221 Ca 0.32 0.23 -0.15 0.00 -0.94 0.00 0.00 52.86 52.31 1va5 s ASN 221 Cb -0.05 0.40 0.21 0.00 -2.00 0.00 0.00 41.25 39.81 1va5 s ASN 221 CO -0.09 -0.36 1.61 0.40 -2.94 0.00 0.00 177.10 175.73 1va5 h ILE 222 N 4.07 0.31 -0.42 0.54 2.04 -1.99 -1.32 117.51 120.74 1va5 h ILE 222 Ca -0.29 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.60 1va5 h ILE 222 Cb 1.18 0.31 -0.04 0.00 -0.74 0.00 0.00 36.82 37.53 1va5 h ILE 222 CO 0.37 0.00 0.21 -0.65 0.00 0.00 0.00 178.15 178.08 1va5 h PRO 223 N -0.05 0.41 -0.47 2.37 0.11 -1.98 0.24 132.00 132.63 1va5 h PRO 223 Ca 0.29 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.33 1va5 h PRO 223 Cb 0.49 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.49 1va5 h PRO 223 CO -0.66 0.27 0.10 0.00 -0.21 0.00 0.00 178.00 177.50 1va5 h ALA 224 N 1.22 1.30 0.01 -0.75 0.00 -1.70 -1.60 119.26 117.74 1va5 h ALA 224 Ca 0.18 -0.19 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 1va5 h ALA 224 Cb 0.09 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.70 1va5 h ALA 224 CO -0.13 0.49 -0.66 0.87 0.00 0.00 0.00 179.25 179.82 1va5 h LYS 225 N 0.69 0.43 -0.08 0.00 1.57 -0.86 0.13 116.57 118.45 1va5 h LYS 225 Ca 0.15 -0.48 -0.01 0.00 -1.87 0.00 0.00 60.65 58.45 1va5 h LYS 225 Cb 0.27 0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.72 1va5 h LYS 225 CO -0.00 1.13 0.02 0.35 -0.57 0.00 0.00 179.45 180.38 1va5 h PHE 226 N -0.07 0.14 -0.61 -1.35 3.57 -0.89 -2.35 116.94 115.38 1va5 h PHE 226 Ca -0.08 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.45 1va5 h PHE 226 Cb 1.37 -0.04 -0.05 0.00 2.79 0.00 0.00 35.95 40.02 1va5 h PHE 226 CO 0.15 0.31 0.33 -0.07 -2.23 0.00 0.00 178.31 176.80 1va5 h LEU 227 N -0.08 0.49 -0.28 0.59 3.38 -1.42 0.63 115.31 118.63 1va5 h LEU 227 Ca 0.03 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1va5 h LEU 227 Cb 0.25 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1va5 h LEU 227 CO 0.00 0.33 0.10 -0.08 0.09 0.00 0.00 178.44 178.88 1va5 h GLU 228 N 0.63 0.42 -0.68 1.13 4.57 -1.53 -0.61 114.58 118.51 1va5 h GLU 228 Ca 0.27 -0.08 -0.02 0.00 -1.18 0.00 0.00 59.36 58.35 1va5 h GLU 228 Cb 0.15 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.64 1va5 h GLU 228 CO -0.17 0.46 0.36 0.78 -1.18 0.00 0.00 179.01 179.27 1va5 h GLY 229 N 0.29 1.01 0.66 1.92 0.00 -1.04 -1.33 103.07 104.58 1va5 h GLY 229 Ca 0.09 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 1va5 h GLY 229 CO -0.01 0.43 -0.19 -2.00 0.00 0.00 0.00 176.54 174.78 1va5 h LEU 230 N 0.95 -0.45 -1.71 3.11 5.85 -0.52 -3.23 115.31 119.32 1va5 h LEU 230 Ca 0.24 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1va5 h LEU 230 Cb 0.04 0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 1va5 h LEU 230 CO -0.04 -0.07 -0.04 0.00 -0.34 0.00 0.00 178.44 177.95 1va5 h THR 231 N -0.87 0.11 -0.73 1.05 1.03 -1.06 -2.65 112.91 109.79 1va5 h THR 231 Ca -0.05 -0.50 0.11 0.00 -0.01 0.00 0.00 66.41 65.96 1va5 h THR 231 Cb 0.55 1.44 -0.05 0.00 -1.07 0.00 0.00 68.15 69.02 1va5 h THR 231 CO 0.09 0.04 0.48 0.25 -0.01 0.00 0.00 175.52 176.37 1va5 h LEU 232 N 0.00 0.51 -0.70 0.00 5.85 -1.25 -0.12 115.31 119.59 1va5 h LEU 232 Ca -0.00 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.77 1va5 h LEU 232 Cb 0.44 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.34 1va5 h LEU 232 CO 0.00 0.29 0.44 0.03 -0.34 0.00 0.00 178.44 178.86 1va5 h ARG 233 N 0.56 0.82 -0.27 1.25 3.08 -1.59 0.17 114.38 118.40 1va5 h ARG 233 Ca 0.34 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 60.23 1va5 h ARG 233 Cb 0.58 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 1va5 h ARG 233 CO -0.12 0.55 -0.32 1.15 -1.07 0.00 0.00 179.97 180.15 1va5 h THR 234 N 0.85 1.28 -0.37 2.04 2.02 -1.22 -2.47 112.91 115.04 1va5 h THR 234 Ca 0.29 -1.43 -0.14 0.00 0.77 0.00 0.00 66.41 65.89 1va5 h THR 234 Cb 0.04 1.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 1va5 h THR 234 CO -0.12 0.46 -0.34 0.78 0.37 0.00 0.00 175.52 176.67 1va5 h ASN 235 N 0.49 0.89 -0.44 4.18 2.35 -0.25 0.50 115.58 123.31 1va5 h ASN 235 Ca 0.06 -0.39 -0.11 0.00 -0.55 0.00 0.00 56.30 55.32 1va5 h ASN 235 Cb 0.80 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.90 1va5 h ASN 235 CO 0.07 1.15 -0.12 1.56 -1.65 0.00 0.00 177.43 178.44 1va5 h GLN 236 N 0.71 0.91 -0.15 0.81 4.20 -0.62 -0.54 115.11 120.41 1va5 h GLN 236 Ca 0.07 -0.32 -0.14 0.00 0.06 0.00 0.00 58.65 58.31 1va5 h GLN 236 Cb 0.91 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.61 1va5 h GLN 236 CO 0.08 0.97 -0.51 1.15 -0.67 0.00 0.00 178.83 179.85 1va5 h THR 237 N 0.81 1.33 -0.06 -0.54 2.02 -1.32 -0.55 112.91 114.60 1va5 h THR 237 Ca 0.13 -1.76 -0.00 0.00 0.77 0.00 0.00 66.41 65.55 1va5 h THR 237 Cb 0.64 1.78 -0.00 0.00 -1.74 0.00 0.00 68.15 68.83 1va5 h THR 237 CO 0.04 0.54 0.02 0.15 0.37 0.00 0.00 175.52 176.65 1va5 h PHE 238 N 0.33 0.09 -0.18 3.16 3.57 -0.56 0.36 116.94 123.72 1va5 h PHE 238 Ca 0.01 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.55 1va5 h PHE 238 Cb 1.02 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.68 1va5 h PHE 238 CO 0.03 0.21 -0.11 -0.09 -2.23 0.00 0.00 178.31 176.13 1va5 h ARG 239 N -0.06 -0.10 -0.42 1.11 1.12 -0.92 0.19 114.38 115.31 1va5 h ARG 239 Ca 0.02 0.01 0.04 0.00 -1.11 0.00 0.00 59.98 58.94 1va5 h ARG 239 Cb 0.16 0.02 -0.04 0.00 -0.01 0.00 0.00 29.97 30.10 1va5 h ARG 239 CO -0.00 -0.07 0.18 -0.44 -3.11 0.00 0.00 179.97 176.53 1va5 h ASP 240 N -0.10 0.22 -0.54 -3.80 3.45 -0.89 -1.55 116.42 113.21 1va5 h ASP 240 Ca 0.10 0.04 -0.10 0.00 0.43 0.00 0.00 57.03 57.50 1va5 h ASP 240 Cb 0.26 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.01 1va5 h ASP 240 CO -0.25 0.16 -0.07 0.74 -1.57 0.00 