#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vg4 n PRO 14 N 0.00 2.00 -1.18 -7.13 -0.05 -1.26 -3.25 135.00 124.13 2vg4 n PRO 14 Ca 0.00 -1.51 -0.36 0.00 -0.05 0.00 0.00 63.50 61.58 2vg4 n PRO 14 Cb 0.00 -1.43 0.07 0.00 -0.05 0.00 0.00 33.50 32.10 2vg4 n PRO 14 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 175.50 176.49 2vg4 n GLN 15 N 0.74 0.20 -2.64 0.54 3.00 -1.26 -4.80 117.38 113.16 2vg4 n GLN 15 Ca 0.17 0.11 -0.41 0.00 -0.01 0.00 0.00 57.00 56.86 2vg4 n GLN 15 Cb 0.42 -1.79 -0.05 0.00 0.00 0.00 0.00 30.24 28.83 2vg4 n GLN 15 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2vg4 s LEU 16 N 0.05 4.53 0.81 1.08 1.43 -0.83 -5.00 118.68 120.73 2vg4 s LEU 16 Ca 0.63 1.96 -0.13 0.00 -1.03 0.00 0.00 54.13 55.56 2vg4 s LEU 16 Cb -0.33 -3.60 0.07 0.00 0.03 0.00 0.00 46.19 42.36 2vg4 s LEU 16 CO 0.60 -0.09 1.09 -0.81 0.23 0.00 0.00 176.35 177.38 2vg4 n PRO 17 N 2.32 0.15 -1.53 1.29 -0.04 -1.26 -4.87 135.00 131.05 2vg4 n PRO 17 Ca 0.02 0.12 -0.38 0.00 -0.04 0.00 0.00 63.50 63.22 2vg4 n PRO 17 Cb 0.47 -2.35 0.05 0.00 -0.04 0.00 0.00 33.50 31.63 2vg4 n PRO 17 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2vg4 n PRO 18 N -2.96 0.66 -2.78 0.54 -0.02 -1.26 -4.94 135.00 124.25 2vg4 n PRO 18 Ca 0.13 0.26 -0.40 0.00 -2.02 0.00 0.00 63.50 61.47 2vg4 n PRO 18 Cb 0.51 -1.91 -0.05 0.00 -0.02 0.00 0.00 33.50 32.02 2vg4 n PRO 18 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vg4 s ALA 19 N -1.63 3.32 1.00 3.55 0.00 -1.26 -5.02 121.76 121.71 2vg4 s ALA 19 Ca 0.72 0.56 -0.17 0.00 0.00 0.00 0.00 51.96 53.08 2vg4 s ALA 19 Cb -0.43 -3.19 -0.02 0.00 0.00 0.00 0.00 23.12 19.48 2vg4 s ALA 19 CO 0.51 0.13 -0.19 -2.30 0.00 0.00 0.00 175.76 173.91 2vg4 n PRO 20 N 2.02 -0.46 -0.10 0.00 -0.02 -1.26 -4.85 135.00 130.34 2vg4 n PRO 20 Ca -0.01 -0.11 -0.04 0.00 -2.02 0.00 0.00 63.50 61.31 2vg4 n PRO 20 Cb 0.48 -1.52 -0.03 0.00 -0.02 0.00 0.00 33.50 32.41 2vg4 n PRO 20 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2vg4 h ASP 21 N -1.47 -0.70 -1.27 2.55 -0.00 -2.01 -2.86 116.42 110.66 2vg4 h ASP 21 Ca -0.45 0.10 -0.60 0.00 -0.00 0.00 0.00 57.03 56.07 2vg4 h ASP 21 Cb 1.31 0.30 -0.18 0.00 -0.00 0.00 0.00 39.33 40.76 2vg4 h ASP 21 CO 0.31 -0.11 0.94 0.47 -0.00 0.00 0.00 179.24 180.85 2vg4 n ASP 22 N -3.71 7.00 -4.89 2.28 10.43 -1.26 -4.94 116.55 121.45 2vg4 n ASP 22 Ca -0.00 -3.30 -0.30 0.00 2.57 0.00 0.00 54.79 53.75 2vg4 n ASP 22 Cb 0.11 -1.24 -0.04 0.00 1.84 0.00 0.00 41.12 41.79 2vg4 n ASP 22 CO 0.00 0.00 0.00 -0.47 -1.07 0.00 0.00 177.20 175.66 2vg4 s TYR 23 N -2.05 3.46 0.25 1.24 5.04 -1.08 -5.03 117.35 119.18 2vg4 s TYR 23 Ca 0.56 0.77 -0.31 0.00 -2.44 0.00 0.00 57.07 55.65 2vg4 s TYR 23 Cb 0.34 -2.20 -0.13 0.00 0.35 0.00 0.00 41.96 40.32 2vg4 s TYR 23 CO -0.22 0.18 1.47 -2.30 -1.34 0.00 0.00 175.55 173.34 2vg4 n PRO 24 N -0.67 2.23 -4.08 4.97 -0.02 -1.26 -4.83 135.00 131.33 2vg4 n PRO 24 Ca -0.00 0.79 -0.32 0.00 -2.02 0.00 0.00 63.50 61.95 2vg4 n PRO 24 Cb 0.53 -2.49 -0.07 0.00 -0.02 0.00 0.00 33.50 31.46 2vg4 n PRO 24 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2vg4 s THR 25 N -0.02 4.65 -0.03 3.45 -4.23 -1.26 -2.35 115.64 115.84 2vg4 s THR 25 Ca 0.67 -0.56 -0.02 0.00 -1.18 0.00 0.00 61.69 60.60 2vg4 s THR 25 Cb -0.60 -3.17 0.02 0.00 1.34 0.00 0.00 72.50 70.08 2vg4 s THR 25 CO 0.49 0.25 0.07 0.12 -0.54 0.00 0.00 174.62 175.01 2vg4 s PHE 26 N -1.28 -0.06 0.19 3.99 5.36 -0.49 -4.40 117.98 121.29 2vg4 s PHE 26 Ca 0.26 0.23 0.03 0.00 -0.96 0.00 0.00 56.93 56.49 2vg4 s PHE 26 Cb -0.12 -0.10 -0.03 0.00 -0.34 0.00 0.00 43.02 42.43 2vg4 s PHE 26 CO 0.18 -0.09 0.33 -1.25 -1.46 0.00 0.00 175.22 172.92 2vg4 s PRO 27 N 0.69 3.45 -0.65 10.12 0.04 -1.26 -2.90 135.00 144.49 2vg4 s PRO 27 Ca -0.06 -0.62 -0.17 0.00 0.04 0.00 0.00 61.00 60.20 2vg4 s PRO 27 Cb -0.08 -2.92 0.14 0.00 0.04 0.00 0.00 34.50 31.68 2vg4 s PRO 27 CO -0.03 0.47 0.69 0.34 0.04 0.00 0.00 177.00 178.51 2vg4 s ASP 28 N -3.49 6.35 -0.14 6.66 2.15 -1.26 -4.78 116.67 122.16 2vg4 s ASP 28 Ca 0.35 -1.86 0.00 0.00 0.43 0.00 0.00 52.55 51.47 2vg4 s ASP 28 Cb -0.10 -2.26 0.13 0.00 -0.30 0.00 0.00 42.92 40.38 2vg4 s ASP 28 CO 0.29 -0.92 1.68 0.41 -0.17 0.00 0.00 175.17 176.46 2vg4 n THR 29 N 5.11 2.03 0.87 1.71 -1.04 -1.26 -3.98 114.28 117.73 2vg4 n THR 29 Ca -0.03 -0.82 0.11 0.00 -2.04 0.00 0.00 64.05 61.27 2vg4 n THR 29 Cb 0.43 -1.19 0.30 0.00 -1.82 0.00 0.00 70.33 68.05 2vg4 n THR 29 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2vg4 n SER 30 N 0.58 2.42 -3.74 8.00 3.41 -1.26 -4.95 113.62 118.08 2vg4 n SER 30 Ca 0.15 -1.83 -0.10 0.00 -0.26 0.00 0.00 58.87 56.83 2vg4 n SER 30 Cb 0.64 -0.15 -0.05 0.00 -0.26 0.00 0.00 64.21 64.39 2vg4 n SER 30 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2vg4 s THR 31 N -1.69 0.05 -0.02 6.66 -4.23 -1.26 -5.11 115.64 110.04 2vg4 s THR 31 Ca 0.34 -0.82 0.01 0.00 -1.18 0.00 0.00 61.69 60.04 2vg4 s THR 31 Cb 0.20 -1.49 0.01 0.00 1.34 0.00 0.00 72.50 72.55 2vg4 s THR 31 CO 0.28 -0.21 -0.03 0.86 -0.54 0.00 0.00 174.62 174.99 2vg4 s TRP 32 N -3.87 0.43 0.26 3.99 -0.00 -1.26 -2.46 118.94 116.03 2vg4 s TRP 32 Ca 0.09 -0.07 -0.30 0.00 -0.00 0.00 0.00 56.10 55.81 2vg4 s TRP 32 Cb 0.01 -0.38 -0.11 0.00 -0.00 0.00 0.00 33.47 32.99 2vg4 s TRP 32 CO -0.05 -0.08 1.53 -2.14 -0.00 0.00 0.00 176.95 176.20 2vg4 s PRO 33 N 0.49 4.19 0.46 5.86 0.02 -1.26 -5.09 135.00 139.68 2vg4 s PRO 33 Ca -0.05 2.44 -0.22 0.00 0.02 0.00 0.00 61.00 63.19 2vg4 s PRO 33 Cb -0.09 -3.07 -0.11 0.00 0.02 0.00 0.00 34.50 31.26 2vg4 s PRO 33 CO -0.01 -0.54 0.73 0.28 -0.33 0.00 0.00 177.00 177.14 2vg4 n VAL 34 N 2.40 2.26 -3.97 3.83 0.31 -1.03 -4.95 118.33 117.17 2vg4 n VAL 34 Ca 0.08 -0.50 -0.36 0.00 -0.01 0.00 0.00 64.34 63.55 2vg4 n VAL 34 Cb 0.39 -0.82 -0.07 0.00 -0.91 0.00 0.00 33.84 32.43 2vg4 n VAL 34 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2vg4 s VAL 35 N -1.45 5.28 -0.06 2.52 1.01 -1.26 -5.06 120.40 121.37 2vg4 s VAL 35 Ca 0.65 0.10 -0.19 0.00 0.00 0.00 0.00 61.98 62.54 2vg4 s VAL 35 Cb -0.55 -3.30 -0.05 0.00 0.00 0.00 0.00 36.38 32.49 2vg4 s VAL 35 CO 0.56 0.60 0.54 0.12 0.00 0.00 0.00 175.10 176.92 2vg4 s PHE 36 N -1.02 3.60 0.23 5.22 5.36 -1.26 -4.53 117.98 125.57 2vg4 s PHE 36 Ca 0.15 1.05 -0.31 0.00 -0.96 0.00 0.00 56.93 56.86 2vg4 s PHE 36 Cb -0.12 -2.58 -0.12 0.00 -0.34 0.00 0.00 43.02 39.87 2vg4 s PHE 36 CO 0.05 0.26 1.67 -1.25 -1.46 0.00 0.00 175.22 174.49 2vg4 s PRO 37 N 0.22 4.14 -0.27 10.12 0.04 -1.26 -4.91 135.00 143.07 2vg4 s PRO 37 Ca 0.29 2.57 -0.34 0.00 0.04 0.00 0.00 61.00 63.56 2vg4 s PRO 37 Cb -0.17 -3.07 -0.10 0.00 0.04 0.00 0.00 34.50 31.20 2vg4 s PRO 37 CO 0.14 -0.70 2.12 -1.91 0.04 0.00 0.00 177.00 176.69 2vg4 n GLU 38 N 3.49 1.50 -3.54 4.56 2.13 -1.26 -4.93 120.64 122.59 2vg4 n GLU 38 Ca 0.13 0.45 -0.37 0.00 0.66 0.00 0.00 57.16 58.03 2vg4 n GLU 38 Cb 0.36 -2.67 -0.07 0.00 0.27 0.00 0.00 31.44 29.34 2vg4 n GLU 38 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2vg4 s LEU 39 N 6.80 4.32 0.87 4.31 1.43 -1.26 -4.88 118.68 130.27 2vg4 s LEU 39 Ca 1.04 0.66 -0.16 0.00 -1.03 0.00 0.00 54.13 54.64 2vg4 s LEU 39 Cb -0.71 -2.44 -0.10 0.00 0.03 0.00 0.00 46.19 42.97 2vg4 s LEU 39 CO 0.47 0.18 -0.31 -2.65 0.23 0.00 0.00 176.35 174.27 2vg4 n PRO 40 N 2.96 -0.01 0.00 1.29 -0.02 -1.26 -4.96 135.00 132.99 2vg4 n PRO 40 Ca -0.13 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 2vg4 n PRO 40 Cb 0.52 -1.26 0.00 0.00 -0.02 0.00 0.00 33.50 32.75 2vg4 n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vg4 n ALA 41 N -2.52 -0.15 -2.11 3.55 0.00 -1.26 -4.93 120.51 113.09 2vg4 n ALA 41 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.43 2vg4 n ALA 41 Cb 0.53 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.00 2vg4 n ALA 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vg4 n ALA 42 N -1.10 -1.46 -2.94 0.00 0.00 -1.26 -4.91 120.51 108.83 2vg4 n ALA 42 Ca 0.00 0.03 -0.33 0.00 0.00 0.00 0.00 53.44 53.14 2vg4 n ALA 42 Cb 0.00 -1.72 -0.13 0.00 0.00 0.00 0.00 19.45 17.60 2vg4 n ALA 42 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2vg4 s PRO 43 N -3.32 3.46 -1.02 0.00 0.05 -1.26 -1.11 135.00 131.81 2vg4 s PRO 43 Ca 0.10 -0.58 -0.01 0.00 0.05 0.00 0.00 61.00 60.56 2vg4 s PRO 43 Cb -0.01 -2.78 0.32 0.00 0.05 0.00 0.00 34.50 32.08 2vg4 s PRO 43 CO 0.27 0.29 1.68 0.66 0.05 0.00 0.00 177.00 179.95 2vg4 n TYR 44 N 3.36 2.68 -1.51 0.56 4.01 -1.26 -5.14 117.16 119.86 2vg4 n TYR 44 Ca -0.18 -2.65 -0.29 0.00 -0.16 0.00 0.00 57.90 54.62 2vg4 n TYR 44 Cb 0.53 -1.17 0.18 0.00 -0.31 0.00 0.00 39.34 38.56 2vg4 n TYR 44 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2vg4 s GLY 45 N -1.58 1.64 0.00 2.72 0.00 -0.27 -5.09 107.32 104.74 2vg4 s GLY 45 Ca 0.37 -0.85 0.00 0.00 0.00 0.00 0.00 44.72 44.25 2vg4 s GLY 45 CO -0.06 -0.13 0.00 0.61 0.00 0.00 0.00 173.10 173.52 2vg4 n GLY 46 N -2.28 0.73 3.74 0.20 0.00 -1.26 -5.03 105.19 101.29 2vg4 n GLY 46 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 2vg4 n GLY 46 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2vg4 s PRO 47 N 1.21 1.84 0.08 1.61 0.04 -1.26 -5.00 135.00 133.52 2vg4 s PRO 47 Ca 0.00 1.11 -0.26 0.00 0.04 0.00 0.00 61.00 61.89 2vg4 s PRO 47 Cb 0.00 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 32.63 2vg4 s PRO 47 CO 0.00 -1.92 0.81 0.00 0.04 0.00 0.00 177.00 175.93 2vg4 s ARG 49 N -0.25 3.69 0.17 0.00 3.52 -1.26 -4.46 118.95 120.36 2vg4 s ARG 49 Ca 0.40 2.29 -0.31 0.00 -0.13 0.00 0.00 55.73 57.97 2vg4 s ARG 49 Cb -0.22 -2.62 -0.10 0.00 -1.56 0.00 0.00 34.95 30.46 2vg4 s ARG 49 CO 0.25 -0.76 1.52 -1.25 -0.81 0.00 0.00 175.30 174.24 2vg4 s PRO 50 N -2.46 4.24 0.54 5.12 0.04 -1.26 -4.97 135.00 136.24 2vg4 s PRO 