#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wh4 n LYS 3 N 0.00 0.00 0.00 0.00 3.00 -1.26 -5.13 118.16 114.77 2wh4 n LYS 3 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2wh4 n LYS 3 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 2wh4 n LYS 3 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 2wh4 n HIS 4 N 0.00 0.00 -1.56 5.64 8.25 -1.26 -4.71 115.22 121.58 2wh4 n HIS 4 Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.05 2wh4 n HIS 4 Cb 0.00 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.12 2wh4 n HIS 4 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2wh4 n PRO 5 N 0.00 1.09 -3.68 -0.41 -0.04 -1.26 -4.98 135.00 125.72 2wh4 n PRO 5 Ca 0.00 0.40 -0.14 0.00 -0.04 0.00 0.00 63.50 63.72 2wh4 n PRO 5 Cb 0.00 -1.88 -0.09 0.00 -0.04 0.00 0.00 33.50 31.49 2wh4 n PRO 5 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2wh4 s VAL 6 N -1.33 0.01 0.17 0.52 1.01 -1.26 -4.92 120.40 114.60 2wh4 s VAL 6 Ca 0.64 -0.04 -0.32 0.00 0.00 0.00 0.00 61.98 62.26 2wh4 s VAL 6 Cb -0.57 -0.76 -0.10 0.00 0.00 0.00 0.00 36.38 34.95 2wh4 s VAL 6 CO 0.57 -0.02 1.60 -2.16 0.00 0.00 0.00 175.10 175.08 2wh4 s PRO 7 N -0.00 4.20 0.44 2.72 0.04 -1.26 -4.86 135.00 136.28 2wh4 s PRO 7 Ca -0.02 2.40 0.24 0.00 0.04 0.00 0.00 61.00 63.66 2wh4 s PRO 7 Cb -0.04 -3.17 0.71 0.00 0.04 0.00 0.00 34.50 32.05 2wh4 s PRO 7 CO 0.02 -0.64 1.74 -0.22 0.04 0.00 0.00 177.00 177.94 2wh4 h LYS 8 N 6.89 0.00 -3.30 4.56 1.63 -2.03 -3.46 116.57 120.87 2wh4 h LYS 8 Ca -0.43 0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.25 2wh4 h LYS 8 Cb 1.20 0.00 -0.19 0.00 -0.60 0.00 0.00 32.23 32.64 2wh4 h LYS 8 CO 0.92 0.15 -0.36 0.15 -3.45 0.00 0.00 179.45 176.86 2wh4 s LYS 9 N -3.41 0.63 -0.38 1.90 -0.14 -1.26 -5.11 119.74 111.97 2wh4 s LYS 9 Ca 0.03 -0.37 -0.28 0.00 -1.36 0.00 0.00 55.97 53.99 2wh4 s LYS 9 Cb 0.08 0.27 -0.01 0.00 -1.68 0.00 0.00 37.83 36.49 2wh4 s LYS 9 CO 0.64 -0.17 1.65 0.21 -0.76 0.00 0.00 175.35 176.92 2wh4 s LYS 10 N -1.68 3.39 -0.02 1.68 2.20 -1.26 -4.93 119.74 119.12 2wh4 s LYS 10 Ca -0.12 1.20 -0.34 0.00 -0.36 0.00 0.00 55.97 56.35 2wh4 s LYS 10 Cb -0.05 -4.14 -0.12 0.00 -1.51 0.00 0.00 37.83 32.01 2wh4 s LYS 10 CO 0.01 -1.79 1.81 2.41 -0.36 0.00 0.00 175.35 177.43 2wh4 n THR 11 N 7.28 0.44 -1.90 3.43 -1.04 -1.26 -4.92 114.28 116.30 2wh4 n THR 11 Ca 0.20 -0.08 -0.35 0.00 -2.04 0.00 0.00 64.05 61.78 2wh4 n THR 11 Cb 0.47 -1.81 0.04 0.00 -1.82 0.00 0.00 70.33 67.22 2wh4 n THR 11 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2wh4 s SER 12 N 3.25 5.02 0.19 8.00 1.04 -1.26 -4.68 113.70 125.26 2wh4 s SER 12 Ca 0.89 2.36 -0.13 0.00 0.48 0.00 0.00 55.95 59.55 2wh4 s SER 12 Cb -0.67 -2.59 0.21 0.00 0.10 0.00 0.00 66.02 63.06 2wh4 s SER 12 CO 0.47 -1.71 1.69 0.11 