#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wh2 n LYS 3 N 0.00 0.00 0.00 0.00 3.00 -1.26 -5.13 118.16 114.77 2wh2 n LYS 3 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2wh2 n LYS 3 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 2wh2 n LYS 3 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 2wh2 n HIS 4 N 0.00 0.00 -1.58 5.64 8.25 -1.26 -4.69 115.22 121.57 2wh2 n HIS 4 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 2wh2 n HIS 4 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2wh2 n HIS 4 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2wh2 n PRO 5 N 0.00 1.25 -3.69 -0.41 -0.04 -1.26 -4.98 135.00 125.87 2wh2 n PRO 5 Ca 0.00 0.45 -0.14 0.00 -0.04 0.00 0.00 63.50 63.77 2wh2 n PRO 5 Cb 0.00 -1.92 -0.09 0.00 -0.04 0.00 0.00 33.50 31.45 2wh2 n PRO 5 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2wh2 s VAL 6 N -1.25 0.01 0.19 0.52 1.01 -1.26 -4.91 120.40 114.71 2wh2 s VAL 6 Ca 0.62 -0.06 -0.31 0.00 0.00 0.00 0.00 61.98 62.23 2wh2 s VAL 6 Cb -0.60 -0.72 -0.10 0.00 0.00 0.00 0.00 36.38 34.96 2wh2 s VAL 6 CO 0.58 -0.03 1.54 -2.16 0.00 0.00 0.00 175.10 175.02 2wh2 s PRO 7 N -0.08 4.22 0.39 2.72 0.04 -1.26 -4.87 135.00 136.16 2wh2 s PRO 7 Ca -0.03 2.36 0.21 0.00 0.04 0.00 0.00 61.00 63.58 2wh2 s PRO 7 Cb -0.03 -3.13 0.38 0.00 0.04 0.00 0.00 34.50 31.75 2wh2 s PRO 7 CO 0.02 -0.57 1.60 -0.22 0.04 0.00 0.00 177.00 177.88 2wh2 h LYS 8 N 6.27 0.00 -3.40 4.56 1.63 -2.03 -3.46 116.57 120.14 2wh2 h LYS 8 Ca -0.44 0.00 -0.14 0.00 -0.85 0.00 0.00 60.65 59.22 2wh2 h LYS 8 Cb 1.21 0.00 -0.21 0.00 -0.60 0.00 0.00 32.23 32.63 2wh2 h LYS 8 CO 0.88 0.21 -0.44 0.15 -3.45 0.00 0.00 179.45 176.80 2wh2 s LYS 9 N -3.20 0.51 -0.38 1.90 -0.14 -1.26 -5.11 119.74 112.06 2wh2 s LYS 9 Ca 0.05 -0.33 -0.28 0.00 -1.36 0.00 0.00 55.97 54.05 2wh2 s LYS 9 Cb 0.07 0.22 -0.01 0.00 -1.68 0.00 0.00 37.83 36.42 2wh2 s LYS 9 CO 0.68 -0.13 1.72 0.21 -0.76 0.00 0.00 175.35 177.08 2wh2 s LYS 10 N -1.31 3.31 -0.07 1.68 2.20 -1.26 -4.92 119.74 119.37 2wh2 s LYS 10 Ca -0.14 1.23 -0.35 0.00 -0.36 0.00 0.00 55.97 56.35 2wh2 s LYS 10 Cb -0.07 -4.18 -0.13 0.00 -1.51 0.00 0.00 37.83 31.94 2wh2 s LYS 10 CO 0.02 -1.89 1.79 2.41 -0.36 0.00 0.00 175.35 177.33 2wh2 n THR 11 N 7.32 0.43 -1.79 3.43 -1.04 -1.26 -4.91 114.28 116.45 2wh2 n THR 11 Ca 0.21 -0.08 -0.35 0.00 -2.04 0.00 0.00 64.05 61.79 2wh2 n THR 11 Cb 0.48 -1.68 0.05 0.00 -1.82 0.00 0.00 70.33 67.36 2wh2 n