50 Ca 0.61 2.30 -0.20 0.00 0.04 0.00 0.00 61.00 63.75 2vg4 s PRO 50 Cb -0.41 -3.17 -0.08 0.00 0.04 0.00 0.00 34.50 30.89 2vg4 s PRO 50 CO 0.52 -0.55 0.83 -2.30 0.04 0.00 0.00 177.00 175.54 2vg4 n PRO 51 N 3.76 0.88 -1.93 0.56 -0.02 -1.26 -4.99 135.00 132.00 2vg4 n PRO 51 Ca 0.12 0.33 -0.30 0.00 -2.02 0.00 0.00 63.50 61.64 2vg4 n PRO 51 Cb 0.39 -1.97 0.05 0.00 -0.02 0.00 0.00 33.50 31.96 2vg4 n PRO 51 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 2vg4 s GLN 52 N -2.33 2.66 0.91 -0.52 0.74 -0.99 -4.81 119.66 115.33 2vg4 s GLN 52 Ca 0.70 0.34 -0.12 0.00 0.05 0.00 0.00 55.36 56.33 2vg4 s GLN 52 Cb -0.47 -2.03 0.14 0.00 1.10 0.00 0.00 33.01 31.76 2vg4 s GLN 52 CO 0.52 -1.14 1.12 -1.58 -0.55 0.00 0.00 175.29 173.66 2vg4 s HIS 53 N -3.38 2.45 0.49 1.67 5.65 -1.26 -1.39 115.29 119.52 2vg4 s HIS 53 Ca 0.59 0.96 0.27 0.00 0.25 0.00 0.00 55.06 57.13 2vg4 s HIS 53 Cb -0.11 -3.30 1.56 0.00 -1.18 0.00 0.00 32.58 29.55 2vg4 s HIS 53 CO 0.51 -2.40 2.14 1.15 -0.65 0.00 0.00 174.74 175.49 2vg4 h THR 54 N -1.53 0.61 0.00 0.89 2.02 -1.83 -0.36 112.91 112.70 2vg4 h THR 54 Ca -0.51 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.36 2vg4 h THR 54 Cb 1.32 1.19 0.00 0.00 -1.74 0.00 0.00 68.15 68.92 2vg4 h THR 54 CO 0.60 0.07 -0.38 -1.54 0.37 0.00 0.00 175.52 174.65 2vg4 n SER 55 N -3.81 0.38 -3.24 4.18 3.41 -1.26 -4.93 113.62 108.36 2vg4 n SER 55 Ca -0.02 -0.06 -0.23 0.00 -0.26 0.00 0.00 58.87 58.29 2vg4 n SER 55 Cb 0.17 0.06 0.04 0.00 -0.26 0.00 0.00 64.21 64.22 2vg4 n SER 55 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2vg4 n LYS 56 N -1.51 -5.48 -1.82 4.33 5.02 -0.15 -4.95 118.16 113.61 2vg4 n LYS 56 Ca 0.06 0.83 -0.29 0.00 -2.02 0.00 0.00 58.31 56.89 2vg4 n LYS 56 Cb 0.34 -5.73 0.09 0.00 -0.02 0.00 0.00 35.03 29.71 2vg4 n LYS 56 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2vg4 s ALA 57 N -3.19 2.49 0.05 7.82 0.00 -1.26 -4.95 121.76 122.72 2vg4 s ALA 57 Ca 0.40 -0.59 -0.06 0.00 0.00 0.00 0.00 51.96 51.71 2vg4 s ALA 57 Cb -0.18 -2.98 -0.05 0.00 0.00 0.00 0.00 23.12 19.90 2vg4 s ALA 57 CO 0.49 -1.75 0.30 0.00 0.00 0.00 0.00 175.76 174.80 2vg4 s ALA 58 N -3.49 3.84 0.17 0.00 0.00 -1.26 -4.80 121.76 116.21 2vg4 s ALA 58 Ca 0.62 -0.57 -0.19 0.00 0.00 0.00 0.00 51.96 51.82 2vg4 s ALA 58 Cb -0.12 -2.08 -0.08 0.00 0.00 0.00 0.00 23.12 20.84 2vg4 s ALA 58 CO 0.50 0.66 0.66 0.00 0.00 0.00 0.00 175.76 177.58 2vg4 s ALA 59 N -1.40 3.49 0.30 0.00 0.00 -1.26 -5.04 121.76 117.84 2vg4 s ALA 59 Ca 0.32 0.08 -0.29 0.00 0.00 0.00 0.00 51.96 52.07 2vg4 s ALA 59 Cb -0.13 -2.72 -0.10 0.00 0.00 0.00 0.00 23.12 20.16 2vg4 s ALA 59 CO 0.19 0.37 1.39 -2.14 0.00 0.00 0.00 175.76 175.57 2vg4 s PRO 60 N -1.75 4.29 -0.51 0.00 0.02 -1.26 -4.90 135.00 130.88 2vg4 s PRO 60 Ca 0.39 2.29 -0.02 0.00 0.02 0.00 0.00 61.00 63.68 2vg4 s PRO 60 Cb -0.17 -3.08 0.34 0.00 0.02 0.00 0.00 34.50 31.61 2vg4 s PRO 60 CO 0.21 -0.33 2.04 0.54 -0.33 0.00 0.00 177.00 179.12 2vg4 n ARG 61 N 1.47 2.29 -1.40 5.54 1.74 -1.26 -4.93 116.66 120.12 2vg4 n ARG 61 Ca 0.03 -2.52 -0.43 0.00 -0.77 0.00 0.00 57.85 54.17 2vg4 n ARG 61 Cb 0.41 -1.99 -0.00 0.00 -1.02 0.00 0.00 32.46 29.86 2vg4 n ARG 61 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2vg4 n ILE 62 N -0.34 1.41 -1.37 0.55 5.41 -1.26 -4.93 119.36 118.82 2vg4 n ILE 62 Ca 0.48 -0.50 -0.35 0.00 1.00 0.00 0.00 62.75 63.38 2vg4 n ILE 62 Cb 0.62 -0.29 0.10 0.00 -0.71 0.00 0.00 39.64 39.36 2vg4 n ILE 62 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 2vg4 s PRO 63 N -1.29 2.01 0.47 0.38 0.02 -1.26 -4.60 135.00 130.73 2vg4 s PRO 63 Ca 0.62 1.86 0.32 0.00 0.02 0.00 0.00 61.00 63.82 2vg4 s PRO 63 Cb -0.66 -1.81 1.43 0.00 0.02 0.00 0.00 34.50 33.48 2vg4 s PRO 63 CO 0.60 -1.96 1.95 0.00 -0.33 0.00 0.00 177.00 177.26 2vg4 h ALA 64 N -0.33 1.00 -0.02 -1.55 0.00 -1.91 -2.78 119.26 113.67 2vg4 h ALA 64 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2vg4 h ALA 64 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2vg4 h ALA 64 CO 0.49 0.00 -0.02 -0.40 0.00 0.00 0.00 179.25 179.32 2vg4 n ASP 65 N -2.78 1.64 -0.56 0.00 5.68 -1.26 -3.50 116.55 115.77 2vg4 n ASP 65 Ca 0.00 -1.52 0.06 0.00 -0.50 0.00 0.00 54.79 52.82 2vg4 n ASP 65 Cb 0.22 0.01 0.10 0.00 -1.14 0.00 0.00 41.12 40.31 2vg4 n ASP 65 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2vg4 n ARG 66 N 0.26 0.82 -3.51 0.11 5.12 -1.05 -5.06 116.66 113.34 2vg4 n ARG 66 Ca 0.18 -2.27 -0.37 0.00 -1.93 0.00 0.00 57.85 53.46 2vg4 n ARG 66 Cb 0.38 -1.02 -0.06 0.00 -1.16 0.00 0.00 32.46 30.61 2vg4 n ARG 66 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2vg4 s LEU 67 N -1.75 4.42 -0.94 0.55 2.96 -1.20 -4.36 118.68 118.35 2vg4 s LEU 67 Ca 0.26 0.91 -0.20 0.00 -0.22 0.00 0.00 54.13 54.89 2vg4 s LEU 67 Cb 0.25 -2.78 0.11 0.00 0.50 0.00 0.00 46.19 44.27 2vg4 s LEU 67 CO -0.04 0.25 1.21 -2.84 -1.32 0.00 0.00 176.35 173.61 2vg4 s PRO 68 N -1.45 3.58 0.58 0.98 0.02 -1.26 -4.87 135.00 132.59 2vg4 s PRO 68 Ca 0.28 -1.55 0.29 0.00 0.02 0.00 0.00 61.00 60.04 2vg4 s PRO 68 Cb -0.16 -5.01 1.46 0.00 0.02 0.00 0.00 34.50 30.82 2vg4 s PRO 68 CO 0.15 -1.89 1.87 -0.97 -0.33 0.00 0.00 177.00 175.84 2vg4 h ASN 69 N 9.12 0.00 -3.34 2.53 -1.24 -1.94 -3.34 115.58 117.38 2vg4 h ASN 69 Ca 0.15 0.00 -0.53 0.00 0.71 0.00 0.00 56.30 56.63 2vg4 h ASN 69 Cb 1.02 0.00 -0.39 0.00 0.73 0.00 0.00 38.32 39.68 2vg4 h ASN 69 CO 1.20 0.00 -0.77 -2.28 -1.29 0.00 0.00 177.43 174.28 2vg4 s HIS 70 N -4.67 1.34 -0.18 0.67 2.46 -1.26 -2.15 115.29 111.51 2vg4 s HIS 70 Ca -0.04 -0.99 -0.01 0.00 0.47 0.00 0.00 55.06 54.49 2vg4 s HIS 70 Cb 0.16 -1.15 -0.00 0.00 -0.13 0.00 0.00 32.58 31.46 2vg4 s HIS 70 CO 0.58 -0.61 -0.12 0.08 -2.47 0.00 0.00 174.74 172.20 2vg4 s VAL 71 N 1.75 2.86 0.06 0.89 1.01 0.62 -0.50 120.40 127.08 2vg4 s VAL 71 Ca -0.01 -0.69 0.05 0.00 0.00 0.00 0.00 61.98 61.33 2vg4 s VAL 71 Cb -0.17 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 2vg4 s VAL 71 CO -0.07 0.49 -0.05 0.00 0.00 0.00 0.00 175.10 175.46 2vg4 s ALA 72 N 1.06 3.10 -0.02 5.51 0.00 -0.06 -0.99 121.76 130.36 2vg4 s ALA 72 Ca -0.00 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.85 2vg4 s ALA 72 Cb -0.15 -1.10 0.03 0.00 0.00 0.00 0.00 23.12 21.90 2vg4 s ALA 72 CO -0.03 0.65 0.02 0.42 0.00 0.00 0.00 175.76 176.82 2vg4 s ILE 73 N -1.16 0.04 -0.80 0.00 1.01 -0.74 -0.98 121.20 118.57 2vg4 s ILE 73 Ca 0.21 0.15 -0.10 0.00 0.00 0.00 0.00 60.65 60.91 2vg4 s ILE 73 Cb -0.11 -0.15 0.21 0.00 0.01 0.00 0.00 42.46 42.42 2vg4 s ILE 73 CO 0.13 0.10 0.70 -0.69 0.00 0.00 0.00 174.94 175.18 2vg4 s VAL 74 N 0.95 5.05 -0.65 2.92 1.01 -0.17 -1.51 120.40 128.00 2vg4 s VAL 74 Ca -0.09 -2.77 -0.26 0.00 0.00 0.00 0.00 61.98 58.87 2vg4 s VAL 74 Cb -0.12 -4.14 -0.06 0.00 0.00 0.00 0.00 36.38 32.06 2vg4 s VAL 74 CO -0.02 -1.00 2.13 -0.04 0.00 0.00 0.00 175.10 176.16 2vg4 s MET 75 N -0.10 2.30 0.22 2.72 1.00 -1.26 -3.64 119.30 120.53 2vg4 s MET 75 Ca 0.19 0.70 0.08 0.00 0.00 0.00 0.00 55.69 56.66 2vg4 s MET 75 Cb -0.13 -4.62 -0.04 0.00 0.00 0.00 0.00 34.83 30.04 2vg4 s MET 75 CO -0.07 -3.26 0.07 0.34 0.00 0.00 0.00 175.02 172.10 2vg4 s ASP 76 N 9.80 5.01 0.00 3.03 -1.08 -1.26 -4.68 116.67 127.49 2vg4 s ASP 76 Ca 0.81 -0.40 0.00 0.00 -0.52 0.00 0.00 52.55 52.44 2vg4 s ASP 76 Cb -0.13 -1.13 0.00 0.00 -1.46 0.00 0.00 42.92 40.20 2vg4 s ASP 76 CO 0.17 0.02 0.00 0.61 0.52 0.00 0.00 175.17 176.49 2vg4 n GLY 77 N -0.69 0.72 0.27 2.66 0.00 -1.26 -2.20 105.19 104.68 2vg4 n GLY 77 Ca -0.08 -0.09 0.04 0.00 0.00 0.00 0.00 46.02 45.89 2vg4 n GLY 77 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2vg4 h ASN 78 N 0.00 0.26 -0.00 1.61 4.21 -1.91 -2.96 115.58 116.78 2vg4 h ASN 78 Ca 0.00 -0.02 0.00 0.00 1.21 0.00 0.00 56.30 57.49 2vg4 h ASN 78 Cb 0.00 -0.07 0.00 0.00 -1.12 0.00 0.00 38.32 37.13 2vg4 h ASN 78 CO 0.00 0.27 -0.92 0.61 -1.29 0.00 0.00 177.43 176.10 2vg4 n GLY 79 N -1.26 -0.83 0.12 2.83 0.00 -1.26 -3.98 105.19 100.80 2vg4 n GLY 79 Ca 0.00 -0.61 -0.11 0.00 0.00 0.00 0.00 46.02 45.30 2vg4 n GLY 79 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2vg4 h ARG 80 N 0.39 -0.16 -0.61 1.61 2.43 -1.92 -2.28 114.38 113.84 2vg4 h ARG 80 Ca 0.00 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.27 2vg4 h ARG 80 Cb 0.54 0.04 -0.09 0.00 -0.42 0.00 0.00 29.97 30.04 2vg4 h ARG 80 CO 0.00 0.31 -0.27 1.87 -1.51 0.00 0.00 179.97 180.37 2vg4 n TRP 81 N -4.88 -0.05 -0.07 2.20 -0.00 -1.19 -1.06 117.44 112.38 2vg4 n TRP 81 Ca -0.08 0.75 -0.12 0.00 -0.00 0.00 0.00 57.50 58.05 2vg4 n TRP 81 Cb 0.27 -0.68 -0.05 0.00 -0.00 0.00 0.00 31.31 30.85 2vg4 n TRP 81 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2vg4 h ALA 82 N 0.70 0.28 -0.92 5.87 0.00 -1.71 -2.96 119.26 120.53 2vg4 h ALA 82 Ca 0.18 -0.27 0.20 0.00 0.00 0.00 0.00 54.91 55.02 2vg4 h ALA 82 Cb 0.33 -0.07 -0.11 0.00 0.00 0.00 0.00 17.79 17.94 2vg4 h ALA 82 CO -0.60 0.09 0.48 1.15 0.00 0.00 0.00 179.25 180.38 2vg4 h THR 83 N 0.12 0.60 -0.80 0.00 2.02 -0.48 -1.27 112.91 113.10 2vg4 h THR 83 Ca 0.05 -0.19 0.05 0.00 0.77 0.00 0.00 66.41 67.09 2vg4 h THR 83 Cb 0.54 -0.01 -0.05 0.00 -1.74 0.00 0.00 68.15 66.88 2vg4 h THR 83 CO 0.02 0.10 0.53 1.56 0.37 0.00 0.00 175.52 178.10 2vg4 h GLN 84 N 0.56 0.89 -0.77 6.66 4.20 -0.92 -2.68 115.11 123.05 2vg4 h GLN 84 Ca 0.55 -0.05 -0.43 0.00 0.06 0.00 0.00 58.65 58.78 2vg4 h GLN 84 Cb 0.95 -0.20 -0.25 0.00 0.30 0.00 0.00 27.48 28.28 2vg4 h GLN 84 CO -0.45 0.59 0.36 0.54 -0.67 0.00 0.00 178.83 179.20 2vg4 n ARG 85 N -4.47 2.25 -3.61 1.46 1.74 -0.67 -4.92 116.66 108.44 2vg4 n ARG 85 Ca 0.11 -3.18 -0.25 0.00 -0.77 0.00 0.00 57.85 53.76 2vg4 n ARG 85 Cb 0.18 -2.08 0.06 0.00 -1.02 0.00 0.00 32.46 29.60 2vg4 n ARG 85 