0.00 179.24 178.26 1va5 h THR 241 N 0.36 1.27 -0.11 0.35 2.02 -0.48 -0.96 112.91 115.35 1va5 h THR 241 Ca 0.19 -1.21 0.02 0.00 0.77 0.00 0.00 66.41 66.17 1va5 h THR 241 Cb 0.15 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.49 1va5 h THR 241 CO -0.17 0.43 -0.01 0.22 0.37 0.00 0.00 175.52 176.36 1va5 h TYR 242 N 0.88 -0.02 -0.23 3.16 3.20 -0.30 0.20 116.97 123.86 1va5 h TYR 242 Ca 0.14 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 1va5 h TYR 242 Cb 0.63 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.92 1va5 h TYR 242 CO 0.04 -0.03 0.12 0.00 -1.64 0.00 0.00 178.16 176.66 1va5 h ALA 243 N 1.10 0.30 -0.38 1.82 0.00 -1.19 0.10 119.26 121.02 1va5 h ALA 243 Ca 0.05 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1va5 h ALA 243 Cb 0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1va5 h ALA 243 CO -0.10 -0.16 0.25 0.00 0.00 0.00 0.00 179.25 179.25 1va5 h ALA 244 N 1.00 1.75 -0.04 0.00 0.00 -0.89 -1.27 119.26 119.81 1va5 h ALA 244 Ca 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1va5 h ALA 244 Cb 0.08 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1va5 h ALA 244 CO -0.01 0.23 0.00 -0.25 0.00 0.00 0.00 179.25 179.22 1va5 n ASP 245 N -4.48 0.41 0.00 0.00 10.43 0.04 -4.88 116.55 118.07 1va5 n ASP 245 Ca 0.03 -1.48 0.00 0.00 2.57 0.00 0.00 54.79 55.91 1va5 n ASP 245 Cb 0.07 -0.02 0.00 0.00 1.84 0.00 0.00 41.12 43.01 1va5 n ASP 245 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1va5 n GLY 246 N 0.88 0.84 3.76 0.44 0.00 -0.48 -5.02 105.19 105.62 1va5 n GLY 246 Ca 0.15 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1va5 n GLY 246 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1va5 s GLY 247 N -2.03 2.70 0.00 -0.02 0.00 0.33 -4.92 107.32 103.38 1va5 s GLY 247 Ca 0.00 1.40 0.08 0.00 0.00 0.00 0.00 44.72 46.20 1va5 s GLY 247 CO 0.00 2.19 0.98 -0.96 0.00 0.00 0.00 173.10 175.30 1va5 n ARG 248 N 1.28 0.00 -2.57 2.90 1.85 -1.26 -4.58 116.66 114.28 1va5 n ARG 248 Ca 0.03 -1.16 -0.08 0.00 -1.00 0.00 0.00 57.85 55.63 1va5 n ARG 248 Cb 0.40 -0.17 0.04 0.00 -1.05 0.00 0.00 32.46 31.68 1va5 n ARG 248 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1va5 n ASN 249 N 0.16 2.66 -4.41 2.89 5.15 -1.26 -5.09 115.26 115.35 1va5 n ASN 249 Ca -0.01 -2.63 -0.22 0.00 -0.60 0.00 0.00 54.58 51.13 1va5 n ASN 249 Cb 0.81 -0.44 -0.10 0.00 -0.53 0.00 0.00 39.78 39.52 1va5 n ASN 249 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1va5 s GLY 250 N -3.70 1.67 -0.15 8.20 0.00 -1.26 -1.94 107.32 110.14 1va5 s GLY 250 Ca 0.35 -1.76 0.00 0.00 0.00 0.00 0.00 44.72 43.31 1va5 s GLY 250 CO -0.02 -1.84 -0.14 0.14 0.00 0.00 0.00 173.10 171.24 1va5 s VAL 251 N -2.61 1.59 -0.25 1.40 1.01 0.04 -4.97 120.40 116.61 1va5 s VAL 251 Ca 0.26 -0.64 -0.02 0.00 0.00 0.00 0.00 61.98 61.58 1va5 s VAL 251 Cb -0.04 -1.49 0.03 0.00 0.00 