THR 11 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2wh2 s SER 12 N 3.36 4.85 0.18 8.00 1.04 -1.26 -4.68 113.70 125.18 2wh2 s SER 12 Ca 0.91 2.34 -0.16 0.00 0.48 0.00 0.00 55.95 59.53 2wh2 s SER 12 Cb -0.76 -2.59 0.13 0.00 0.10 0.00 0.00 66.02 62.90 2wh2 s SER 12 CO 0.51 -1.82 1.67 0.11 0.98 0.00 0.00 173.24 174.69 2wh2 h LYS 13 N 0.41 0.03 -0.71 4.02 1.57 -1.98 0.45 116.57 120.36 2wh2 h LYS 13 Ca -0.49 -0.00 0.15 0.00 -1.87 0.00 0.00 60.65 58.43 2wh2 h LYS 13 Cb 1.29 -0.01 -0.10 0.00 0.08 0.00 0.00 32.23 33.49 2wh2 h LYS 13 CO 0.53 0.02 0.18 0.00 -0.57 0.00 0.00 179.45 179.61 2wh2 h ALA 14 N 1.44 0.91 0.02 3.86 0.00 -2.00 0.18 119.26 123.66 2wh2 h ALA 14 Ca 0.22 0.15 -0.20 0.00 0.00 0.00 0.00 54.91 55.08 2wh2 h ALA 14 Cb 0.33 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2wh2 h ALA 14 CO -0.44 -0.32 -0.92 -0.09 0.00 0.00 0.00 179.25 177.49 2wh2 h ARG 15 N 0.29 0.15 -0.18 0.00 2.43 -1.42 -2.57 114.38 113.09 2wh2 h ARG 15 Ca 0.39 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.37 2wh2 h ARG 15 Cb 0.64 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.24 2wh2 h ARG 15 CO -0.47 0.97 0.07 -0.09 -1.51 0.00 0.00 179.97 178.93 2wh2 h ARG 16 N 0.08 0.26 -0.33 0.20 2.43 0.13 -2.61 114.38 114.54 2wh2 h ARG 16 Ca -0.04 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 58.94 2wh2 h ARG 16 Cb 1.58 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 31.07 2wh2 h ARG 16 CO 0.14 0.34 -0.35 -0.44 -1.51 0.00 0.00 179.97 178.15 2wh2 h ASP 17 N 0.13 0.78 -0.88 -3.80 3.32 -0.78 -2.97 116.42 112.22 2wh2 h ASP 17 Ca 0.06 -0.33 0.03 0.00 0.02 0.00 0.00 57.03 56.81 2wh2 h ASP 17 Cb 0.18 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 39.46 2wh2 h ASP 17 CO -0.00 1.05 0.58 0.00 -1.72 0.00 0.00 179.24 179.15 2wh2 h ALA 18 N 0.99 1.44 -0.06 3.45 0.00 -1.39 0.22 119.26 123.90 2wh2 h ALA 18 Ca 0.06 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2wh2 h ALA 18 Cb 0.88 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2wh2 h ALA 18 CO 0.08 0.49 -0.11 -0.09 0.00 0.00 0.00 179.25 179.61 2wh2 h ARG 19 N 1.11 0.09 0.00 0.00 2.43 -1.31 -2.52 114.38 114.19 2wh2 h ARG 19 Ca 0.34 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.50 2wh2 h ARG 19 Cb -0.01 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 2wh2 h ARG 19 CO -0.10 0.21 0.00 0.54 -1.51 0.00 0.00 179.97 179.12 2wh2 n ARG 20 N -4.35 0.20 -0.56 0.20 1.74 0.73 -4.22 116.66 110.40 2wh2 