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2vg4 n GLY 86 N -1.08 -0.53 3.57 -0.13 0.00 -1.01 -4.99 105.19 101.01 2vg4 n GLY 86 Ca 0.51 0.22 -0.24 0.00 0.00 0.00 0.00 46.02 46.51 2vg4 n GLY 86 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vg4 s LEU 87 N -7.22 2.94 0.69 0.99 1.43 -0.57 -5.03 118.68 111.91 2vg4 s LEU 87 Ca 0.57 -0.73 -0.11 0.00 -1.03 0.00 0.00 54.13 52.83 2vg4 s LEU 87 Cb -0.26 -1.52 0.00 0.00 0.03 0.00 0.00 46.19 44.44 2vg4 s LEU 87 CO 0.71 0.04 1.06 0.00 0.23 0.00 0.00 176.35 178.39 2vg4 s ALA 88 N -2.17 2.77 0.45 4.21 0.00 -1.26 -3.79 121.76 121.97 2vg4 s ALA 88 Ca 0.29 -0.05 0.15 0.00 0.00 0.00 0.00 51.96 52.35 2vg4 s ALA 88 Cb -0.07 -3.12 1.04 0.00 0.00 0.00 0.00 23.12 20.97 2vg4 s ALA 88 CO 0.17 -1.13 2.01 0.00 0.00 0.00 0.00 175.76 176.81 2vg4 h ARG 89 N -0.65 0.00 -0.73 0.00 3.08 -1.93 -2.94 114.38 111.21 2vg4 h ARG 89 Ca -0.44 0.00 0.13 0.00 0.07 0.00 0.00 59.98 59.74 2vg4 h ARG 89 Cb 1.22 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.17 2vg4 h ARG 89 CO 0.59 0.16 0.28 1.79 -1.07 0.00 0.00 179.97 181.72 2vg4 h THR 90 N 0.00 0.67 0.00 2.04 1.35 -1.96 -1.85 112.91 113.16 2vg4 h THR 90 Ca -0.00 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 2vg4 h THR 90 Cb 0.29 0.20 0.00 0.00 -1.73 0.00 0.00 68.15 66.91 2vg4 h THR 90 CO 0.02 0.08 0.00 -0.33 -0.25 0.00 0.00 175.52 175.04 2vg4 h GLU 91 N 0.43 0.00 -0.03 4.72 4.39 -1.91 -2.66 114.58 119.52 2vg4 h GLU 91 Ca 0.39 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.97 2vg4 h GLU 91 Cb 0.58 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.24 2vg4 h GLU 91 CO -0.39 0.00 -0.45 0.78 -1.16 0.00 0.00 179.01 177.79 2vg4 h GLY 92 N 2.05 0.39 2.00 -3.84 0.00 -1.49 -3.22 103.07 98.96 2vg4 h GLY 92 Ca 0.00 -0.63 -0.04 0.00 0.00 0.00 0.00 47.33 46.66 2vg4 h GLY 92 CO 0.00 0.56 -0.19 0.45 0.00 0.00 0.00 176.54 177.36 2vg4 h HIS 93 N -0.18 0.00 -0.50 5.60 3.86 -1.47 -2.84 115.15 119.61 2vg4 h HIS 93 Ca -0.05 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.08 2vg4 h HIS 93 Cb 1.15 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.60 2vg4 h HIS 93 CO 0.15 0.19 -0.00 0.87 0.86 0.00 0.00 177.93 180.00 2vg4 h LYS 94 N 0.00 0.89 0.00 2.45 1.57 -1.54 -2.77 116.57 117.17 2vg4 h LYS 94 Ca -0.00 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 2vg4 h LYS 94 Cb 0.37 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2vg4 h LYS 94 CO 0.03 0.92 0.00 -1.33 -0.57 0.00 0.00 179.45 178.50 2vg4 n MET 95 N -4.31 0.16 0.00 3.15 2.81 -1.09 -2.76 117.12 115.08 2vg4 n MET 95 Ca 0.01 0.17 0.13 0.00 -1.81 0.00 0.00 57.70 56.20 2vg4 n MET 95 Cb 0.32 -1.70 0.46 0.00 -0.71 0.00 0.00 33.22 31.58 2vg4 n MET 95 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2vg4 n GLY 96 N 1.17 -0.91 0.10 3.03 0.00 -1.05 -3.98 105.19 103.55 2vg4 n GLY 96 Ca 0.06 -0.32 -0.13 0.00 0.00 0.00 0.00 46.02 45.63 2vg4 n GLY 96 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2vg4 h GLU 97 N 0.67 -0.12 0.00 1.61 4.81 -1.47 -2.79 114.58 117.29 2vg4 h GLU 97 Ca 0.00 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2vg4 h GLU 97 Cb 0.45 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.86 2vg4 h GLU 97 CO 0.00 0.34 0.00 0.00 -0.73 0.00 0.00 179.01 178.62 2vg4 h ALA 98 N 0.18 1.00 -0.23 2.92 0.00 -1.76 -1.72 119.26 119.65 2vg4 h ALA 98 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 2vg4 h ALA 98 Cb 0.51 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 2vg4 h ALA 98 CO 0.02 0.00 -0.24 0.28 0.00 0.00 0.00 179.25 179.31 2vg4 h VAL 99 N 0.00 1.32 0.65 0.00 2.07 -1.64 -2.49 116.25 116.15 2vg4 h VAL 99 Ca 0.00 -1.41 -0.02 0.00 0.82 0.00 0.00 66.70 66.09 2vg4 h VAL 99 Cb 0.23 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 2vg4 h VAL 99 CO 0.00 0.44 -0.46 0.58 0.02 0.00 0.00 177.57 178.15 2vg4 h VAL 100 N 0.26 0.09 -1.00 2.57 2.07 -1.05 0.12 116.25 119.32 2vg4 h VAL 100 Ca 0.03 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.68 2vg4 h VAL 100 Cb 0.80 0.09 -0.09 0.00 -1.52 0.00 0.00 31.29 30.57 2vg4 h VAL 100 CO 0.06 0.00 0.63 0.40 0.02 0.00 0.00 177.57 178.67 2vg4 h ILE 101 N -1.06 0.91 -0.23 4.57 1.08 -1.63 0.32 117.51 121.48 2vg4 h ILE 101 Ca -0.08 -0.34 -0.09 0.00 -0.39 0.00 0.00 64.86 63.96 2vg4 h ILE 101 Cb 0.87 -0.16 -0.01 0.00 -3.07 0.00 0.00 36.82 34.46 2vg4 h ILE 101 CO 0.05 0.18 -0.25 -0.78 -0.69 0.00 0.00 178.15 176.66 2vg4 h ASP 102 N 0.98 0.43 1.45 1.72 3.58 -1.21 -1.69 116.42 121.68 2vg4 h ASP 102 Ca 0.50 -0.14 -0.07 0.00 0.42 0.00 0.00 57.03 57.74 2vg4 h ASP 102 Cb 0.49 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.42 2vg4 h ASP 102 CO -0.27 0.67 -0.32 0.40 -2.88 0.00 0.00 179.24 176.84 2vg4 h ILE 103 N 0.38 0.60 -0.01 2.25 5.03 0.17 -2.93 117.51 123.01 2vg4 h ILE 103 Ca 0.06 -1.67 -0.20 0.00 -0.12 0.00 0.00 64.86 62.93 2vg4 h ILE 103 Cb 0.64 2.16 -0.01 0.00 -3.03 0.00 0.00 36.82 36.58 2vg4 h ILE 103 CO 0.05 0.32 -0.86 0.00 -0.68 0.00 0.00 178.15 176.97 2vg4 h ALA 104 N 1.68 0.52 -0.03 1.87 0.00 -0.00 -2.94 119.26 120.35 2vg4 h ALA 104 Ca -0.00 -0.70 -0.15 0.00 0.00 0.00 0.00 54.91 54.06 2vg4 h ALA 104 Cb 1.14 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2vg4 h ALA 104 CO 0.04 0.88 -0.65 0.00 0.00 0.00 0.00 179.25 179.53 2vg4 h GLY 106 N 1.70 0.12 1.48 0.00 0.00 -1.55 -2.39 103.07 102.44 2vg4 h GLY 106 Ca -0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 2vg4 h GLY 106 CO 0.09 0.24 0.20 0.00 0.00 0.00 0.00 176.54 177.07 2vg4 h ALA 107 N 0.93 1.46 -0.01 3.60 0.00 -1.47 0.38 119.26 124.16 2vg4 h ALA 107 Ca -0.04 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.57 2vg4 h ALA 107 Cb 1.69 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 19.30 2vg4 h ALA 107 CO 0.14 0.42 -0.67 0.82 0.00 0.00 0.00 179.25 179.96 2vg4 h ILE 108 N 0.67 1.40 -0.36 0.00 2.04 -1.52 0.44 117.51 120.18 2vg4 h ILE 108 Ca 0.17 -2.09 0.08 0.00 1.00 0.00 0.00 64.86 64.01 2vg4 h ILE 108 Cb 0.12 2.54 -0.02 0.00 -0.74 0.00 0.00 36.82 38.72 2vg4 h ILE 108 CO -0.02 0.62 0.25 -0.33 0.00 0.00 0.00 178.15 178.67 2vg4 h GLU 109 N -0.01 0.11 0.00 2.37 5.08 -1.11 -1.57 114.58 119.45 2vg4 h GLU 109 Ca -0.08 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2vg4 h GLU 109 Cb 1.37 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.59 2vg4 h GLU 109 CO 0.13 0.07 -0.80 -0.11 -1.00 0.00 0.00 179.01 177.31 2vg4 n LEU 110 N -4.46 0.67 0.00 1.33 7.94 0.10 -1.98 117.00 120.60 2vg4 n LEU 110 Ca 0.05 -0.14 0.00 0.00 -1.11 0.00 0.00 56.01 54.81 2vg4 n LEU 110 Cb 0.35 -0.14 0.00 0.00 0.53 0.00 0.00 43.42 44.16 2vg4 n LEU 110 CO 0.35 0.13 0.00 0.61 -1.11 0.00 0.00 177.39 177.37 2vg4 n GLY 111 N 1.46 0.71 3.78 -3.96 0.00 -0.28 -4.31 105.19 102.59 2vg4 n GLY 111 Ca 0.04 -0.19 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 2vg4 n GLY 111 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2vg4 s ILE 112 N -2.00 3.40 0.00 -0.61 1.01 0.14 -4.93 121.20 118.21 2vg4 s ILE 112 Ca 0.00 0.95 0.00 0.00 0.00 0.00 0.00 60.65 61.60 2vg4 s ILE 112 Cb 0.00 -3.43 0.00 0.00 0.01 0.00 0.00 42.46 39.04 2vg4 s ILE 112 CO 0.00 -0.11 0.05 1.17 0.00 0.00 0.00 174.94 176.05 2vg4 n LYS 113 N -0.79 2.64 -3.68 2.79 3.00 -1.23 -4.38 118.16 116.52 2vg4 n LYS 113 Ca 0.09 -0.05 -0.28 0.00 -0.00 0.00 0.00 58.31 58.07 2vg4 n LYS 113 Cb 0.50 -0.35 -0.16 0.00 0.00 0.00 0.00 35.03 35.02 2vg4 n LYS 113 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 2vg4 s TRP 114 N -0.39 0.84 -0.21 5.64 0.52 -0.91 -0.24 118.94 124.18 2vg4 s TRP 114 Ca 0.00 -0.88 0.01 0.00 0.02 0.00 0.00 56.10 55.25 2vg4 s TRP 114 Cb 0.00 -1.04 0.03 0.00 -1.15 0.00 0.00 33.47 31.31 2vg4 s TRP 114 CO 0.00 -0.67 -0.15 -1.17 0.02 0.00 0.00 176.95 174.98 2vg4 s LEU 115 N 1.92 2.67 0.29 2.99 2.96 -0.74 -0.28 118.68 128.49 2vg4 s LEU 115 Ca 0.03 -0.91 -0.01 0.00 -0.22 0.00 0.00 54.13 53.02 2vg4 s LEU 115 Cb -0.17 -1.53 -0.04 0.00 0.50 0.00 0.00 46.19 44.96 2vg4 s LEU 115 CO -0.16 -0.07 0.50 -0.44 -1.32 0.00 0.00 176.35 174.86 2vg4 s SER 116 N 1.24 6.35 -0.19 3.68 0.01 -0.16 -1.30 113.70 123.32 2vg4 s SER 116 Ca 0.00 0.47 -0.07 0.00 1.31 0.00 0.00 55.95 57.66 2vg4 s SER 116 Cb -0.16 -2.04 0.09 0.00 0.21 0.00 0.00 66.02 64.12 2vg4 s SER 116 CO -0.09 -0.20 0.40 -0.76 0.41 0.00 0.00 173.24 173.00 2vg4 s LEU 117 N -3.88 -0.61 -1.28 2.44 1.02 -1.15 -1.79 118.68 113.44 2vg4 s LEU 117 Ca 0.40 0.95 -0.13 0.00 0.02 0.00 0.00 54.13 55.37 2vg4 s LEU 117 Cb -0.10 1.29 0.14 0.00 0.02 0.00 0.00 46.19 47.54 2vg4 s LEU 117 CO 0.33 -0.23 1.73 0.00 0.02 0.00 0.00 176.35 178.19 2vg4 n TYR 118 N 5.39 4.02 -0.01 0.29 -0.00 -0.57 -1.88 117.16 124.39 2vg4 n TYR 118 Ca -0.08 -3.04 -0.13 0.00 -0.00 0.00 0.00 57.90 54.65 2vg4 n TYR 118 Cb 0.49 -2.21 -0.09 0.00 -0.00 0.00 0.00 39.34 37.54 2vg4 n TYR 118 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2vg4 h ALA 119 N 6.55 0.03 -2.34 2.98 0.00 -1.73 -3.40 119.26 121.35 2vg4 h ALA 119 Ca 0.39 -0.21 -0.19 0.00 0.00 0.00 0.00 54.91 54.90 2vg4 h ALA 119 Cb 0.76 -0.01 -0.15 0.00 0.00 0.00 0.00 17.79 18.39 2vg4 h ALA 119 CO 1.49 -0.26 -0.66 0.12 0.00 0.00 0.00 179.25 179.94 2vg4 s PHE 120 N -4.59 0.85 0.03 0.00 5.36 -0.65 -5.00 117.98 113.97 2vg4 s PHE 120 Ca -0.15 -1.14 -0.01 0.00 -0.96 0.00 0.00 56.93 54.67 2vg4 s PHE 120 Cb 0.03 -0.50 -0.02 0.00 -0.34 0.00 0.00 43.02 42.18 2vg4 s PHE 120 CO 0.68 -0.41 -0.00 0.45 -1.46 0.00 0.00 175.22 174.48 2vg4 s SER 121 N -3.04 0.26 0.44 6.13 0.15 -1.26 -3.29 113.70 113.10 2vg4 s SER 121 Ca 0.19 -0.57 0.10 0.00 0.70 0.00 0.00 55.95 56.37 2vg4 s SER 121 Cb 0.07 0.14 0.99 0.00 -1.71 0.00 0.00 66.02 65.51 2vg4 s SER 121 CO -0.01 -0.39 2.08 0.71 1.20 0.00 0.00 173.24 176.84 2vg4 h THR 122 N 4.23 1.07 -0.26 6.45 1.35 -1.66 0.12 