0.98 0.00 0.00 173.24 174.78 2wh4 h LYS 13 N 0.63 0.13 -0.65 4.02 1.57 -1.98 0.53 116.57 120.83 2wh4 h LYS 13 Ca -0.50 -0.01 0.13 0.00 -1.87 0.00 0.00 60.65 58.41 2wh4 h LYS 13 Cb 1.29 -0.03 -0.10 0.00 0.08 0.00 0.00 32.23 33.48 2wh4 h LYS 13 CO 0.54 0.09 0.12 0.00 -0.57 0.00 0.00 179.45 179.63 2wh4 h ALA 14 N 1.45 0.77 0.00 3.86 0.00 -1.99 0.25 119.26 123.61 2wh4 h ALA 14 Ca 0.26 0.16 -0.21 0.00 0.00 0.00 0.00 54.91 55.12 2wh4 h ALA 14 Cb 0.40 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2wh4 h ALA 14 CO -0.42 -0.34 -0.90 -0.09 0.00 0.00 0.00 179.25 177.51 2wh4 h ARG 15 N 0.23 0.27 -0.32 0.00 2.43 -1.38 -2.47 114.38 113.13 2wh4 h ARG 15 Ca 0.35 -0.29 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2wh4 h ARG 15 Cb 0.56 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 2wh4 h ARG 15 CO -0.47 1.00 0.14 -0.09 -1.51 0.00 0.00 179.97 179.05 2wh4 h ARG 16 N 0.15 0.48 -0.28 0.20 2.43 0.13 -2.60 114.38 114.89 2wh4 h ARG 16 Ca -0.06 -0.08 -0.15 0.00 -0.81 0.00 0.00 59.98 58.89 2wh4 h ARG 16 Cb 1.53 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.99 2wh4 h ARG 16 CO 0.14 0.46 -0.42 -0.44 -1.51 0.00 0.00 179.97 178.21 2wh4 h ASP 17 N 0.38 0.73 -0.83 -3.80 3.32 -0.60 -2.97 116.42 112.65 2wh4 h ASP 17 Ca 0.11 -0.34 0.02 0.00 0.02 0.00 0.00 57.03 56.84 2wh4 h ASP 17 Cb 0.16 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.46 2wh4 h ASP 17 CO -0.01 1.05 0.55 0.00 -1.72 0.00 0.00 179.24 179.12 2wh4 h ALA 18 N 0.98 1.44 -0.15 3.45 0.00 -1.35 0.11 119.26 123.73 2wh4 h ALA 18 Ca 0.04 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2wh4 h ALA 18 Cb 0.95 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2wh4 h ALA 18 CO 0.09 0.50 -0.03 -0.09 0.00 0.00 0.00 179.25 179.72 2wh4 h ARG 19 N 1.09 0.22 0.00 0.00 2.43 -1.30 -2.48 114.38 114.33 2wh4 h ARG 19 Ca 0.32 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.45 2wh4 h ARG 19 Cb -0.06 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.45 2wh4 h ARG 19 CO -0.08 0.27 0.00 0.54 -1.51 0.00 0.00 179.97 179.19 2wh4 n ARG 20 N -4.38 0.18 -0.52 0.20 1.74 0.36 -4.20 116.66 110.05 2wh4 n ARG 20 Ca -0.01 0.20 0.43 0.00 -0.77 0.00 0.00 57.85 57.70 2wh4 n ARG 20 Cb 0.19 -1.73 0.74 0.00 -1.02 0.00 0.00 32.46 30.64 2wh4 n ARG 20 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2wh4 h SER 21 N 0.00 0.10 -0.36 0.55 4.64 -1.10 0.68 113.55 118.06 2wh4 h SER 21 Ca 0.00 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2wh4 h SER 21 Cb 0.60 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 2wh4 h SER 21 CO 0.00 -0.06 0.00 1.41 -0.87 0.00 0.00 176.83 177.31 2wh4 n HIS 22 N -4.28 0.84 0.41 4.77 8.25 -1.26 -4.03 115.22 119.92 2wh4 n HIS 22 Ca 0.37 -0.33 0.12 0.00 -0.26 0.00 0.00 57.72 57.62 2wh4 n HIS 22 Cb 