n ARG 20 Ca -0.02 0.21 0.45 0.00 -0.77 0.00 0.00 57.85 57.72 2wh2 n ARG 20 Cb 0.22 -1.76 0.75 0.00 -1.02 0.00 0.00 32.46 30.65 2wh2 n ARG 20 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2wh2 h SER 21 N 0.00 0.09 -0.39 0.55 4.64 -1.08 0.66 113.55 118.02 2wh2 h SER 21 Ca 0.00 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2wh2 h SER 21 Cb 0.64 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2wh2 h SER 21 CO 0.00 -0.06 0.00 1.41 -0.87 0.00 0.00 176.83 177.31 2wh2 n HIS 22 N -4.24 0.90 0.40 4.77 8.25 -1.26 -4.03 115.22 120.01 2wh2 n HIS 22 Ca 0.39 -0.36 0.12 0.00 -0.26 0.00 0.00 57.72 57.61 2wh2 n HIS 22 Cb 1.69 -0.17 0.09 0.00 1.12 0.00 0.00 29.99 32.72 2wh2 n HIS 22 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2wh2 h HIS 23 N 2.43 0.00 -0.98 4.41 -0.00 0.04 -3.47 115.15 117.58 2wh2 h HIS 23 Ca 0.00 0.00 -0.82 0.00 -0.00 0.00 0.00 60.37 59.55 2wh2 h HIS 23 Cb 0.98 0.00 0.03 0.00 -0.00 0.00 0.00 27.41 28.42 2wh2 h HIS 23 CO 0.47 0.00 0.37 0.00 -0.00 0.00 0.00 177.93 178.76 2wh2 n ALA 24 N -1.96 -2.47 -1.78 2.45 0.00 -1.26 -4.88 120.51 110.61 2wh2 n ALA 24 Ca 0.02 0.54 -0.37 0.00 0.00 0.00 0.00 53.44 53.63 2wh2 n ALA 24 Cb 0.48 -1.81 -0.06 0.00 0.00 0.00 0.00 19.45 18.07 2wh2 n ALA 24 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2wh2 s LEU 25 N 1.47 4.31 -0.09 0.00 0.20 -1.26 -5.05 118.68 118.26 2wh2 s LEU 25 Ca 0.96 1.91 -0.05 0.00 0.69 0.00 0.00 54.13 57.65 2wh2 s LEU 25 Cb -1.36 -4.02 -0.04 0.00 -0.43 0.00 0.00 46.19 40.34 2wh2 s LEU 25 CO 0.68 -0.16 0.09 0.42 -0.29 0.00 0.00 176.35 177.09 2wh2 s THR 26 N -1.59 5.02 0.32 3.68 -4.23 -1.26 -5.08 115.64 112.51 2wh2 s THR 26 Ca 0.51 -0.01 -0.29 0.00 -1.18 0.00 0.00 61.69 60.72 2wh2 s THR 26 Cb -0.20 -3.18 -0.11 0.00 1.34 0.00 0.00 72.50 70.35 2wh2 s THR 26 CO 0.26 0.58 1.51 -2.16 -0.54 0.00 0.00 174.62 174.28 2wh2 s PRO 27 N -1.07 4.16 0.45 3.99 0.04 -1.26 -4.94 135.00 136.37 2wh2 s PRO 27 Ca 0.15 2.51 -0.25 0.00 0.04 0.00 0.00 61.00 63.45 2wh2 s PRO 27 Cb -0.12 -3.02 -0.08 0.00 0.04 0.00 0.00 34.50 31.32 2wh2 s PRO 27 CO 0.05 -0.53 1.45 -1.25 0.04 0.00 0.00 177.00 176.75 2wh2 s PRO 28 N -1.14 3.70 -0.19 0.56 0.04 -1.26 -4.93 135.00 131.78 2wh2 s PRO 28 Ca 0.58 2.46 -0.20 0.00 0.04 0.00 0.00 61.00 63.88 2wh2 s PRO 28 Cb -0.46 -2.68 -0.03 0.00 0.04 0.00 0.00 34.50 31.38 2wh2 s PRO 28 CO 0.53 -0.82 0.60 0.95 0.04 0.00 0.00 177.00 178.30 2wh2 s THR 29 N -1.19 5.05 0.21 1.26 -4.23 -1.26 -5.05 115.64 110.43 2wh2 s THR 29 Ca 0.61 1.15 0.04 0.00 -1.18 0.00 0.00 61.69 62.30 2wh2 s THR 29 Cb -0.45 -3.92 -0.05 0.00 1.34 0.00 0.00 72.50 69.42 2wh2 s THR 29 CO 0.58 0.14 -0.04 -0.76 -0.54 0.00 0.00 174.62 174.00 2wh2 s LEU 30 N 1.72 2.31 0.07 4.79 1.43 -1.26 -4.42 118.68 123.32 2wh2 s LEU 30 Ca 0.28 -1.16 -0.06 0.00 -1.03 0.00 0.00 54.13 52.17 2wh2 s LEU 30 Cb -0.16 -0.33 -0.02 0.00 0.03 0.00 0.00 46.19 45.72 2wh2 s LEU 30 CO 0.11 -0.44 0.10 0.68 0.23 0.00 0.00 176.35 177.02 2wh2 s VAL 31 N -3.35 0.17 0.51 -1.59 -7.23 0.11 -4.92 120.40 104.10 2wh2 s VAL 31 Ca 0.25 -1.43 -0.20 0.00 -1.81 0.00 0.00 61.98 58.79 2wh2 s VAL 31 Cb 0.04 -1.41 -0.07 0.00 0.56 0.00 0.00 36.38 35.50 2wh2 s VAL 31 CO 0.07 -0.79 1.06 -2.84 -0.31 0.00 0.00 175.10 172.28 2wh2 s PRO 32 N -3.89 3.67 0.21 4.82 0.02 -1.25 0.91 135.00 139.49 2wh2 s PRO 32 Ca 0.06 1.38 -0.22 0.00 0.02 0.00 0.00 61.00 62.24 2wh2 s PRO 32 Cb 0.06 -2.07 -0.08 0.00 0.02 0.00 0.00 34.50 32.43 2wh2 s PRO 32 CO -0.11 -0.55 0.76 0.00 -0.33 0.00 0.00 177.00 176.78 2wh2 h PRO 34 N 3.75 0.00 -0.42 0.00 0.11 -1.94 -2.96 132.00 130.54 2wh2 h PRO 34 Ca -0.48 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 2wh2 h PRO 34 Cb 1.20 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 2wh2 h PRO 34 CO 0.65 0.00 0.04 0.39 -0.21 0.00 0.00 178.00 178.87 2wh2 n GLU 35 N -2.80 3.41 0.00 1.05 -0.58 -1.26 -5.00 120.64 115.46 2wh2 n GLU 35 Ca 0.01 -2.99 0.00 0.00 -0.42 0.00 0.00 57.16 53.76 2wh2 n GLU 35 Cb 0.27 -2.00 0.00 0.00 -0.57 0.00 0.00 31.44 29.14 2wh2 n GLU 35 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wh2 h LYS 37 N 0.00 0.00 -0.87 0.00 2.10 -1.95 -2.79 116.57 113.06 2wh2 h LYS 37 Ca 0.00 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.55 2wh2 h LYS 37 Cb 0.00 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.35 2wh2 h LYS 37 CO 0.00 0.00 -0.07 0.00 -2.00 0.00 0.00 179.45 177.38 2wh2 n ALA 38 N -2.13 -1.24 -3.38 0.07 0.00 -1.26 -3.89 120.51 108.67 2wh2 n ALA 38 Ca -0.00 0.07 -0.45 0.00 0.00 0.00 0.00 53.44 53.05 2wh2 n ALA 38 Cb 0.29 -0.24 -0.04 0.00 0.00 0.00 0.00 19.45 19.46 2wh2 n ALA 38 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2wh2 s MET 39 N -0.13 3.18 0.40 0.00 -1.94 -1.26 0.12 119.30 119.67 2wh2 s MET 39 Ca 0.10 -2.13 0.00 0.00 -1.71 0.00 0.00 55.69 51.95 2wh2 s MET 39 Cb -0.14 -4.27 -0.02 0.00 2.01 0.00 0.00 34.83 32.41 2wh2 s MET 39 CO 0.08 -1.28 0.61 0.15 -0.01 0.00 0.00 175.02 174.57 2wh2 s LYS 40 N 0.78 3.29 -0.38 2.03 1.02 0.26 -4.75 119.74 122.00 2wh2 s LYS 40 Ca 0.11 -0.39 -0.21 0.00 0.02 0.00 0.00 55.97 55.50 2wh2 s LYS 40 Cb -0.20 -2.60 0.01 0.00 -0.52 0.00 0.00 37.83 34.52 2wh2 s LYS 40 CO -0.03 -0.06 0.66 -2.14 -0.92 0.00 0.00 175.35 172.86 2wh2 s PRO 41 N -4.44 3.59 0.13 -1.68 0.02 -1.26 0.10 135.00 131.45 2wh2 s PRO 41 Ca 0.44 -0.02 -0.23 0.00 0.02 0.00 0.00 61.00 61.22 2wh2 s PRO 41 Cb -0.10 -3.85 -0.13 0.00 0.02 0.00 0.00 34.50 30.44 2wh2 s PRO 41 CO 0.37 -0.83 0.46 -0.35 -0.33 0.00 0.00 177.00 176.32 2wh2 n PRO 42 N 6.17 0.00 -2.16 5.54 -0.04 -1.26 -2.62 135.00 140.62 2wh2 n PRO 42 Ca -0.01 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.38 2wh2 n PRO 42 Cb 0.48 -0.82 -0.00 0.00 -0.04 0.00 0.00 33.50 33.12 2wh2 n PRO 42 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2wh2 n HIS 43 N 0.17 -0.36 -3.99 0.54 8.25 -1.26 -5.03 115.22 113.53 2wh2 n HIS 43 Ca 0.14 0.01 -0.08 0.00 -0.26 0.00 0.00 57.72 57.53 2wh2 n HIS 43 Cb 0.17 -2.03 -0.09 0.00 1.12 0.00 0.00 29.99 29.16 2wh2 n HIS 43 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2wh2 s THR 44 N -2.38 0.18 -0.12 1.59 -4.23 -1.08 -5.15 115.64 104.45 2wh2 s THR 44 Ca 0.01 -1.51 -0.08 0.00 -1.18 0.00 0.00 61.69 58.93 2wh2 s THR 44 Cb -0.00 -1.38 -0.04 0.00 1.34 0.00 0.00 72.50 72.41 2wh2 s THR 44 CO 0.01 -0.83 0.16 -0.69 -0.54 0.00 0.00 174.62 172.72 2wh2 s VAL 45 N -3.75 5.48 -0.05 2.29 1.01 -1.26 -4.84 120.40 119.28 2wh2 s VAL 45 Ca 0.05 0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.29 2wh2 s VAL 45 Cb 0.06 -3.42 0.02 0.00 0.00 0.00 0.00 36.38 33.04 2wh2 s VAL 45 CO -0.10 0.61 -0.05 0.00 0.00 0.00 0.00 175.10 175.56 2wh2 n PRO 47 N 4.06 0.00 0.00 0.00 -0.04 -1.26 -3.46 135.00 134.30 2wh2 n PRO 47 Ca -0.24 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.22 2wh2 n PRO 47 Cb 0.51 -0.65 0.00 0.00 -0.04 0.00 0.00 33.50 33.32 2wh2 n PRO 47 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2wh2 n GLU 48 N 1.67 0.00 0.00 0.54 4.71 -1.26 -4.92 120.64 121.38 2wh2 n GLU 48 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 2wh2 n GLU 48 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.43 2wh2 n GLU 48 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2wh2 n GLY 50 N 0.77 0.00 0.00 0.00 0.00 -1.22 -4.73 105.19 100.01 2wh2 n GLY 50 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2wh2 n GLY 50 