112.91 124.20 2vg4 h THR 122 Ca -0.32 -0.13 -0.01 0.00 -0.55 0.00 0.00 66.41 65.40 2vg4 h THR 122 Cb 1.19 0.64 -0.01 0.00 -1.73 0.00 0.00 68.15 68.24 2vg4 h THR 122 CO 0.47 0.07 0.14 -0.33 -0.25 0.00 0.00 175.52 175.62 2vg4 h GLU 123 N 0.39 0.35 0.00 4.72 3.07 -1.95 -3.10 114.58 118.06 2vg4 h GLU 123 Ca 0.11 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.94 2vg4 h GLU 123 Cb -0.02 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 27.82 2vg4 h GLU 123 CO -0.02 0.26 0.00 0.09 -1.40 0.00 0.00 179.01 177.94 2vg4 n ASN 124 N -4.46 0.00 0.00 1.42 4.13 0.41 -2.38 115.26 114.38 2vg4 n ASN 124 Ca 0.01 -0.68 0.12 0.00 1.68 0.00 0.00 54.58 55.71 2vg4 n ASN 124 Cb 0.10 0.00 0.21 0.00 -1.54 0.00 0.00 39.78 38.54 2vg4 n ASN 124 CO 0.00 0.00 0.00 0.79 0.28 0.00 0.00 177.26 178.33 2vg4 n TRP 125 N -0.51 0.00 0.89 3.10 7.02 -1.17 -3.87 117.44 122.90 2vg4 n TRP 125 Ca 0.00 0.00 0.08 0.00 -1.02 0.00 0.00 57.50 56.57 2vg4 n TRP 125 Cb 0.00 -0.22 0.25 0.00 -2.42 0.00 0.00 31.31 28.92 2vg4 n TRP 125 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 2vg4 n LYS 126 N -1.50 1.88 -2.64 -0.99 5.02 -1.00 -4.87 118.16 114.06 2vg4 n LYS 126 Ca 0.05 -1.35 -0.26 0.00 -2.02 0.00 0.00 58.31 54.73 2vg4 n LYS 126 Cb 0.33 -1.35 0.02 0.00 -0.02 0.00 0.00 35.03 34.01 2vg4 n LYS 126 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2vg4 s ARG 127 N -1.59 3.13 0.24 1.97 0.52 -1.25 -4.99 118.95 116.97 2vg4 s ARG 127 Ca 0.29 -0.09 -0.30 0.00 -0.52 0.00 0.00 55.73 55.11 2vg4 s ARG 127 Cb 0.16 -2.38 -0.15 0.00 0.52 0.00 0.00 34.95 33.10 2vg4 s ARG 127 CO 0.22 -0.44 1.12 -1.13 0.02 0.00 0.00 175.30 175.09 2vg4 n SER 128 N -2.35 1.52 -0.11 0.23 3.41 -1.26 -4.67 113.62 110.40 2vg4 n SER 128 Ca 0.02 1.16 0.26 0.00 -0.26 0.00 0.00 58.87 60.06 2vg4 n SER 128 Cb 0.57 -1.28 0.72 0.00 -0.26 0.00 0.00 64.21 63.96 2vg4 n SER 128 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2vg4 h PRO 129 N 2.82 0.00 0.46 4.33 0.11 -1.94 0.18 132.00 137.97 2vg4 h PRO 129 Ca -0.42 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.67 2vg4 h PRO 129 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.45 2vg4 h PRO 129 CO 0.66 0.00 -0.22 0.93 -0.21 0.00 0.00 178.00 179.16 2vg4 h GLU 130 N 0.00 -0.60 -0.18 1.05 3.07 -1.98 -1.40 114.58 114.54 2vg4 h GLU 130 Ca 0.36 0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 59.24 2vg4 h GLU 130 Cb 1.56 0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 29.59 2vg4 h GLU 130 CO -0.00 -0.29 -0.01 1.49 -1.40 0.00 0.00 179.01 178.79 2vg4 h GLU 131 N -0.97 0.26 0.24 2.33 4.81 -1.54 -2.58 114.58 117.13 2vg4 h GLU 131 Ca -0.06 -0.04 -0.33 0.00 -0.13 0.00 0.00 59.36 58.80 2vg4 h GLU 131 Cb 0.58 -0.05 0.03 0.00 0.63 0.00 0.00 28.75 29.95 2vg4 h GLU 131 CO 0.10 0.30 -1.47 0.28 -0.73 0.00 0.00 179.01 177.50 2vg4 h VAL 132 N 0.26 1.25 0.00 0.32 2.07 -1.08 -1.97 116.25 117.10 2vg4 h VAL 132 Ca 0.06 -2.66 0.00 0.00 0.82 0.00 0.00 66.70 64.93 2vg4 h VAL 132 Cb 0.20 3.02 0.00 0.00 -1.52 0.00 0.00 31.29 32.99 2vg4 h VAL 132 CO 0.01 0.81 0.00 -1.14 0.02 0.00 0.00 177.57 177.26 2vg4 n ARG 133 N -3.74 0.08 -0.08 1.57 0.63 -0.53 -2.05 116.66 112.55 2vg4 n ARG 133 Ca -0.18 0.47 -0.19 0.00 -0.92 0.00 0.00 57.85 57.03 2vg4 n ARG 133 Cb 1.08 -1.72 -0.13 0.00 0.45 0.00 0.00 32.46 32.14 2vg4 n ARG 133 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 2vg4 n PHE 134 N -1.89 0.49 0.31 -0.14 7.35 -0.99 -4.11 117.46 118.48 2vg4 n PHE 134 Ca 0.01 0.11 0.17 0.00 -0.76 0.00 0.00 57.45 56.97 2vg4 n PHE 134 Cb 0.10 -1.07 0.73 0.00 0.35 0.00 0.00 39.48 39.59 2vg4 n PHE 134 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2vg4 h LEU 135 N 0.03 0.00 0.07 -2.13 3.38 -0.76 -1.57 115.31 114.33 2vg4 h LEU 135 Ca -0.51 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.18 2vg4 h LEU 135 Cb 1.97 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.70 2vg4 h LEU 135 CO -0.01 0.00 -1.36 0.24 0.09 0.00 0.00 178.44 177.40 2vg4 h MET 136 N 0.00 0.15 0.00 1.13 2.86 -1.66 -3.28 114.93 114.13 2vg4 h MET 136 Ca 0.00 -0.26 -0.16 0.00 -2.06 0.00 0.00 59.70 57.22 2vg4 h MET 136 Cb 0.35 0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.09 2vg4 h MET 136 CO 0.00 1.02 -0.89 0.78 1.06 0.00 0.00 176.91 178.88 2vg4 h GLY 137 N 2.27 0.00 1.04 8.32 0.00 -1.55 -3.24 103.07 109.90 2vg4 h GLY 137 Ca -0.17 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 46.96 2vg4 h GLY 137 CO 0.15 0.00 -0.75 -2.75 0.00 0.00 0.00 176.54 173.19 2vg4 h PHE 138 N 0.00 0.89 0.10 5.60 3.57 -1.45 -2.66 116.94 123.00 2vg4 h PHE 138 Ca -0.05 -0.44 -0.00 0.00 3.53 0.00 0.00 57.97 61.01 2vg4 h PHE 138 Cb 1.58 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 40.20 2vg4 h PHE 138 CO 0.00 1.26 -0.05 -0.91 -2.23 0.00 0.00 178.31 176.38 2vg4 h ASN 139 N 0.27 -0.11 -0.74 0.41 2.35 -1.69 -1.08 115.58 115.00 2vg4 h ASN 139 Ca -0.07 -0.08 0.16 0.00 -0.55 0.00 0.00 56.30 55.76 2vg4 h ASN 139 Cb 1.41 0.03 -0.11 0.00 0.05 0.00 0.00 38.32 39.70 2vg4 h ASN 139 CO 0.15 0.00 0.18 -0.09 -1.65 0.00 0.00 177.43 176.03 2vg4 h ARG 140 N -0.23 0.27 -0.52 0.81 2.43 -1.62 -0.63 114.38 114.89 2vg4 h ARG 140 Ca -0.01 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 2vg4 h ARG 140 Cb 0.18 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 2vg4 h ARG 140 CO 0.02 0.18 0.23 -0.44 -1.51 0.00 0.00 179.97 178.45 2vg4 h ASP 141 N 0.27 0.69 -0.65 -3.80 5.19 -1.17 -2.41 116.42 114.55 2vg4 h ASP 141 Ca 0.41 -0.15 -0.06 0.00 -0.62 0.00 0.00 57.03 56.61 2vg4 h ASP 141 Cb 0.70 -0.18 -0.03 0.00 0.18 0.00 0.00 39.33 40.01 2vg4 h ASP 141 CO -0.51 0.65 0.15 0.58 -3.12 0.00 0.00 179.24 177.00 2vg4 h VAL 142 N 0.69 1.26 0.27 -1.35 2.07 0.17 -0.05 116.25 119.30 2vg4 h VAL 142 Ca 0.18 -0.95 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 2vg4 h VAL 142 Cb 0.15 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2vg4 h VAL 142 CO -0.02 0.36 -0.13 0.58 0.02 0.00 0.00 177.57 178.38 2vg4 h VAL 143 N 0.97 0.76 -0.28 2.57 2.07 -1.24 0.23 116.25 121.33 2vg4 h VAL 143 Ca 0.20 -0.15 0.08 0.00 0.82 0.00 0.00 66.70 67.66 2vg4 h VAL 143 Cb 0.37 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2vg4 h VAL 143 CO 0.00 0.03 0.24 -0.09 0.02 0.00 0.00 177.57 177.78 2vg4 h ARG 144 N -0.43 0.00 0.03 1.57 2.43 -0.96 -1.02 114.38 116.00 2vg4 h ARG 144 Ca -0.04 0.00 -0.39 0.00 -0.81 0.00 0.00 59.98 58.75 2vg4 h ARG 144 Cb 0.33 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.82 2vg4 h ARG 144 CO 0.06 0.00 -2.34 0.54 -1.51 0.00 0.00 179.97 176.72 2vg4 n ARG 145 N -4.08 0.66 0.01 0.20 1.74 -0.07 -4.62 116.66 110.51 2vg4 n ARG 145 Ca 0.04 0.20 0.11 0.00 -0.77 0.00 0.00 57.85 57.43 2vg4 n ARG 145 Cb 0.40 -1.57 0.04 0.00 -1.02 0.00 0.00 32.46 30.31 2vg4 n ARG 145 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2vg4 n ARG 146 N -3.46 0.11 0.28 5.56 5.12 0.78 -4.33 116.66 120.73 2vg4 n ARG 146 Ca -0.43 -0.01 0.18 0.00 -1.93 0.00 0.00 57.85 55.66 2vg4 n ARG 146 Cb 0.98 -1.53 0.75 0.00 -1.16 0.00 0.00 32.46 31.50 2vg4 n ARG 146 CO 0.00 0.00 0.00 0.07 -1.93 0.00 0.00 177.63 175.77 2vg4 h ARG 147 N 0.00 0.00 0.22 5.56 0.11 -1.33 -1.88 114.38 117.06 2vg4 h ARG 147 Ca 0.00 0.00 -0.32 0.00 0.10 0.00 0.00 59.98 59.76 2vg4 h ARG 147 Cb 0.59 0.00 0.03 0.00 1.11 0.00 0.00 29.97 31.70 2vg4 h ARG 147 CO 0.00 0.00 -1.43 -0.44 0.10 0.00 0.00 179.97 178.21 2vg4 h ASP 148 N 0.00 0.71 -0.03 0.08 3.32 -1.83 -1.03 116.42 117.65 2vg4 h ASP 148 Ca -0.00 -0.77 0.03 0.00 0.02 0.00 0.00 57.03 56.31 2vg4 h ASP 148 Cb 0.45 -0.23 -0.06 0.00 0.22 0.00 0.00 39.33 39.71 2vg4 h ASP 148 CO 0.00 1.61 -0.43 0.74 -1.72 0.00 0.00 179.24 179.44 2vg4 h THR 149 N 0.12 0.14 -0.65 0.35 2.02 -1.62 -2.63 112.91 110.64 2vg4 h THR 149 Ca -0.22 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 66.93 2vg4 h THR 149 Cb 2.11 0.14 -0.03 0.00 -1.74 0.00 0.00 68.15 68.63 2vg4 h THR 149 CO 0.25 0.00 0.30 -0.07 0.37 0.00 0.00 175.52 176.37 2vg4 h LEU 150 N -0.57 0.84 -0.68 2.58 3.38 -1.41 -1.49 115.31 117.96 2vg4 h LEU 150 Ca 0.05 -0.09 0.14 0.00 0.09 0.00 0.00 57.88 58.07 2vg4 h LEU 150 Cb 0.65 -0.21 -0.12 0.00 0.09 0.00 0.00 40.66 41.07 2vg4 h LEU 150 CO -0.34 0.72 -0.06 0.50 0.09 0.00 0.00 178.44 179.36 2vg4 h LYS 151 N 0.92 0.07 0.00 1.13 1.63 -0.85 -1.45 116.57 118.02 2vg4 h LYS 151 Ca 0.22 -0.00 -0.10 0.00 -0.85 0.00 0.00 60.65 59.92 2vg4 h LYS 151 Cb 0.12 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.72 2vg4 h LYS 151 CO -0.03 0.04 -0.47 0.87 -3.45 0.00 0.00 179.45 176.41 2vg4 h LYS 152 N 0.07 0.00 0.00 1.90 1.57 -0.94 -3.14 116.57 116.03 2vg4 h LYS 152 Ca 0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 2vg4 h LYS 152 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 2vg4 h LYS 152 CO -0.63 0.47 0.00 1.28 -0.57 0.00 0.00 179.45 180.01 2vg4 n LEU 153 N -3.41 0.11 0.00 2.94 4.77 -0.61 -1.15 117.00 119.64 2vg4 n LEU 153 Ca 0.01 0.51 0.00 0.00 -0.03 0.00 0.00 56.01 56.50 2vg4 n LEU 153 Cb 0.62 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2vg4 n LEU 153 CO 0.39 -0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 2vg4 n GLY 154 N 1.30 0.81 3.69 -0.72 0.00 -1.06 -4.73 105.19 104.48 2vg4 n GLY 154 Ca 0.06 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 2vg4 n GLY 154 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vg4 s VAL 155 N -2.00 4.08 -0.47 1.61 1.01 -0.79 -1.38 120.40 122.45 2vg4 s VAL 155 Ca 0.00 1.44 -0.17 0.00 0.00 0.00 0.00 61.98 63.25 2vg4 s VAL 155 Cb 0.00 -3.93 0.05 0.00 0.00 0.00 0.00 36.38 32.51 2vg4 s VAL 155 CO 0.00 0.02 0.48 -0.60 0.00 0.00 0.00 175.10 175.00 2vg4 s ARG 156 N 2.03 3.06 -0.13 2.72 3.52 -0.54 -4.55 118.95 125.07 2vg4 s ARG 156 Ca 0.58 -1.01 -0.00 0.00 -0.13 0.00 0.00 55.73 