0.00 0.00 36.38 34.88 1va5 s VAL 251 CO 0.11 0.46 -0.06 -0.36 0.00 0.00 0.00 175.10 175.26 1va5 s PHE 252 N 1.48 3.08 -0.40 5.22 0.08 -1.26 -0.53 117.98 125.65 1va5 s PHE 252 Ca 0.05 -1.56 -0.06 0.00 0.12 0.00 0.00 56.93 55.48 1va5 s PHE 252 Cb -0.13 -2.06 0.09 0.00 -0.57 0.00 0.00 43.02 40.34 1va5 s PHE 252 CO -0.11 -0.73 0.21 -0.80 -0.10 0.00 0.00 175.22 173.70 1va5 s ASN 253 N 1.32 5.43 -0.55 1.36 0.02 0.04 -4.98 114.94 117.58 1va5 s ASN 253 Ca -0.00 -1.66 0.07 0.00 -1.02 0.00 0.00 52.86 50.25 1va5 s ASN 253 Cb -0.17 -1.91 0.29 0.00 0.02 0.00 0.00 41.25 39.48 1va5 s ASN 253 CO -0.04 -0.51 0.77 0.49 0.02 0.00 0.00 177.10 177.83 1va5 n PHE 254 N 4.78 2.75 -1.22 2.20 0.99 -1.26 -2.23 117.46 123.47 1va5 n PHE 254 Ca -0.08 -3.98 -0.31 0.00 -0.00 0.00 0.00 57.45 53.09 1va5 n PHE 254 Cb 0.42 -0.49 0.11 0.00 -1.00 0.00 0.00 39.48 38.52 1va5 n PHE 254 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 1va5 s PRO 255 N -2.56 1.85 -0.03 -1.08 0.04 -1.26 -4.90 135.00 127.07 1va5 s PRO 255 Ca 0.42 1.06 -0.02 0.00 0.04 0.00 0.00 61.00 62.50 1va5 s PRO 255 Cb 0.21 -1.86 -0.08 0.00 0.04 0.00 0.00 34.50 32.82 1va5 s PRO 255 CO -0.07 -1.89 2.56 -0.35 0.04 0.00 0.00 177.00 177.28 1va5 n PRO 256 N -3.68 1.41 -3.83 0.56 -0.04 -1.26 -4.09 135.00 124.06 1va5 n PRO 256 Ca 0.08 -0.47 -0.07 0.00 -0.04 0.00 0.00 63.50 63.01 1va5 n PRO 256 Cb 0.54 -1.39 -0.00 0.00 -0.04 0.00 0.00 33.50 32.60 1va5 n PRO 256 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1va5 s ASN 257 N 1.87 -0.15 0.00 3.54 0.01 -1.26 -4.77 114.94 114.17 1va5 s ASN 257 Ca 0.25 -0.77 0.00 0.00 -0.71 0.00 0.00 52.86 51.63 1va5 s ASN 257 Cb 0.13 0.74 0.00 0.00 0.41 0.00 0.00 41.25 42.53 1va5 s ASN 257 CO -0.01 -1.41 0.00 0.61 -1.51 0.00 0.00 177.10 174.78 1va5 n GLY 258 N -0.49 2.66 3.64 0.66 0.00 0.11 -2.59 105.19 109.18 1va5 n GLY 258 Ca -0.06 -1.43 -0.29 0.00 0.00 0.00 0.00 46.02 44.25 1va5 n GLY 258 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1va5 s THR 259 N -0.35 1.72 -1.18 2.61 -4.23 -1.26 -0.48 115.64 112.46 1va5 s THR 259 Ca 0.00 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 58.34 1va5 s THR 259 Cb 0.00 -2.77 -0.04 0.00 1.34 0.00 0.00 72.50 71.03 1va5 s THR 259 CO 0.00 0.00 2.12 1.57 -0.54 0.00 0.00 174.62 177.77 1va5 n HIS 260 N -1.02 2.82 -3.97 3.99 -0.00 0.43 -4.83 115.22 112.64 1va5 n HIS 260 Ca -0.08 -2.50 -0.09 0.00 0.46 0.00 0.00 57.72 55.51 1va5 n HIS 260 Cb 0.67 -2.21 -0.08 0.00 -0.12 0.00 0.00 29.99 28.25 1va5 n HIS 260 CO 0.00 0.00 0.00 -1.54 0.46 0.00 0.00 176.34 175.26 1va5 s SER 261 N 3.90 0.21 0.27 0.26 1.04 -1.26 -4.75 113.70 113.36 1va5 s SER 261 Ca 0.51 -0.85 -0.02 0.00 0.48 0.00 0.00 55.95 56.08 1va5 s SER 261 Cb 0.14 0.32 0.46 0.00 0.10 0.00 0.00 66.02 67.05 1va5 s SER 261 CO -0.01 -0.74 1.85 -0.50 0.98 0.00 0.00 173.24 174.82 1va5 h TRP 262 N 