1.61 -0.16 0.10 0.00 1.12 0.00 0.00 29.99 32.65 2wh4 n HIS 22 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2wh4 h HIS 23 N 2.28 0.00 -1.00 4.41 -0.00 0.07 -3.48 115.15 117.43 2wh4 h HIS 23 Ca 0.00 0.00 -0.83 0.00 -0.00 0.00 0.00 60.37 59.54 2wh4 h HIS 23 Cb 0.92 0.00 0.03 0.00 -0.00 0.00 0.00 27.41 28.36 2wh4 h HIS 23 CO 0.43 0.00 0.32 0.00 -0.00 0.00 0.00 177.93 178.68 2wh4 n ALA 24 N -1.95 -2.70 -1.79 2.45 0.00 -1.26 -4.89 120.51 110.38 2wh4 n ALA 24 Ca 0.02 0.56 -0.36 0.00 0.00 0.00 0.00 53.44 53.66 2wh4 n ALA 24 Cb 0.48 -1.82 -0.06 0.00 0.00 0.00 0.00 19.45 18.04 2wh4 n ALA 24 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2wh4 s LEU 25 N 1.25 4.24 -0.09 0.00 0.20 -1.26 -5.05 118.68 117.97 2wh4 s LEU 25 Ca 0.97 1.84 -0.04 0.00 0.69 0.00 0.00 54.13 57.59 2wh4 s LEU 25 Cb -1.36 -4.13 -0.04 0.00 -0.43 0.00 0.00 46.19 40.23 2wh4 s LEU 25 CO 0.67 -0.18 0.07 0.42 -0.29 0.00 0.00 176.35 177.05 2wh4 s THR 26 N -1.72 4.87 0.32 3.68 -4.23 -1.26 -5.08 115.64 112.22 2wh4 s THR 26 Ca 0.53 -0.07 -0.29 0.00 -1.18 0.00 0.00 61.69 60.68 2wh4 s THR 26 Cb -0.17 -3.10 -0.11 0.00 1.34 0.00 0.00 72.50 70.45 2wh4 s THR 26 CO 0.22 0.58 1.51 -2.16 -0.54 0.00 0.00 174.62 174.23 2wh4 s PRO 27 N -1.05 4.16 0.46 3.99 0.04 -1.26 -4.94 135.00 136.40 2wh4 s PRO 27 Ca 0.15 2.50 -0.25 0.00 0.04 0.00 0.00 61.00 63.45 2wh4 s PRO 27 Cb -0.12 -3.02 -0.08 0.00 0.04 0.00 0.00 34.50 31.32 2wh4 s PRO 27 CO 0.04 -0.52 1.43 -1.25 0.04 0.00 0.00 177.00 176.74 2wh4 s PRO 28 N -1.21 3.65 -0.19 0.56 0.04 -1.26 -4.94 135.00 131.65 2wh4 s PRO 28 Ca 0.57 2.43 -0.20 0.00 0.04 0.00 0.00 61.00 63.84 2wh4 s PRO 28 Cb -0.46 -2.64 -0.03 0.00 0.04 0.00 0.00 34.50 31.42 2wh4 s PRO 28 CO 0.54 -0.85 0.59 0.95 0.04 0.00 0.00 177.00 178.27 2wh4 s THR 29 N -1.20 5.05 0.21 1.26 -4.23 -1.26 -5.05 115.64 110.42 2wh4 s THR 29 Ca 0.62 1.12 0.05 0.00 -1.18 0.00 0.00 61.69 62.29 2wh4 s THR 29 Cb -0.44 -3.91 -0.05 0.00 1.34 0.00 0.00 72.50 69.44 2wh4 s THR 29 CO 0.56 0.14 -0.05 -0.76 -0.54 0.00 0.00 174.62 173.97 2wh4 s LEU 30 N 1.77 2.36 0.08 4.79 1.43 -1.26 -4.40 118.68 123.45 2wh4 s LEU 30 Ca 0.27 -1.14 -0.05 0.00 -1.03 0.00 0.00 54.13 52.19 2wh4 s LEU 30 Cb -0.16 -0.38 -0.02 0.00 0.03 0.00 0.00 46.19 45.66 2wh4 s LEU 30 CO 0.10 -0.40 0.09 0.68 0.23 0.00 0.00 176.35 177.05 2wh4 s VAL 31 N -3.29 0.17 0.50 -1.59 -7.23 0.11 -4.92 120.40 104.15 2wh4 s VAL 31 Ca 0.25 -1.52 -0.19 0.00 -1.81 0.00 0.00 61.98 58.70 2wh4 s VAL 31 Cb 0.04 -1.52 -0.08 0.00 0.56 0.00 0.00 36.38 35.39 2wh4 s VAL 31 CO 0.07 -0.75 1.03 -2.84 -0.31 0.00 0.00 175.10 172.29 2wh4 s PRO 32 N -3.91 3.77 0.20 4.82 0.02 -1.25 0.80 135.00 139.44 2wh4 s PRO 32 Ca 0.08 1.26 -0.23 0.00 0.02 0.00 0.00 61.00 62.13 2wh4 s PRO 32 Cb 0.06 -2.10 -0.08 0.00 0.02 0.00 