55.17 2vg4 s ARG 156 Cb -0.27 -4.07 -0.02 0.00 -1.56 0.00 0.00 34.95 29.03 2vg4 s ARG 156 CO 0.24 -1.03 -0.12 -1.50 -0.81 0.00 0.00 175.30 172.08 2vg4 s ILE 157 N 2.13 3.16 0.19 4.11 1.10 -1.26 -1.44 121.20 129.19 2vg4 s ILE 157 Ca 0.10 -0.63 -0.04 0.00 -0.51 0.00 0.00 60.65 59.58 2vg4 s ILE 157 Cb -0.20 -2.33 -0.03 0.00 0.15 0.00 0.00 42.46 40.05 2vg4 s ILE 157 CO 0.11 0.53 0.19 0.00 -2.11 0.00 0.00 174.94 173.65 2vg4 s ARG 158 N 0.27 1.20 0.09 3.50 3.03 -1.07 -3.34 118.95 122.62 2vg4 s ARG 158 Ca -0.09 -1.49 -0.18 0.00 2.03 0.00 0.00 55.73 56.01 2vg4 s ARG 158 Cb -0.15 0.31 -0.07 0.00 -1.03 0.00 0.00 34.95 34.01 2vg4 s ARG 158 CO 0.05 -0.41 0.55 -0.46 -1.13 0.00 0.00 175.30 173.90 2vg4 s TRP 159 N -4.10 3.74 -0.29 5.89 -0.00 -1.26 -1.44 118.94 121.49 2vg4 s TRP 159 Ca 0.31 1.19 -0.03 0.00 -0.00 0.00 0.00 56.10 57.58 2vg4 s TRP 159 Cb 0.06 -2.44 0.10 0.00 -0.00 0.00 0.00 33.47 31.18 2vg4 s TRP 159 CO 0.08 0.55 0.12 0.08 -0.00 0.00 0.00 176.95 177.78 2vg4 s VAL 160 N -1.21 0.23 -0.03 5.86 1.01 -0.81 -4.90 120.40 120.55 2vg4 s VAL 160 Ca 0.31 -0.92 -0.31 0.00 0.00 0.00 0.00 61.98 61.06 2vg4 s VAL 160 Cb -0.18 -1.17 0.12 0.00 0.00 0.00 0.00 36.38 35.15 2vg4 s VAL 160 CO 0.18 -0.68 1.32 -0.83 0.00 0.00 0.00 175.10 175.10 2vg4 s GLY 161 N 1.95 -0.41 0.47 4.51 0.00 -1.26 -3.14 107.32 109.44 2vg4 s GLY 161 Ca 0.09 0.70 -0.21 0.00 0.00 0.00 0.00 44.72 45.29 2vg4 s GLY 161 CO -0.31 0.61 1.03 -0.45 0.00 0.00 0.00 173.10 173.98 2vg4 s SER 162 N -3.06 6.45 -0.16 1.64 0.15 -0.51 -4.99 113.70 113.23 2vg4 s SER 162 Ca 0.16 1.92 -0.24 0.00 0.70 0.00 0.00 55.95 58.49 2vg4 s SER 162 Cb 0.05 -2.56 -0.21 0.00 -1.71 0.00 0.00 66.02 61.59 2vg4 s SER 162 CO -0.04 -0.71 0.49 0.03 1.20 0.00 0.00 173.24 174.21 2vg4 h ARG 163 N 1.72 0.00 -6.05 5.44 3.08 -1.93 -3.43 114.38 113.21 2vg4 h ARG 163 Ca -0.49 0.00 -0.80 0.00 0.07 0.00 0.00 59.98 58.76 2vg4 h ARG 163 Cb 1.22 0.00 0.03 0.00 0.08 0.00 0.00 29.97 31.30 2vg4 h ARG 163 CO 0.60 0.91 0.44 -2.30 -1.07 0.00 0.00 179.97 178.55 2vg4 n PRO 164 N -4.55 0.29 0.00 0.04 -0.02 -1.26 -0.82 135.00 128.68 2vg4 n PRO 164 Ca -0.18 0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 2vg4 n PRO 164 Cb 0.52 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 32.36 2vg4 n PRO 164 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2vg4 n ARG 165 N 3.01 0.00 -1.68 -0.52 1.74 -1.26 -4.98 116.66 112.96 2vg4 n ARG 165 Ca 0.25 0.00 -0.49 0.00 -0.77 0.00 0.00 57.85 56.83 2vg4 n ARG 165 Cb 0.05 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.44 2vg4 n ARG 165 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2vg4 n LEU 166 N 0.00 3.30 -4.63 0.55 7.94 -0.00 -4.84 117.00 119.32 2vg4 n LEU 166 Ca 0.00 0.99 -0.58 0.00 -1.11 0.00 0.00 56.01 55.31 2vg4 n LEU 166 Cb 0.00 -1.35 -0.07 0.00 0.53 0.00 0.00 43.42 42.53 2vg4 n LEU 166 CO 0.00 -0.11 0.98 0.79 -1.11 0.00 0.00 177.39 177.94 2vg4 n TRP 167 N 6.30 1.50 -0.30 1.96 7.02 -1.26 -4.81 117.44 127.85 2vg4 n TRP 167 Ca 0.23 0.79 0.16 0.00 -1.02 0.00 0.00 57.50 57.66 2vg4 n TRP 167 Cb 0.27 -2.30 0.42 0.00 -2.42 0.00 0.00 31.31 27.29 2vg4 n TRP 167 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2vg4 h ARG 168 N 5.00 0.57 -0.17 -0.99 3.08 -1.93 -2.28 114.38 117.66 2vg4 h ARG 168 Ca -0.48 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.49 2vg4 h ARG 168 Cb 1.36 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 31.27 2vg4 h ARG 168 CO 0.83 0.37 -0.13 0.66 -1.07 0.00 0.00 179.97 180.64 2vg4 h SER 169 N 0.58 0.25 -0.02 7.04 4.64 -1.99 -2.04 113.55 122.02 2vg4 h SER 169 Ca 0.53 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.79 2vg4 h SER 169 Cb 1.07 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 63.09 2vg4 h SER 169 CO -0.28 0.41 -0.03 0.58 -0.87 0.00 0.00 176.83 176.65 2vg4 h VAL 170 N 0.25 1.41 -0.99 0.95 2.07 -1.73 -2.97 116.25 115.25 2vg4 h VAL 170 Ca 0.05 -1.25 0.11 0.00 0.82 0.00 0.00 66.70 66.43 2vg4 h VAL 170 Cb 0.39 2.22 -0.08 0.00 -1.52 0.00 0.00 31.29 32.30 2vg4 h VAL 170 CO 0.02 0.33 0.63 0.40 0.02 0.00 0.00 177.57 178.97 2vg4 h ILE 171 N -0.46 0.95 0.00 4.57 2.04 -1.41 -2.46 117.51 120.75 2vg4 h ILE 171 Ca 0.00 -0.34 -0.02 0.00 1.00 0.00 0.00 64.86 65.50 2vg4 h ILE 171 Cb 0.55 -0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 36.49 2vg4 h ILE 171 CO 0.01 0.18 -0.15 0.78 0.00 0.00 0.00 178.15 178.97 2vg4 h ASN 172 N 1.00 0.00 1.25 1.72 2.35 -1.41 -0.39 115.58 120.10 2vg4 h ASN 172 Ca 0.47 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 56.17 2vg4 h ASN 172 Cb 0.44 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.80 2vg4 h ASN 172 CO -0.24 0.09 -0.24 -0.33 -1.65 0.00 0.00 177.43 175.07 2vg4 h GLU 173 N 0.00 0.00 0.00 0.81 4.39 -1.28 -2.53 114.58 115.98 2vg4 h GLU 173 Ca -0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 2vg4 h GLU 173 Cb 1.07 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.71 2vg4 h GLU 173 CO 0.01 0.24 -1.42 1.28 -1.16 0.00 0.00 179.01 177.96 2vg4 n LEU 174 N -3.27 0.55 0.22 1.33 4.77 -1.05 -2.20 117.00 117.35 2vg4 n LEU 174 Ca 0.01 0.22 0.14 0.00 -0.03 0.00 0.00 56.01 56.35 2vg4 n LEU 174 Cb 0.51 -0.01 0.36 0.00 -2.33 0.00 0.00 43.42 41.96 2vg4 n LEU 174 CO 0.35 -0.07 0.88 0.00 -1.33 0.00 0.00 177.39 177.21 2vg4 h ALA 175 N 1.90 1.00 0.04 -1.18 0.00 -1.00 -0.85 119.26 119.17 2vg4 h ALA 175 Ca -0.04 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.59 2vg4 h ALA 175 Cb 1.11 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 2vg4 h ALA 175 CO 0.01 0.00 -1.56 0.28 0.00 0.00 0.00 179.25 177.98 2vg4 n VAL 176 N -2.98 1.62 0.19 0.00 0.31 -0.96 -3.23 118.33 113.28 2vg4 n VAL 176 Ca 0.03 -0.26 0.03 0.00 -0.01 0.00 0.00 64.34 64.13 2vg4 n VAL 176 Cb 0.44 -1.93 0.39 0.00 -0.91 0.00 0.00 33.84 31.83 2vg4 n VAL 176 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2vg4 h ALA 177 N -0.31 1.45 -0.24 3.52 0.00 -1.50 -2.21 119.26 119.98 2vg4 h ALA 177 Ca -0.39 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.16 2vg4 h ALA 177 Cb 1.57 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.30 2vg4 h ALA 177 CO -0.11 0.41 -0.11 1.49 0.00 0.00 0.00 179.25 180.93 2vg4 h GLU 178 N 0.02 0.49 0.00 0.00 4.81 -1.15 -2.56 114.58 116.20 2vg4 h GLU 178 Ca -0.00 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.02 2vg4 h GLU 178 Cb 0.57 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.94 2vg4 h GLU 178 CO 0.04 0.76 0.00 1.49 -0.73 0.00 0.00 179.01 180.57 2vg4 h GLU 179 N 0.21 0.00 0.00 1.92 4.57 -1.45 -1.98 114.58 117.84 2vg4 h GLU 179 Ca 0.05 0.00 -0.22 0.00 -1.18 0.00 0.00 59.36 58.02 2vg4 h GLU 179 Cb 0.61 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.16 2vg4 h GLU 179 CO 0.03 0.00 -1.43 0.52 -1.18 0.00 0.00 179.01 176.95 2vg4 h MET 180 N 0.00 0.00 -0.18 1.92 2.86 -1.30 -3.37 114.93 114.85 2vg4 h MET 180 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 2vg4 h MET 180 Cb 0.44 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.09 2vg4 h MET 180 CO 0.00 0.45 -0.01 0.25 1.06 0.00 0.00 176.91 178.66 2vg4 n THR 181 N -3.02 2.18 0.17 2.22 -2.24 -0.97 -4.71 114.28 107.91 2vg4 n THR 181 Ca -0.11 -2.06 0.02 0.00 -2.27 0.00 0.00 64.05 59.63 2vg4 n THR 181 Cb 0.93 -0.26 0.38 0.00 -2.10 0.00 0.00 70.33 69.28 2vg4 n THR 181 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2vg4 h LYS 182 N 1.20 0.08 -0.14 -0.78 2.10 -1.54 -2.25 116.57 115.25 2vg4 h LYS 182 Ca 0.01 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2vg4 h LYS 182 Cb 1.32 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.64 2vg4 h LYS 182 CO 0.16 0.36 0.00 -1.13 -2.00 0.00 0.00 179.45 176.85 2vg4 n SER 183 N -4.17 2.48 -4.87 7.07 3.41 -1.26 -4.91 113.62 111.37 2vg4 n SER 183 Ca -0.02 -1.82 -0.31 0.00 -0.26 0.00 0.00 58.87 56.46 2vg4 n SER 183 Cb 0.35 -0.08 -0.00 0.00 -0.26 0.00 0.00 64.21 64.22 2vg4 n SER 183 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2vg4 s ASN 184 N -1.80 6.35 -0.24 4.04 0.02 -0.85 -5.02 114.94 117.44 2vg4 s ASN 184 Ca 0.34 1.40 0.06 0.00 -1.02 0.00 0.00 52.86 53.64 2vg4 s ASN 184 Cb 0.20 -2.45 0.20 0.00 0.02 0.00 0.00 41.25 39.22 2vg4 s ASN 184 CO 0.31 -0.75 1.08 -0.90 0.02 0.00 0.00 177.10 176.86 2vg4 n ASP 185 N -2.33 -1.02 0.06 -1.22 5.68 -1.17 -4.61 116.55 111.95 2vg4 n ASP 185 Ca 0.06 -1.75 -0.14 0.00 -0.50 0.00 0.00 54.79 52.45 2vg4 n ASP 185 Cb 0.54 0.61 -0.14 0.00 -1.14 0.00 0.00 41.12 41.00 2vg4 n ASP 185 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 2vg4 h VAL 186 N 1.57 1.26 -3.34 2.12 2.07 -1.54 -3.49 116.25 114.90 2vg4 h VAL 186 Ca -0.32 -2.93 -0.00 0.00 0.82 0.00 0.00 66.70 64.27 2vg4 h VAL 186 Cb 1.20 2.76 -0.07 0.00 -1.52 0.00 0.00 31.29 33.66 2vg4 h VAL 186 CO -0.12 0.82 0.05 -0.51 0.02 0.00 0.00 177.57 177.83 2vg4 s ILE 187 N -2.64 0.00 -0.31 4.57 2.07 -1.20 -4.59 121.20 119.11 2vg4 s ILE 187 Ca -0.06 -1.21 -0.03 0.00 -1.41 0.00 0.00 60.65 57.94 2vg4 s ILE 187 Cb 0.08 -2.14 0.11 0.00 0.13 0.00 0.00 42.46 40.64 2vg4 s ILE 187 CO 0.85 0.00 0.17 -0.89 -1.91 0.00 0.00 174.94 173.16 2vg4 s THR 188 N -3.89 -0.06 -0.20 4.00 2.01 0.67 -1.47 115.64 116.69 2vg4 s THR 188 Ca 0.17 -0.96 -0.29 0.00 0.31 0.00 0.00 61.69 60.92 2vg4 s THR 188 Cb -0.03 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.48 2vg4 s THR 188 CO 0.08 -0.76 1.07 -0.63 -0.69 0.00 0.00 174.62 173.69 2vg4 s ILE 189 N 1.86 4.62 -0.58 1.82 1.01 -0.52 -1.79 121.20 127.62 2vg4 s ILE 189 Ca 0.11 1.95 -0.19 0.00 0.00 0.00 0.00 60.65 62.53 2vg4 s ILE 189 Cb -0.17 -4.26 0.10 0.00 0.01 0.00 0.00 42.46 38.14 2vg4 s ILE 189 CO -0.27 -0.15 0.69 0.20 0.00 0.00 0.00 174.94 175.41 2vg4 s ASN 190 N 1.31 6.19 -0.48 3.58 0.01 -0.42 -2.59 114.94 122.53 2vg4 s ASN 190 Ca 0.46 -1.40 -0.29 0.00 -0.71 0.00 0.00 52.86 50.92 2vg4 s ASN 190 Cb -0.17 -2.30 0.03 0.00 0.41 0.00 0.00 41.25 39.23 2vg4 s ASN 190 CO 0.09 -1.08 1.17 -0.47 -1.51 0.00 0.00 177.10 175.30 2vg4 s TYR 191 N 2.63 2.76 -0.45 2.20 5.04 -0.52 -2.91 117.35 126.10 2vg4 s TYR 191 Ca 0.11 0.69 -0.17 0.00 -2.44 0.00 0.00 57.07 55.27 2vg4 s TYR 191 Cb -0.24 -4.44 0.04 0.00 0.35 0.00 0.00 41.96 37.67 2vg4 s TYR 191 CO 0.07 -1.37 0.43 0.00 -1.34 0.00 0.00 175.55 173.34 2vg4 s VAL 193 N 1.99 1.62 -1.20 0.00 1.01 -1.19 -1.64 120.40 121.00 2vg4 s VAL 193 Ca 0.09 -0.73 -0.02 0.00 0.00 0.00 0.00 61.98 61.32 2vg4 s VAL 193 Cb -0.20 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.73 2vg4 s VAL 193 CO 0.11 0.46 1.01 -3.20 0.00 0.00 0.00 175.10 173.48 2vg4 n ASN 194 N 3.99 -2.90 -4.84 3.32 5.15 -1.21 -4.22 115.26 114.55 2vg4 n ASN 194 Ca -0.20 -0.59 -0.38 0.00 -0.60 0.00 0.00 54.58 52.82 2vg4 n ASN 194 Cb 0.52 -4.99 -0.06 0.00 -0.53 0.00 0.00 39.78 34.72 2vg4 n ASN 194 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 2vg4 s TYR 195 N -3.34 3.72 -0.16 1.20 6.14 -1.21 -1.42 117.35 122.28 2vg4 s TYR 195 Ca 0.12 1.02 -0.04 0.00 0.64 0.00 0.00 57.07 58.80 2vg4 s TYR 195 Cb -0.05 -2.31 0.07 0.00 0.42 0.00 0.00 41.96 40.09 2vg4 s TYR 195 CO 0.71 0.62 0.15 0.20 0.64 0.00 0.00 175.55 177.87 2vg4 s GLY 196 N -1.17 0.15 0.20 8.97 0.00 -1.26 -2.05 107.32 112.16 2vg4 s GLY 196 Ca 0.26 0.09 -0.19 0.00 0.00 0.00 0.00 44.72 44.88 2vg4 s GLY 196 CO 0.15 1.88 1.59 -1.33 0.00 0.00 0.00 173.10 175.39 2vg4 h GLY 197 N 8.37 0.03 1.04 0.20 0.00 -1.56 0.24 103.07 111.38 2vg4 h GLY 197 Ca -0.15 0.40 -0.12 0.00 0.00 0.00 0.00 47.33 47.46 2vg4 h GLY 197 CO 0.26 -0.22 -0.20 3.21 0.00 0.00 0.00 176.54 179.59 2vg4 h ARG 198 N -0.12 0.86 -0.11 4.80 3.08 -1.97 -3.10 114.38 117.83 2vg4 h ARG 198 Ca 0.26 -0.38 0.03 0.00 0.07 0.00 0.00 59.98 59.97 2vg4 h ARG 198 Cb 0.55 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.57 2vg4 h ARG 198 CO -0.71 1.02 0.17 1.15 -1.07 0.00 0.00 179.97 180.53 2vg4 h THR 199 N 0.67 0.31 0.03 2.04 2.02 -1.05 0.18 112.91 117.12 2vg4 h THR 199 Ca 0.09 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 66.97 2vg4 h THR 199 Cb 0.76 0.85 -0.04 0.00 -1.74 0.00 0.00 68.15 67.98 2vg4 h THR 199 CO 0.06 0.00 -1.74 -0.08 0.37 0.00 0.00 175.52 174.13 2vg4 h GLU 200 N 0.00 0.07 0.82 6.66 4.81 -0.81 -2.98 114.58 123.15 2vg4 h GLU 200 Ca 0.05 -0.13 -0.04 0.00 -0.13 0.00 0.00 59.36 59.12 2vg4 h GLU 200 Cb 0.40 0.05 0.01 0.00 0.63 0.00 0.00 28.75 29.83 2vg4 h GLU 200 CO -0.00 0.71 -0.39 0.82 -0.73 0.00 0.00 179.01 179.41 2vg4 h ILE 201 N 0.02 0.00 -0.85 2.32 2.04 -1.08 -1.32 117.51 118.63 2vg4 h ILE 201 Ca -0.30 -0.20 0.29 0.00 1.00 0.00 0.00 64.86 65.65 2vg4 h ILE 201 Cb 2.01 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 37.93 2vg4 h ILE 201 CO 0.09 0.00 0.22 0.41 0.00 0.00 0.00 178.15 178.86 2vg4 n THR 202 N -5.50 -0.36 0.06 -0.27 -1.04 0.48 -0.54 114.28 107.11 2vg4 n THR 202 Ca -0.14 1.81 -0.09 0.00 -2.04 0.00 0.00 64.05 63.60 2vg4 n THR 202 Cb 0.43 -2.78 -0.13 0.00 -1.82 0.00 0.00 70.33 66.04 2vg4 n THR 202 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2vg4 h GLU 203 N 0.00 0.06 0.00 -2.82 5.08 -1.42 -1.61 114.58 113.87 2vg4 h GLU 203 Ca 0.61 -0.10 -0.05 0.00 -1.00 0.00 0.00 59.36 58.83 2vg4 h GLU 203 Cb 1.45 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.73 2vg4 h GLU 203 CO -0.74 0.99 -0.22 0.00 -1.00 0.00 0.00 179.01 178.04 2vg4 h ALA 204 N 0.91 1.43 0.00 3.43 0.00 0.39 -2.93 119.26 122.49 2vg4 h ALA 204 Ca -0.07 -0.20 -0.23 0.00 0.00 0.00 0.00 54.91 54.41 2vg4 h ALA 204 Cb 1.84 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.56 2vg4 h ALA 204 CO 0.14 0.27 -1.27 1.15 0.00 0.00 0.00 179.25 179.54 2vg4 h THR 205 N 0.00 1.17 -0.57 0.00 2.02 -0.85 -2.84 112.91 111.83 2vg4 h THR 205 Ca -0.00 -2.88 -0.05 0.00 0.77 0.00 0.00 66.41 64.26 2vg4 h THR 205 Cb 0.44 2.55 -0.03 0.00 -1.74 0.00 0.00 68.15 69.38 2vg4 h THR 205 CO 0.03 0.67 0.17 0.03 0.37 0.00 0.00 175.52 176.78 2vg4 h ARG 206 N 0.00 0.86 0.57 6.66 3.08 -1.12 -1.01 114.38 123.42 2vg4 h ARG 206 Ca -0.13 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 59.73 2vg4 h ARG 206 Cb 1.81 -0.14 0.01 0.00 0.08 0.00 0.00 29.97 31.73 2vg4 h ARG 206 CO 0.10 0.75 -0.27 0.93 -1.07 0.00 0.00 179.97 180.41 2vg4 h GLU 207 N 0.84 -0.73 -0.72 0.04 5.08 -1.50 -2.05 114.58 115.53 2vg4 h GLU 207 Ca 0.19 0.05 0.16 0.00 -1.00 0.00 0.00 59.36 58.76 2vg4 h GLU 207 Cb 0.26 0.17 -0.12 0.00 0.50 0.00 0.00 28.75 29.55 2vg4 h GLU 207 CO -0.01 -0.45 0.04 0.82 -1.00 0.00 0.00 179.01 178.42 2vg4 h ILE 208 N -0.87 0.41 -0.43 3.13 2.04 -1.33 -0.63 117.51 119.82 2vg4 h ILE 208 Ca -0.08 -0.05 0.04 0.00 1.00 0.00 0.00 64.86 65.77 2vg4 h ILE 208 Cb 0.62 0.26 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 2vg4 h ILE 208 CO 0.13 0.02 0.21 0.00 0.00 0.00 0.00 178.15 178.51 2vg4 h ALA 209 N 1.66 0.54 0.39 1.87 0.00 -1.03 -0.22 119.26 122.46 2vg4 h ALA 209 Ca 0.39 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.31 2vg4 h ALA 209 Cb 0.68 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2vg4 h ALA 209 CO -0.60 -0.15 -0.21 0.00 0.00 0.00 0.00 179.25 178.29 2vg4 h ARG 210 N 0.42 -0.53 -0.88 0.00 3.08 -0.41 0.27 114.38 116.32 2vg4 h ARG 210 Ca 0.19 0.04 0.09 0.00 0.07 0.00 0.00 59.98 60.37 2vg4 h ARG 210 Cb 0.11 0.12 -0.07 0.00 0.08 0.00 0.00 29.97 30.21 2vg4 h ARG 210 CO -0.14 -0.35 0.52 0.93 -1.07 0.00 0.00 179.97 179.86 2vg4 h GLU 211 N -0.55 0.86 -0.40 0.04 4.39 -1.10 0.22 114.58 118.05 2vg4 h GLU 211 Ca -0.05 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.55 2vg4 h GLU 211 Cb 0.44 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.87 2vg4 h GLU 211 CO 0.07 0.57 0.05 0.28 -1.16 0.00 0.00 179.01 178.81 2vg4 h VAL 212 N 0.88 1.20 0.00 3.13 2.07 -0.65 -1.12 116.25 121.76 2vg4 h VAL 212 Ca 0.42 -0.76 0.00 0.00 0.82 0.00 0.00 66.70 67.17 2vg4 h VAL 212 Cb 0.35 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 2vg4 h VAL 212 CO -0.23 0.27 -0.32 0.00 0.02 0.00 0.00 177.57 177.30 2vg4 h ALA 213 N 1.47 0.84 -0.01 1.67 0.00 0.73 -3.16 119.26 120.80 2vg4 h ALA 213 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2vg4 h ALA 213 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2vg4 h ALA 213 CO 0.01 0.00 -0.27 0.00 0.00 0.00 0.00 179.25 178.99 2vg4 n ALA 214 N -2.12 3.08 -0.91 0.00 0.00 0.62 -4.93 120.51 116.25 2vg4 n ALA 214 Ca 0.03 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.11 2vg4 n ALA 214 Cb 0.53 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2vg4 n ALA 214 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vg4 n GLY 215 N 1.36 0.63 0.00 0.00 0.00 -0.95 -4.96 105.19 101.28 2vg4 n GLY 215 Ca 0.11 -0.75 0.05 0.00 0.00 0.00 0.00 46.02 45.43 2vg4 n GLY 215 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vg4 n ARG 216 N -2.25 3.34 -3.78 1.61 1.74 -0.46 -4.95 116.66 111.91 2vg4 n ARG 216 Ca 0.00 -0.01 -0.15 0.00 -0.77 0.00 0.00 57.85 56.92 2vg4 n ARG 216 Cb 0.10 -1.02 -0.16 0.00 -1.02 0.00 0.00 32.46 30.36 2vg4 n ARG 216 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2vg4 s LEU 217 N -2.50 1.06 -0.14 0.55 2.96 -1.16 -4.95 118.68 114.49 2vg4 s LEU 217 Ca 0.04 0.04 -0.20 0.00 -0.22 0.00 0.00 54.13 53.79 2vg4 s LEU 217 Cb 0.08 -0.08 -0.03 0.00 0.50 0.00 0.00 46.19 46.66 2vg4 s LEU 217 CO 0.45 -0.13 0.57 0.21 -1.32 0.00 0.00 176.35 176.13 2vg4 s ASN 218 N 1.10 6.72 0.47 3.68 2.47 -1.26 -4.21 114.94 123.91 2vg4 s ASN 218 Ca -0.09 0.87 0.29 0.00 0.42 0.00 0.00 52.86 54.35 2vg4 s ASN 218 Cb -0.13 -2.33 1.36 0.00 -1.45 0.00 0.00 41.25 38.70 2vg4 s ASN 218 CO -0.03 -0.13 1.76 -0.65 -3.72 0.00 0.00 177.10 174.34 2vg4 h PRO 219 N 7.06 0.17 -0.01 0.43 0.11 -1.99 -1.36 132.00 136.41 2vg4 h PRO 219 Ca -0.37 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2vg4 h PRO 219 Cb 1.17 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2vg4 h PRO 219 CO 0.76 0.11 0.00 0.39 -0.21 0.00 0.00 178.00 179.05 2vg4 n GLU 220 N -4.42 1.14 0.00 1.05 -0.58 -1.26 -3.09 120.64 113.48 2vg4 n GLU 220 Ca 0.27 -0.21 0.04 0.00 -0.42 0.00 0.00 57.16 56.84 2vg4 n GLU 220 Cb 1.13 -1.43 0.03 0.00 -0.57 0.00 0.00 31.44 30.60 2vg4 n GLU 220 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2vg4 n ARG 221 N -0.69 0.19 -2.09 3.49 5.12 -0.51 -4.98 116.66 117.19 2vg4 n ARG 221 Ca 0.20 -0.94 -0.42 0.00 -1.93 0.00 0.00 57.85 54.76 2vg4 n ARG 221 Cb 0.15 -1.14 -0.03 0.00 -1.16 0.00 0.00 32.46 30.28 2vg4 n ARG 221 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2vg4 s ILE 222 N -0.67 3.32 0.38 0.55 1.01 -1.18 -4.96 121.20 119.64 2vg4 s ILE 222 Ca 0.09 0.81 0.05 0.00 0.00 0.00 0.00 60.65 61.60 2vg4 s ILE 222 Cb 0.06 -3.52 -0.02 0.00 0.01 0.00 0.00 42.46 39.00 2vg4 s ILE 222 CO 0.10 0.02 0.17 0.35 0.00 0.00 0.00 174.94 175.58 2vg4 n THR 223 N 4.47 0.00 -0.03 2.92 -2.24 -1.26 -5.00 114.28 113.13 2vg4 n THR 223 Ca 0.14 -2.30 0.01 0.00 -2.27 0.00 0.00 64.05 59.62 2vg4 n THR 223 Cb 0.42 0.90 0.32 0.00 -2.10 0.00 0.00 70.33 69.87 2vg4 n THR 223 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2vg4 h GLU 224 N 0.00 0.60 -0.99 -0.78 5.08 -2.00 -1.25 114.58 115.24 2vg4 h GLU 224 Ca -0.29 -0.09 0.09 0.00 -1.00 0.00 0.00 59.36 58.07 2vg4 h GLU 224 Cb 1.17 -0.11 -0.07 0.00 0.50 0.00 0.00 28.75 30.23 2vg4 h GLU 224 CO 0.45 0.53 0.63 0.77 -1.00 0.00 0.00 179.01 180.39 2vg4 h SER 225 N 0.60 0.97 -0.55 1.42 0.02 -1.98 -0.74 113.55 113.29 2vg4 h SER 225 Ca 0.14 0.03 -0.10 0.00 -0.84 0.00 0.00 61.79 61.02 2vg4 h SER 225 Cb 0.17 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 2vg4 h SER 225 CO -0.01 0.58 -0.06 0.74 -1.14 0.00 0.00 176.83 176.95 2vg4 h THR 226 N 