2.81 1.09 -0.84 5.02 4.06 -1.96 -3.00 115.95 123.13 1va5 h TRP 262 Ca -0.34 0.03 0.17 0.00 2.06 0.00 0.00 58.89 60.81 1va5 h TRP 262 Cb 1.19 -0.35 -0.10 0.00 -1.00 0.00 0.00 29.16 28.90 1va5 h TRP 262 CO 0.44 0.49 0.38 -1.35 -3.56 0.00 0.00 178.44 174.84 1va5 h PRO 263 N 1.01 0.49 -0.16 0.49 0.11 -1.89 0.33 132.00 132.38 1va5 h PRO 263 Ca 0.45 -0.03 -0.17 0.00 0.11 0.00 0.00 66.00 66.36 1va5 h PRO 263 Cb 0.34 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.34 1va5 h PRO 263 CO -0.23 0.33 -0.60 1.88 -0.21 0.00 0.00 178.00 179.17 1va5 h TYR 264 N 0.51 0.70 -0.25 0.65 -1.99 -1.85 -2.06 116.97 112.68 1va5 h TYR 264 Ca 0.48 -0.26 -0.11 0.00 2.00 0.00 0.00 58.73 60.83 1va5 h TYR 264 Cb 0.76 -0.13 -0.01 0.00 2.00 0.00 0.00 36.73 39.35 1va5 h TYR 264 CO -0.13 1.00 -0.31 -1.49 -0.00 0.00 0.00 178.16 177.24 1va5 h TRP 265 N 0.41 0.59 -0.41 4.88 6.55 -1.26 -2.26 115.95 124.45 1va5 h TRP 265 Ca -0.00 -0.14 -0.14 0.00 0.95 0.00 0.00 58.89 59.56 1va5 h TRP 265 Cb 1.15 -0.14 -0.01 0.00 -0.86 0.00 0.00 29.16 29.30 1va5 h TRP 265 CO 0.05 0.77 -0.28 -0.97 -1.05 0.00 0.00 178.44 176.95 1va5 h ASN 266 N 0.44 0.93 -0.84 -3.49 -0.73 -0.86 -1.05 115.58 109.99 1va5 h ASN 266 Ca 0.06 -0.38 0.03 0.00 1.87 0.00 0.00 56.30 57.88 1va5 h ASN 266 Cb 0.76 -0.26 -0.05 0.00 0.27 0.00 0.00 38.32 39.05 1va5 h ASN 266 CO 0.06 1.15 0.55 -0.08 -0.37 0.00 0.00 177.43 178.74 1va5 h GLU 267 N 0.76 1.04 -0.08 6.67 4.22 -1.09 -1.63 114.58 124.46 1va5 h GLU 267 Ca 0.09 -0.06 -0.22 0.00 0.08 0.00 0.00 59.36 59.24 1va5 h GLU 267 Cb 0.85 -0.23 0.01 0.00 0.50 0.00 0.00 28.75 29.87 1va5 h GLU 267 CO 0.07 0.69 -0.84 1.96 -2.18 0.00 0.00 179.01 178.71 1va5 h GLN 268 N 1.07 0.59 -0.84 1.92 1.08 -1.17 -1.89 115.11 115.88 1va5 h GLN 268 Ca 0.33 -0.54 0.04 0.00 -1.45 0.00 0.00 58.65 57.03 1va5 h GLN 268 Cb -0.01 0.13 -0.05 0.00 -0.05 0.00 0.00 27.48 27.50 1va5 h GLN 268 CO -0.09 1.16 0.53 1.25 -0.95 0.00 0.00 178.83 180.72 1va5 h LEU 269 N 0.38 0.86 -0.26 1.46 5.85 -0.58 -0.06 115.31 122.96 1va5 h LEU 269 Ca -0.06 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.57 1va5 h LEU 269 Cb 1.46 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 1va5 h LEU 269 CO 0.16 0.57 -0.18 0.58 -0.34 0.00 0.00 178.44 179.23 1va5 h VAL 270 N 1.00 1.31 -0.59 1.05 2.07 -1.28 -2.93 116.25 116.88 1va5 h VAL 270 Ca 0.35 -1.31 -0.01 0.00 0.82 0.00 0.00 66.70 66.55 1va5 h VAL 270 Cb 0.07 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 1va5 h VAL 270 CO -0.14 0.41 0.33 0.00 0.02 0.00 0.00 177.57 178.20 1va5 h ALA 271 N 0.71 1.48 0.00 1.67 0.00 -0.76 -2.59 119.26 119.77 1va5 h ALA 271 Ca 0.05 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1va5 h ALA 271 Cb 0.72 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1va5 h ALA 271 CO 0.05 0.44 -0.15 0.00 0.00 0.00 0.00 179.25 179.58 1va5 n MET 