0.00 34.50 32.40 2wh4 s PRO 32 CO -0.09 -0.44 0.76 0.00 -0.33 0.00 0.00 177.00 176.90 2wh4 h PRO 34 N 3.87 0.00 -0.42 0.00 0.11 -1.94 -2.97 132.00 130.66 2wh4 h PRO 34 Ca -0.47 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 2wh4 h PRO 34 Cb 1.20 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 2wh4 h PRO 34 CO 0.65 0.00 0.04 0.39 -0.21 0.00 0.00 178.00 178.87 2wh4 n GLU 35 N -2.75 3.44 0.00 1.05 -0.58 -1.26 -5.00 120.64 115.54 2wh4 n GLU 35 Ca 0.01 -2.99 0.00 0.00 -0.42 0.00 0.00 57.16 53.76 2wh4 n GLU 35 Cb 0.27 -2.01 0.00 0.00 -0.57 0.00 0.00 31.44 29.14 2wh4 n GLU 35 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wh4 h LYS 37 N 0.00 0.00 -0.50 0.00 2.10 -1.95 -2.83 116.57 113.39 2wh4 h LYS 37 Ca 0.00 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.59 2wh4 h LYS 37 Cb 0.00 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.34 2wh4 h LYS 37 CO 0.00 0.00 -0.04 0.00 -2.00 0.00 0.00 179.45 177.41 2wh4 n ALA 38 N -2.18 -1.12 -3.39 0.07 0.00 -1.26 -3.88 120.51 108.75 2wh4 n ALA 38 Ca -0.01 0.04 -0.45 0.00 0.00 0.00 0.00 53.44 53.02 2wh4 n ALA 38 Cb 0.24 -0.13 -0.04 0.00 0.00 0.00 0.00 19.45 19.52 2wh4 n ALA 38 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2wh4 s MET 39 N -0.08 3.25 0.46 0.00 -1.94 -1.26 0.10 119.30 119.84 2wh4 s MET 39 Ca 0.06 -2.23 -0.01 0.00 -1.71 0.00 0.00 55.69 51.80 2wh4 s MET 39 Cb -0.08 -4.28 -0.01 0.00 2.01 0.00 0.00 34.83 32.47 2wh4 s MET 39 CO 0.05 -1.28 0.70 0.15 -0.01 0.00 0.00 175.02 174.63 2wh4 s LYS 40 N 0.59 3.15 -0.36 2.03 1.02 0.24 -4.74 119.74 121.67 2wh4 s LYS 40 Ca 0.13 -0.32 -0.20 0.00 0.02 0.00 0.00 55.97 55.60 2wh4 s LYS 40 Cb -0.17 -2.51 0.00 0.00 -0.52 0.00 0.00 37.83 34.63 2wh4 s LYS 40 CO -0.05 -0.27 0.59 -2.14 -0.92 0.00 0.00 175.35 172.57 2wh4 s PRO 41 N -4.61 3.60 0.12 -1.68 0.02 -1.26 0.06 135.00 131.27 2wh4 s PRO 41 Ca 0.48 -0.08 -0.24 0.00 0.02 0.00 0.00 61.00 61.18 2wh4 s PRO 41 Cb -0.10 -3.83 -0.14 0.00 0.02 0.00 0.00 34.50 30.45 2wh4 s PRO 41 CO 0.39 -0.74 0.51 -0.35 -0.33 0.00 0.00 177.00 176.48 2wh4 n PRO 42 N 5.97 0.00 -2.22 5.54 -0.04 -1.26 -2.77 135.00 140.22 2wh4 n PRO 42 Ca -0.02 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.37 2wh4 n PRO 42 Cb 0.49 -0.88 0.00 0.00 -0.04 0.00 0.00 33.50 33.07 2wh4 n PRO 42 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2wh4 n HIS 43 N 0.25 -0.38 -3.98 0.54 8.25 -1.26 -5.04 115.22 113.61 2wh4 n HIS 43 Ca 0.15 0.04 -0.09 0.00 -0.26 0.00 0.00 57.72 57.57 2wh4 n HIS 43 Cb 0.17 -1.94 -0.08 0.00 1.12 0.00 0.00 29.99 29.25 2wh4 n HIS 43 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2wh4 s THR 44 N -2.43 0.14 -0.13 1.59 -4.23 -1.11 -5.15 115.64 104.32 2wh4 s THR 44 Ca 0.03 -1.49 -0.07 0.00 -1.18 0.00 0.00 61.69 58.98 2wh4 s THR 44 