1.08 1.27 -0.37 -2.27 2.02 -1.60 -0.90 112.91 112.14 2vg4 h THR 226 Ca 0.45 -1.20 -0.12 0.00 0.77 0.00 0.00 66.41 66.31 2vg4 h THR 226 Cb 0.30 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 2vg4 h THR 226 CO -0.21 0.43 -0.22 0.40 0.37 0.00 0.00 175.52 176.28 2vg4 h ILE 227 N 0.93 1.28 -0.06 3.11 2.04 -1.30 -2.26 117.51 121.25 2vg4 h ILE 227 Ca 0.16 -1.37 0.02 0.00 1.00 0.00 0.00 64.86 64.66 2vg4 h ILE 227 Cb 0.61 1.37 -0.00 0.00 -0.74 0.00 0.00 36.82 38.06 2vg4 h ILE 227 CO 0.04 0.45 0.07 0.00 0.00 0.00 0.00 178.15 178.71 2vg4 h ALA 228 N 0.78 1.60 0.00 1.87 0.00 -0.79 -2.08 119.26 120.65 2vg4 h ALA 228 Ca 0.08 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 2vg4 h ALA 228 Cb 0.78 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 2vg4 h ALA 228 CO 0.06 -0.10 -1.42 0.54 0.00 0.00 0.00 179.25 178.33 2vg4 n ARG 229 N -3.79 0.62 -0.44 0.00 1.74 -0.37 -4.04 116.66 110.37 2vg4 n ARG 229 Ca -0.01 0.23 0.08 0.00 -0.77 0.00 0.00 57.85 57.38 2vg4 n ARG 229 Cb 0.17 -1.81 0.29 0.00 -1.02 0.00 0.00 32.46 30.09 2vg4 n ARG 229 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2vg4 n HIS 230 N -2.89 1.10 -1.40 -1.55 8.25 -0.80 -4.70 115.22 113.23 2vg4 n HIS 230 Ca -0.10 -0.46 -0.30 0.00 -0.26 0.00 0.00 57.72 56.60 2vg4 n HIS 230 Cb 0.84 -0.14 0.11 0.00 1.12 0.00 0.00 29.99 31.93 2vg4 n HIS 230 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2vg4 s LEU 231 N -1.40 2.48 0.11 2.41 1.43 -1.12 -4.11 118.68 118.48 2vg4 s LEU 231 Ca 0.42 1.41 -0.22 0.00 -1.03 0.00 0.00 54.13 54.70 2vg4 s LEU 231 Cb 0.25 -3.95 -0.10 0.00 0.03 0.00 0.00 46.19 42.43 2vg4 s LEU 231 CO 0.23 -2.24 1.71 -0.61 0.23 0.00 0.00 176.35 175.67 2vg4 h GLN 232 N -1.28 -0.06 -3.37 1.70 4.15 -1.91 -3.31 115.11 111.03 2vg4 h GLN 232 Ca -0.48 0.00 -0.63 0.00 0.77 0.00 0.00 58.65 58.31 2vg4 h GLN 232 Cb 1.27 0.01 -0.41 0.00 0.21 0.00 0.00 27.48 28.57 2vg4 h GLN 232 CO 0.57 -0.04 -0.66 1.03 -1.93 0.00 0.00 178.83 177.80 2vg4 s ARG 233 N -6.18 1.79 0.00 1.69 1.81 -1.26 -4.97 118.95 111.83 2vg4 s ARG 233 Ca -0.14 -2.44 0.12 0.00 -1.72 0.00 0.00 55.73 51.56 2vg4 s ARG 233 Cb 0.08 -3.09 0.73 0.00 -0.45 0.00 0.00 34.95 32.21 2vg4 s ARG 233 CO 0.67 -1.11 1.47 -0.35 -0.68 0.00 0.00 175.30 175.30 2vg4 n PRO 234 N 3.28 1.00 0.00 3.54 -0.05 -1.25 -2.96 135.00 138.57 2vg4 n PRO 234 Ca 0.06 -0.00 0.12 0.00 -0.05 0.00 0.00 63.50 63.62 2vg4 n PRO 234 Cb 0.33 -1.19 0.17 0.00 -0.05 0.00 0.00 33.50 32.76 2vg4 n PRO 234 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 175.50 175.05 2vg4 n ASP 235 N -0.69 0.61 -4.65 3.54 5.75 -1.26 -4.83 116.55 115.02 2vg4 n ASP 235 Ca 0.09 -0.41 -0.42 0.00 -0.01 0.00 0.00 54.79 54.04 2vg4 n ASP 235 Cb 0.04 0.42 -0.03 0.00 -1.03 0.00 0.00 41.12 40.52 2vg4 n ASP 235 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2vg4 s ILE 236 N -3.01 3.09 0.71 2.12 1.01 -1.15 -4.97 121.20 119.00 2vg4 s ILE 236 Ca 0.10 0.11 -0.14 0.00 0.00 0.00 0.00 60.65 60.73 2vg4 s ILE 236 Cb 0.17 -3.08 0.03 0.00 0.01 0.00 0.00 42.46 39.59 2vg4 s ILE 236 CO 0.74 -0.02 1.12 -2.16 0.00 0.00 0.00 174.94 174.62 2vg4 s PRO 237 N 4.61 2.49 0.66 2.79 0.04 -1.26 -4.98 135.00 139.36 2vg4 s PRO 237 Ca 0.88 1.39 -0.17 0.00 0.04 0.00 0.00 61.00 63.14 2vg4 s PRO 237 Cb -0.40 -1.91 -0.08 0.00 0.04 0.00 0.00 34.50 32.15 2vg4 s PRO 237 CO 0.39 -1.49 0.35 -0.25 0.04 0.00 0.00 177.00 176.04 2vg4 n ASP 238 N -2.81 -1.80 -4.70 6.66 8.00 -1.26 -4.91 116.55 115.72 2vg4 n ASP 238 Ca 0.11 0.62 -0.40 0.00 0.71 0.00 0.00 54.79 55.82 2vg4 n ASP 238 Cb 0.52 -1.12 -0.05 0.00 -0.02 0.00 0.00 41.12 40.45 2vg4 n ASP 238 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2vg4 s VAL 239 N -1.87 5.01 -0.20 2.53 1.01 -0.94 -4.70 120.40 121.24 2vg4 s VAL 239 Ca 0.64 1.47 -0.22 0.00 0.00 0.00 0.00 61.98 63.86 2vg4 s VAL 239 Cb -0.39 -4.05 -0.19 0.00 0.00 0.00 0.00 36.38 31.74 2vg4 s VAL 239 CO 0.60 0.19 0.25 0.44 0.00 0.00 0.00 175.10 176.58 2vg4 h ASP 240 N 6.94 0.00 -3.14 3.32 3.32 -1.14 -3.35 116.42 122.36 2vg4 h ASP 240 Ca -0.38 -0.54 -0.61 0.00 0.02 0.00 0.00 57.03 55.52 2vg4 h ASP 240 Cb 1.18 0.00 -0.35 0.00 0.22 0.00 0.00 39.33 40.38 2vg4 h ASP 240 CO 0.77 1.42 -0.84 -0.22 -1.72 0.00 0.00 179.24 178.65 2vg4 s LEU 241 N -7.92 1.76 -0.44 1.55 2.96 -0.71 -2.11 118.68 113.77 2vg4 s LEU 241 Ca -0.27 -0.50 -0.07 0.00 -0.22 0.00 0.00 54.13 53.07 2vg4 s LEU 241 Cb 0.05 -1.21 0.11 0.00 0.50 0.00 0.00 46.19 45.64 2vg4 s LEU 241 CO 0.59 -0.03 0.28 0.12 -1.32 0.00 0.00 176.35 175.98 2vg4 s PHE 242 N 1.33 3.48 0.02 5.38 5.36 -0.46 -0.88 117.98 132.22 2vg4 s PHE 242 Ca 0.02 -2.06 -0.10 0.00 -0.96 0.00 0.00 56.93 53.83 2vg4 s PHE 242 Cb -0.13 -3.32 -0.05 0.00 -0.34 0.00 0.00 43.02 39.18 2vg4 s PHE 242 CO -0.09 -0.97 0.34 -0.51 -1.46 0.00 0.00 175.22 172.53 2vg4 s LEU 243 N 1.28 4.39 -0.15 6.12 2.01 -0.16 -1.17 118.68 131.01 2vg4 s LEU 243 Ca 0.06 0.74 -0.12 0.00 0.01 0.00 0.00 54.13 54.83 2vg4 s LEU 243 Cb -0.24 -2.70 0.04 0.00 0.01 0.00 0.00 46.19 43.30 2vg4 s LEU 243 CO -0.02 0.26 0.38 -0.60 1.01 0.00 0.00 176.35 177.38 2vg4 s ARG 244 N -1.56 0.41 0.00 1.70 3.52 -1.12 -1.00 118.95 120.90 2vg4 s ARG 244 Ca 0.27 0.60 0.00 0.00 -0.13 0.00 0.00 55.73 56.47 2vg4 s ARG 244 Cb -0.14 0.13 0.00 0.00 -1.56 0.00 0.00 34.95 33.38 2vg4 s ARG 244 CO 0.15 -0.09 0.00 0.25 -0.81 0.00 0.00 175.30 174.80 2vg4 n THR 245 N 3.34 0.00 0.00 4.11 -2.24 -1.24 -2.32 114.28 115.93 2vg4 n THR 245 Ca -0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2vg4 n THR 245 Cb 0.56 -0.91 0.00 0.00 -2.10 0.00 0.00 70.33 67.89 2vg4 n THR 245 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2vg4 n SER 246 N -1.89 0.00 0.00 3.42 3.41 -1.05 -3.14 113.62 114.37 2vg4 n SER 246 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2vg4 n SER 246 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2vg4 n SER 246 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vg4 n GLY 247 N 0.00 1.47 3.63 5.00 0.00 -0.54 -4.75 105.19 110.00 2vg4 n GLY 247 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2vg4 n GLY 247 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vg4 s GLU 248 N -0.19 4.03 -1.05 1.61 0.41 -1.19 -5.00 118.70 117.33 2vg4 s GLU 248 Ca 0.00 -0.14 -0.03 0.00 -0.41 0.00 0.00 54.97 54.39 2vg4 s GLU 248 Cb 0.00 -3.61 0.31 0.00 -1.78 0.00 0.00 34.13 29.05 2vg4 s GLU 248 CO 0.00 -0.11 1.51 1.04 -0.49 0.00 0.00 175.26 177.20 2vg4 n GLN 249 N 4.82 4.55 -3.94 1.61 6.02 -1.26 -4.76 117.38 124.41 2vg4 n GLN 249 Ca -0.12 -4.59 -0.10 0.00 -0.01 0.00 0.00 57.00 52.18 2vg4 n GLN 249 Cb 0.52 -2.49 -0.12 0.00 1.02 0.00 0.00 30.24 29.17 2vg4 n GLN 249 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2vg4 s ARG 250 N -3.06 0.20 0.21 -1.09 0.52 -1.26 -4.99 118.95 109.48 2vg4 s ARG 250 Ca 0.33 -0.38 0.11 0.00 -0.52 0.00 0.00 55.73 55.27 2vg4 s ARG 250 Cb 0.08 0.06 -0.00 0.00 0.52 0.00 0.00 34.95 35.60 2vg4 s ARG 250 CO 0.06 -0.03 1.40 0.66 0.02 0.00 0.00 175.30 177.41 2vg4 h SER 251 N 5.21 0.00 -4.81 0.23 4.64 -1.95 -3.48 113.55 113.40 2vg4 h SER 251 Ca -0.29 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 60.79 2vg4 h SER 251 Cb 1.21 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.25 2vg4 h SER 251 CO 0.45 0.74 -0.33 -1.20 -0.87 0.00 0.00 176.83 175.61 2vg4 n SER 252 N -3.35 -2.95 -0.47 4.97 7.64 -1.26 -1.15 113.62 117.05 2vg4 n SER 252 Ca 0.01 0.03 -0.02 0.00 1.01 0.00 0.00 58.87 59.89 2vg4 n SER 252 Cb 0.81 -2.52 0.00 0.00 -1.01 0.00 0.00 64.21 61.49 2vg4 n SER 252 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2vg4 n ASN 253 N -1.90 -1.88 -4.80 6.43 5.15 -1.26 -4.93 115.26 112.06 2vg4 n ASN 253 Ca -0.05 -0.02 -0.36 0.00 -0.60 0.00 0.00 54.58 53.54 2vg4 n ASN 253 Cb 0.55 -0.95 -0.07 0.00 -0.53 0.00 0.00 39.78 38.78 2vg4 n ASN 253 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 2vg4 s PHE 254 N -2.49 3.49 -1.20 1.20 5.36 -0.30 -1.32 117.98 122.72 2vg4 s PHE 254 Ca 0.02 0.41 -0.03 0.00 -0.96 0.00 0.00 56.93 56.38 2vg4 s PHE 254 Cb -0.01 -2.00 0.03 0.00 -0.34 0.00 0.00 43.02 40.69 2vg4 s PHE 254 CO 0.03 0.54 0.07 -1.33 -1.46 0.00 0.00 175.22 173.07 2vg4 n MET 255 N 2.56 -0.93 -0.16 10.12 2.81 -1.26 -4.76 117.12 125.51 2vg4 n MET 255 Ca -0.18 0.07 -0.05 0.00 -1.81 0.00 0.00 57.70 55.73 2vg4 n MET 255 Cb 0.54 -2.81 0.01 0.00 -0.71 0.00 0.00 33.22 30.25 2vg4 n MET 255 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 2vg4 h LEU 256 N -1.02 -0.93 -0.20 4.03 5.85 -1.83 0.20 115.31 121.41 2vg4 h LEU 256 Ca -0.49 0.19 -0.22 0.00 0.84 0.00 0.00 57.88 58.21 2vg4 h LEU 256 Cb 1.05 0.47 0.01 0.00 0.37 0.00 0.00 40.66 42.56 2vg4 h LEU 256 CO 0.55 -0.28 -0.77 -0.25 -0.34 0.00 0.00 178.44 177.36 2vg4 h TRP 257 N -0.16 0.99 -0.24 1.25 2.91 -1.86 -3.27 115.95 115.57 2vg4 h TRP 257 Ca 0.22 -0.44 -0.12 0.00 1.13 0.00 0.00 58.89 59.68 2vg4 h TRP 257 Cb 0.51 -0.15 -0.01 0.00 -0.51 0.00 0.00 29.16 28.99 2vg4 h TRP 257 CO -0.54 1.26 -0.36 1.96 -1.03 0.00 0.00 178.44 179.74 2vg4 h GLN 258 N 0.51 0.53 -0.77 2.65 7.50 -1.68 -3.25 115.11 120.60 2vg4 h GLN 258 Ca -0.05 -0.25 -0.12 0.00 0.50 0.00 0.00 58.65 58.74 2vg4 h GLN 258 Cb 1.39 -0.01 -0.07 0.00 0.05 0.00 0.00 27.48 28.84 2vg4 h GLN 258 CO 0.15 0.81 0.15 0.00 -1.50 0.00 0.00 178.83 178.44 2vg4 n ALA 259 N -2.50 3.99 -0.32 3.87 0.00 0.63 -2.22 120.51 123.97 2vg4 n ALA 259 Ca -0.01 -1.73 0.07 0.00 0.00 0.00 0.00 53.44 51.77 2vg4 n ALA 259 Cb 0.48 -1.17 0.24 0.00 0.00 0.00 0.00 19.45 18.99 2vg4 n ALA 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vg4 h ALA 260 N 2.90 1.38 -0.05 0.00 0.00 -1.66 -2.62 119.26 119.20 2vg4 h ALA 260 Ca 0.15 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2vg4 h ALA 260 Cb 1.91 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.60 