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2wh2 n TYR 51 N 0.00 0.00 -3.99 1.61 4.19 -1.26 -4.14 117.16 113.58 2wh2 n TYR 51 Ca 0.00 0.00 -0.35 0.00 3.31 0.00 0.00 57.90 60.86 2wh2 n TYR 51 Cb 0.00 0.00 -0.09 0.00 0.49 0.00 0.00 39.34 39.74 2wh2 n TYR 51 CO 0.00 0.00 0.00 1.52 0.91 0.00 0.00 176.86 179.29 2wh2 s TYR 52 N -2.02 3.28 -1.60 2.98 -0.85 -1.26 -4.18 117.35 113.69 2wh2 s TYR 52 Ca 0.00 0.11 -0.15 0.00 -0.52 0.00 0.00 57.07 56.52 2wh2 s TYR 52 Cb 0.00 -2.07 0.11 0.00 0.38 0.00 0.00 41.96 40.38 2wh2 s TYR 52 CO 0.00 0.20 0.84 0.00 -1.52 0.00 0.00 175.55 175.06 2wh2 n ALA 53 N 3.44 -1.36 -2.53 9.51 0.00 -1.26 -4.92 120.51 123.40 2wh2 n ALA 53 Ca -0.17 0.05 -0.25 0.00 0.00 0.00 0.00 53.44 53.07 2wh2 n ALA 53 Cb 0.52 -3.69 -0.09 0.00 0.00 0.00 0.00 19.45 16.19 2wh2 n ALA 53 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2wh2 s GLY 54 N -3.42 2.47 0.48 0.00 0.00 -1.26 -5.16 107.32 100.43 2wh2 s GLY 54 Ca 0.63 -1.45 0.02 0.00 0.00 0.00 0.00 44.72 43.92 2wh2 s GLY 54 CO 0.88 -1.88 0.69 -1.60 0.00 0.00 0.00 173.10 171.19 2wh2 s ARG 55 N -3.80 2.84 0.00 2.90 6.06 -1.26 -4.79 118.95 120.90 2wh2 s ARG 55 Ca 0.26 -0.69 0.00 0.00 -2.50 0.00 0.00 55.73 52.80 2wh2 s ARG 55 Cb 0.05 -2.56 0.00 0.00 0.06 0.00 0.00 34.95 32.50 2wh2 s ARG 55 CO 0.13 -0.43 0.00 0.36 -2.50 0.00 0.00 175.30 172.87 2wh2 n LYS 56 N -2.14 -0.28 0.00 5.12 0.00 -1.26 -4.40 118.16 115.20 2wh2 n LYS 56 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.35 2wh2 n LYS 56 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.62 2wh2 n LYS 56 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 2wh2 n VAL 57 N 4.38 0.00 -2.82 0.58 0.24 -1.26 -5.04 118.33 114.41 2wh2 n VAL 57 Ca 0.00 0.00 -0.24 0.00 -2.04 0.00 0.00 64.34 62.06 2wh2 n VAL 57 Cb 0.00 -0.23 0.02 0.00 -1.47 0.00 0.00 33.84 32.15 2wh2 n VAL 57 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2wh2 s LEU 58 N 0.00 3.52 0.00 1.34 0.20 -1.26 -5.09 118.68 117.40 2wh2 s LEU 58 Ca 0.00 0.35 0.00 0.00 0.69 0.00 0.00 54.13 55.17 2wh2 s LEU 58 Cb 0.00 -3.22 0.00 0.00 -0.43 0.00 0.00 46.19 42.54 2wh2 s LEU 58 CO 0.00 -0.82 0.00 -0.62 -0.29 0.00 0.00 176.35 174.62 2wh2 n GLU 59 N -2.21 0.00 0.00 1.98 1.02 -1.26 -5.12 120.64 115.05 2wh2 n GLU 59 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 2wh2 n GLU 59 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.00 2wh2 n GLU 59 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59