272 N -4.40 0.15 -0.09 0.00 0.00 -0.09 -4.30 117.12 108.40 1va5 n MET 272 Ca 0.05 0.10 -0.09 0.00 0.00 0.00 0.00 57.70 57.77 1va5 n MET 272 Cb 0.09 -1.65 -0.03 0.00 0.00 0.00 0.00 33.22 31.63 1va5 n MET 272 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 175.97 175.75 1va5 h LYS 273 N 0.00 -0.30 -0.40 3.17 3.64 -1.26 0.29 116.57 121.71 1va5 h LYS 273 Ca 0.00 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1va5 h LYS 273 Cb 0.63 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.50 1va5 h LYS 273 CO 0.00 -0.20 0.24 0.00 -2.27 0.00 0.00 179.45 177.22 1va5 h ALA 274 N 0.59 1.68 -0.40 5.00 0.00 -1.78 -0.45 119.26 123.91 1va5 h ALA 274 Ca 0.14 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1va5 h ALA 274 Cb 0.55 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1va5 h ALA 274 CO -0.50 0.28 0.05 0.22 0.00 0.00 0.00 179.25 179.31 1va5 h ASP 275 N 0.54 0.64 -0.32 0.00 3.58 -1.28 -2.17 116.42 117.41 1va5 h ASP 275 Ca 0.14 -0.27 -0.07 0.00 0.42 0.00 0.00 57.03 57.26 1va5 h ASP 275 Cb -0.03 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 40.84 1va5 h ASP 275 CO -0.03 0.74 -0.07 0.40 -2.88 0.00 0.00 179.24 177.41 1va5 h ILE 276 N 0.51 1.28 -0.37 2.25 2.04 -0.44 -2.16 117.51 120.61 1va5 h ILE 276 Ca 0.12 -1.11 0.06 0.00 1.00 0.00 0.00 64.86 64.93 1va5 h ILE 276 Cb 0.38 1.34 -0.05 0.00 -0.74 0.00 0.00 36.82 37.76 1va5 h ILE 276 CO 0.01 0.36 0.07 1.56 0.00 0.00 0.00 178.15 180.15 1va5 h GLN 277 N 0.39 0.19 -0.51 2.37 4.20 -1.00 0.30 115.11 121.04 1va5 h GLN 277 Ca 0.08 -0.01 -0.11 0.00 0.06 0.00 0.00 58.65 58.67 1va5 h GLN 277 Cb 0.56 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.28 1va5 h GLN 277 CO 0.03 0.12 -0.11 0.45 -0.67 0.00 0.00 178.83 178.66 1va5 h HIS 278 N 0.19 1.05 -0.10 2.96 3.86 -1.37 0.18 115.15 121.92 1va5 h HIS 278 Ca 0.18 -0.21 -0.15 0.00 -1.16 0.00 0.00 60.37 59.03 1va5 h HIS 278 Cb 0.21 -0.26 0.01 0.00 1.06 0.00 0.00 27.41 28.42 1va5 h HIS 278 CO -0.20 0.99 -0.52 0.28 0.86 0.00 0.00 177.93 179.35 1va5 h VAL 279 N 0.85 1.37 0.00 2.45 2.07 -0.92 0.71 116.25 122.77 1va5 h VAL 279 Ca 0.14 -1.85 -0.22 0.00 0.82 0.00 0.00 66.70 65.59 1va5 h VAL 279 Cb 0.65 2.21 -0.03 0.00 -1.52 0.00 0.00 31.29 32.60 1va5 h VAL 279 CO 0.05 0.55 -1.19 -0.07 0.02 0.00 0.00 177.57 176.93 1va5 h LEU 280 N 0.12 0.00 -0.32 2.57 3.38 -0.44 -3.39 115.31 117.23 1va5 h LEU 280 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1va5 h LEU 280 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1va5 h LEU 280 CO 0.11 0.91 0.00 0.59 0.09 0.00 0.00 178.44 180.14 1va5 n ASN 281 N -3.21 0.32 0.00 -0.43 3.02 0.59 -5.03 115.26 110.52 1va5 n ASN 281 Ca -0.05 -0.65 0.00 0.00 -0.03 0.00 0.00 54.58 53.85 1va5 n ASN 281 Cb 0.94 0.57 0.00 0.00 -0.61 0.00 0.00 39.78 40.69 1va5 n ASN 281 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25