2vg4 h ALA 260 CO 0.53 0.01 -0.37 0.66 0.00 0.00 0.00 179.25 180.08 2vg4 n TYR 261 N -4.78 0.16 -2.33 0.00 4.01 -1.26 -5.06 117.16 107.90 2vg4 n TYR 261 Ca 0.18 -1.44 -0.30 0.00 -0.16 0.00 0.00 57.90 56.18 2vg4 n TYR 261 Cb 0.42 -0.27 -0.01 0.00 -0.31 0.00 0.00 39.34 39.17 2vg4 n TYR 261 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2vg4 s ALA 262 N -3.19 3.19 -0.45 -0.72 0.00 -0.99 -4.99 121.76 114.62 2vg4 s ALA 262 Ca 0.38 -0.11 -0.20 0.00 0.00 0.00 0.00 51.96 52.02 2vg4 s ALA 262 Cb 0.36 -2.93 0.03 0.00 0.00 0.00 0.00 23.12 20.58 2vg4 s ALA 262 CO -0.04 -0.38 0.64 -1.21 0.00 0.00 0.00 175.76 174.76 2vg4 s GLU 263 N -4.57 3.24 -0.30 0.00 0.41 -0.90 -4.92 118.70 111.67 2vg4 s GLU 263 Ca 0.54 -0.49 -0.29 0.00 -0.41 0.00 0.00 54.97 54.32 2vg4 s GLU 263 Cb -0.10 -3.98 0.01 0.00 -1.78 0.00 0.00 34.13 28.27 2vg4 s GLU 263 CO 0.42 -1.06 1.17 0.71 -0.49 0.00 0.00 175.26 176.01 2vg4 s TYR 264 N 2.78 2.97 -0.15 1.61 2.02 -1.26 -1.35 117.35 123.96 2vg4 s TYR 264 Ca 0.21 1.07 -0.02 0.00 -0.37 0.00 0.00 57.07 57.96 2vg4 s TYR 264 Cb -0.15 -3.75 -0.02 0.00 -0.40 0.00 0.00 41.96 37.64 2vg4 s TYR 264 CO 0.17 -1.17 -0.09 0.42 -1.57 0.00 0.00 175.55 173.32 2vg4 s ILE 265 N 3.89 3.32 0.00 2.71 1.01 -0.31 -4.97 121.20 126.85 2vg4 s ILE 265 Ca 0.50 -0.55 0.08 0.00 0.00 0.00 0.00 60.65 60.67 2vg4 s ILE 265 Cb -0.14 -2.43 -0.02 0.00 0.01 0.00 0.00 42.46 39.87 2vg4 s ILE 265 CO 0.18 0.50 -0.24 -0.36 0.00 0.00 0.00 174.94 175.02 2vg4 s PHE 266 N 0.56 2.10 0.17 3.97 0.08 -1.26 -2.81 117.98 120.80 2vg4 s PHE 266 Ca -0.06 -0.40 0.01 0.00 0.12 0.00 0.00 56.93 56.61 2vg4 s PHE 266 Cb -0.15 -1.32 -0.05 0.00 -0.57 0.00 0.00 43.02 40.93 2vg4 s PHE 266 CO 0.03 0.01 0.02 -0.65 -0.10 0.00 0.00 175.22 174.54 2vg4 s GLN 267 N -0.77 1.11 -0.10 0.44 -0.21 -0.98 -5.02 119.66 114.13 2vg4 s GLN 267 Ca 0.09 -1.54 -0.03 0.00 0.02 0.00 0.00 55.36 53.90 2vg4 s GLN 267 Cb -0.09 -0.17 -0.26 0.00 1.00 0.00 0.00 33.01 33.49 2vg4 s GLN 267 CO 0.00 -0.17 0.43 -0.25 -2.12 0.00 0.00 175.29 173.18 2vg4 n ASP 268 N -0.24 1.86 -4.59 5.90 8.00 -1.26 -1.47 116.55 124.75 2vg4 n ASP 268 Ca -0.06 0.25 -0.56 0.00 0.71 0.00 0.00 54.79 55.13 2vg4 n ASP 268 Cb 0.64 -0.70 -0.07 0.00 -0.02 0.00 0.00 41.12 40.97 2vg4 n ASP 268 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2vg4 n LYS 269 N -3.39 0.68 -1.91 -1.24 4.81 -1.26 -2.63 118.16 113.22 2vg4 n LYS 269 Ca -0.29 0.25 -0.32 0.00 -0.87 0.00 0.00 58.31 57.08 2vg4 n LYS 269 Cb 1.05 -1.84 0.02 0.00 0.02 0.00 0.00 35.03 34.29 2vg4 n LYS 269 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2vg4 s LEU 270 N 0.96 3.41 0.20 3.14 1.43 -1.26 -2.54 118.68 124.02 2vg4 s LEU 270 Ca 0.90 1.80 -0.10 0.00 -1.03 0.00 0.00 54.13 55.70 2vg4 s LEU 270 Cb -1.12 -4.53 0.24 0.00 0.03 0.00 0.00 46.19 40.81 2vg4 s LEU 270 CO 0.56 -1.29 1.77 -0.25 0.23 0.00 0.00 176.35 177.37 2vg4 h TRP 271 N 0.15 0.51 0.00 0.29 -0.00 -1.66 -2.10 115.95 113.14 2vg4 h TRP 271 Ca -0.46 0.03 0.00 0.00 -0.00 0.00 0.00 58.89 58.45 2vg4 h TRP 271 Cb 1.22 -0.14 0.00 0.00 -0.00 0.00 0.00 29.16 30.24 2vg4 h TRP 271 CO 0.59 0.20 0.00 -2.30 -0.00 0.00 0.00 178.44 176.92 2vg4 n PRO 272 N -4.91 0.03 -0.00 2.65 -0.02 -1.26 -0.85 135.00 130.65 2vg4 n PRO 272 Ca 0.08 0.27 0.08 0.00 -2.02 0.00 0.00 63.50 61.90 2vg4 n PRO 272 Cb 0.21 -1.50 -0.10 0.00 -0.02 0.00 0.00 33.50 32.09 2vg4 n PRO 272 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2vg4 n ASP 273 N -1.46 0.82 -4.73 2.55 9.92 -0.82 -4.88 116.55 117.95 2vg4 n ASP 273 Ca 0.04 -0.81 -0.41 0.00 -0.53 0.00 0.00 54.79 53.07 2vg4 n ASP 273 Cb 0.13 1.08 -0.03 0.00 -0.64 0.00 0.00 41.12 41.66 2vg4 n ASP 273 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 2vg4 s TYR 274 N -2.66 3.36 0.18 1.24 5.04 -0.03 -5.00 117.35 119.48 2vg4 s TYR 274 Ca 0.05 1.30 -0.02 0.00 -2.44 0.00 0.00 57.07 55.96 2vg4 s TYR 274 Cb 0.13 -3.51 -0.04 0.00 0.35 0.00 0.00 41.96 38.89 2vg4 s TYR 274 CO 0.70 -1.55 0.13 0.16 -1.34 0.00 0.00 175.55 173.66 2vg4 s ASP 275 N 0.42 0.18 0.30 4.32 1.47 -1.26 -4.85 116.67 117.24 2vg4 s ASP 275 Ca 0.56 -1.31 0.05 0.00 1.18 0.00 0.00 52.55 53.03 2vg4 s ASP 275 Cb -0.34 0.37 0.71 0.00 -0.34 0.00 0.00 42.92 43.32 2vg4 s ASP 275 CO 0.35 -0.83 1.78 0.08 0.68 0.00 0.00 175.17 177.23 2vg4 h ARG 276 N 2.66 0.73 -0.44 2.11 0.11 -1.92 0.56 114.38 118.20 2vg4 h ARG 276 Ca -0.35 -0.04 0.12 0.00 0.10 0.00 0.00 59.98 59.80 2vg4 h ARG 276 Cb 1.24 -0.17 -0.02 0.00 1.11 0.00 0.00 29.97 32.13 2vg4 h ARG 276 CO 0.54 0.49 0.31 0.00 0.10 0.00 0.00 179.97 181.40 2vg4 h ARG 277 N 0.76 0.05 -0.01 0.08 3.08 -1.96 0.20 114.38 116.57 2vg4 h ARG 277 Ca 0.56 -0.00 -0.17 0.00 0.07 0.00 0.00 59.98 60.44 2vg4 h ARG 277 Cb 0.86 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.88 2vg4 h ARG 277 CO -0.38 0.03 -0.78 -0.44 -1.07 0.00 0.00 179.97 177.34 2vg4 h ASP 278 N 0.05 0.14 0.28 7.04 3.32 -1.30 -1.90 116.42 124.05 2vg4 h ASP 278 Ca 0.21 -0.10 -0.08 0.00 0.02 0.00 0.00 57.03 57.07 2vg4 h ASP 278 Cb 0.77 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 2vg4 h ASP 278 CO -0.01 0.86 -0.35 0.25 -1.72 0.00 0.00 179.24 178.27 2vg4 h LEU 279 N 0.07 0.10 -0.48 1.55 5.85 -0.64 -2.49 115.31 119.27 2vg4 h LEU 279 Ca -0.02 -0.04 -0.16 0.00 0.84 0.00 0.00 57.88 58.50 2vg4 h LEU 279 Cb 1.36 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.35 2vg4 h LEU 279 CO 0.11 0.45 -0.75 -0.50 -0.34 0.00 0.00 178.44 177.41 2vg4 h TRP 280 N 0.09 0.13 0.29 1.25 6.55 -0.91 -2.91 115.95 120.44 2vg4 h TRP 280 Ca 0.01 -0.06 -0.01 0.00 0.95 0.00 0.00 58.89 59.77 2vg4 h TRP 280 Cb 0.66 -0.02 -0.00 0.00 -0.86 0.00 0.00 29.16 28.94 2vg4 h TRP 280 CO 0.00 0.81 -0.16 0.00 -1.05 0.00 0.00 178.44 178.05 2vg4 h ALA 281 N 1.17 -0.42 -0.52 1.49 0.00 -0.99 -2.79 119.26 117.20 2vg4 h ALA 281 Ca -0.02 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 54.91 2vg4 h ALA 281 Cb 1.33 0.18 -0.10 0.00 0.00 0.00 0.00 17.79 19.20 2vg4 h ALA 281 CO 0.11 -0.74 -0.11 0.00 0.00 0.00 0.00 179.25 178.51 2vg4 h ALA 282 N 0.28 0.37 0.00 0.00 0.00 -1.40 -2.10 119.26 116.41 2vg4 h ALA 282 Ca -0.04 0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2vg4 h ALA 282 Cb 0.33 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 2vg4 h ALA 282 CO 0.05 -0.43 -0.03 0.00 0.00 0.00 0.00 179.25 178.84 2vg4 h GLU 284 N 0.00 0.19 -0.20 0.00 5.08 -1.11 -1.77 114.58 116.77 2vg4 h GLU 284 Ca -0.00 -0.18 -0.13 0.00 -1.00 0.00 0.00 59.36 58.05 2vg4 h GLU 284 Cb 0.57 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2vg4 h GLU 284 CO 0.00 0.87 -0.40 1.49 -1.00 0.00 0.00 179.01 179.98 2vg4 h GLU 285 N 0.12 0.61 0.00 2.33 4.81 -0.94 -2.41 114.58 119.11 2vg4 h GLU 285 Ca -0.03 -0.40 -0.02 0.00 -0.13 0.00 0.00 59.36 58.79 2vg4 h GLU 285 Cb 1.35 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.78 2vg4 h GLU 285 CO 0.12 1.01 -0.09 -0.92 -0.73 0.00 0.00 179.01 178.41 2vg4 h TYR 286 N 0.29 0.00 -0.17 0.92 3.20 -1.33 -2.62 116.97 117.26 2vg4 h TYR 286 Ca 0.01 0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.74 2vg4 h TYR 286 Cb 1.00 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.26 2vg4 h TYR 286 CO 0.09 0.09 -0.47 0.00 -1.64 0.00 0.00 178.16 176.22 2vg4 h ALA 287 N 1.91 0.87 -0.00 1.82 0.00 -0.85 -3.07 119.26 119.95 2vg4 h ALA 287 Ca -0.00 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2vg4 h ALA 287 Cb 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2vg4 h ALA 287 CO 0.01 0.66 -0.16 -1.13 0.00 0.00 0.00 179.25 178.63 2vg4 n SER 288 N -3.98 0.20 -4.88 0.00 3.41 -0.96 -4.90 113.62 102.50 2vg4 n SER 288 Ca -0.02 0.11 -0.30 0.00 -0.26 0.00 0.00 58.87 58.41 2vg4 n SER 288 Cb 0.54 -0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 64.25 2vg4 n SER 288 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2vg4 s ARG 289 N -2.91 3.73 -0.27 4.33 0.52 -1.16 -5.07 118.95 118.12 2vg4 s ARG 289 Ca 0.16 0.33 -0.09 0.00 -0.52 0.00 0.00 55.73 55.61 2vg4 s ARG 289 Cb 0.19 -2.45 -0.03 0.00 0.52 0.00 0.00 34.95 33.18 2vg4 s ARG 289 CO 0.57 0.02 0.12 0.99 0.02 0.00 0.00 175.30 177.01 2vg4 s THR 290 N -2.32 4.61 -0.05 0.02 2.01 -1.26 -5.05 115.64 113.60 2vg4 s THR 290 Ca 0.49 -0.16 -0.05 0.00 0.31 0.00 0.00 61.69 62.28 2vg4 s THR 290 Cb -0.10 -3.22 -0.04 0.00 0.01 0.00 0.00 72.50 69.15 2vg4 s THR 290 CO 0.32 0.25 0.18 -0.13 -0.69 0.00 0.00 174.62 174.55 2vg4 s ARG 291 N 1.65 3.46 0.00 4.92 0.52 -1.26 -5.01 118.95 123.23 2vg4 s ARG 291 Ca 0.06 -0.20 0.00 0.00 -0.52 0.00 0.00 55.73 55.07 2vg4 s ARG 291 Cb -0.16 -3.13 0.00 0.00 0.52 0.00 0.00 34.95 32.18 2vg4 s ARG 291 CO 0.06 0.71 0.00 0.54 0.02 0.00 0.00 175.30 176.63 2vg4 n ARG 292 N 1.39 1.99 -3.67 3.54 1.74 -1.26 -5.05 116.66 115.34 2vg4 n ARG 292 Ca -0.15 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.72 2vg4 n ARG 292 Cb 0.54 -0.64 0.04 0.00 -1.02 0.00 0.00 32.46 31.37 2vg4 n ARG 292 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2vg4 n PHE 293 N -0.79 -1.94 -0.68 -1.55 3.72 -1.26 -1.13 117.46 113.83 2vg4 n PHE 293 Ca 0.00 0.84 0.00 0.00 -0.05 0.00 0.00 57.45 58.24 2vg4 n PHE 293 Cb 0.10 -4.44 0.00 0.00 -0.94 0.00 0.00 39.48 34.20 2vg4 n PHE 293 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2vg4 n GLY 294 N -1.53 1.48 3.81 1.37 0.00 -1.26 -5.02 105.19 104.04 2vg4 n GLY 294 Ca -0.30 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 2vg4 n GLY 294 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vg4 s SER 295 N -3.24 5.24 0.00 1.61 1.04 -0.28 -5.33 113.70 112.74 2vg4 s SER 295 Ca 0.00 1.66 0.00 0.00 0.48 0.00 0.00 55.95 58.09 2vg4 s SER 295 Cb 0.00 -2.50 0.00 0.00 0.10 0.00 0.00 66.02 63.62 2vg4 s SER 295 CO 0.00 -1.54 0.48 0.00 0.98 0.00 0.00 173.24 173.16