Cb -0.01 -1.58 -0.04 0.00 1.34 0.00 0.00 72.50 72.21 2wh4 s THR 44 CO 0.03 -0.66 0.12 -0.69 -0.54 0.00 0.00 174.62 172.89 2wh4 s VAL 45 N -3.92 5.38 -0.05 2.29 1.01 -1.26 -4.86 120.40 118.98 2wh4 s VAL 45 Ca 0.10 0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.26 2wh4 s VAL 45 Cb 0.06 -3.35 0.02 0.00 0.00 0.00 0.00 36.38 33.11 2wh4 s VAL 45 CO -0.07 0.59 -0.06 0.00 0.00 0.00 0.00 175.10 175.56 2wh4 n PRO 47 N 4.08 0.00 0.00 0.00 -0.04 -1.26 -3.39 135.00 134.39 2wh4 n PRO 47 Ca -0.23 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.23 2wh4 n PRO 47 Cb 0.51 -0.63 0.00 0.00 -0.04 0.00 0.00 33.50 33.34 2wh4 n PRO 47 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2wh4 n GLU 48 N 1.63 0.00 0.00 0.54 4.71 -1.26 -4.92 120.64 121.34 2wh4 n GLU 48 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 2wh4 n GLU 48 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.43 2wh4 n GLU 48 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2wh4 n GLY 50 N 0.69 0.00 0.00 0.00 0.00 -1.22 -4.73 105.19 99.93 2wh4 n GLY 50 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2wh4 n GLY 50 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2wh4 n TYR 51 N 0.00 0.00 -3.98 1.61 4.19 -1.26 -4.15 117.16 113.57 2wh4 n TYR 51 Ca 0.00 0.00 -0.35 0.00 3.31 0.00 0.00 57.90 60.86 2wh4 n TYR 51 Cb 0.00 0.00 -0.09 0.00 0.49 0.00 0.00 39.34 39.74 2wh4 n TYR 51 CO 0.00 0.00 0.00 1.52 0.91 0.00 0.00 176.86 179.29 2wh4 s TYR 52 N -2.05 3.28 -1.61 2.98 -0.85 -1.26 -4.17 117.35 113.66 2wh4 s TYR 52 Ca 0.00 0.12 -0.15 0.00 -0.52 0.00 0.00 57.07 56.52 2wh4 s TYR 52 Cb 0.00 -2.07 0.12 0.00 0.38 0.00 0.00 41.96 40.39 2wh4 s TYR 52 CO 0.00 0.20 0.82 0.00 -1.52 0.00 0.00 175.55 175.06 2wh4 n ALA 53 N 3.42 -1.35 -2.55 9.51 0.00 -1.26 -4.92 120.51 123.36 2wh4 n ALA 53 Ca -0.17 0.04 -0.26 0.00 0.00 0.00 0.00 53.44 53.05 2wh4 n ALA 53 Cb 0.52 -3.62 -0.09 0.00 0.00 0.00 0.00 19.45 16.26 2wh4 n ALA 53 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2wh4 s GLY 54 N -3.42 2.56 0.44 0.00 0.00 -1.26 -5.16 107.32 100.48 2wh4 s GLY 54 Ca 0.63 -1.30 0.03 0.00 0.00 0.00 0.00 44.72 44.08 2wh4 s GLY 54 CO 0.89 -1.91 0.63 -1.60 0.00 0.00 0.00 173.10 171.11 2wh4 s ARG 55 N -3.78 2.93 0.00 2.90 6.06 -1.26 -4.80 118.95 121.00 2wh4 s ARG 55 Ca 0.24 -0.79 0.00 0.00 -2.50 0.00 0.00 55.73 52.67 2wh4 s ARG 55 Cb 0.04 -2.64 0.00 0.00 0.06 0.00 0.00 34.95 32.41 2wh4 s ARG 55 CO 0.13 -0.28 0.00 0.36 -2.50 0.00 0.00 175.30 173.01 2wh4 n LYS 56 N -1.99 -0.18 0.00 5.12 0.00 -1.26 -4.41 118.16 115.45 2wh4 n LYS 56 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.34 2wh4 n LYS 56 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.61 2wh4 n LYS 56 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 2wh4 n VAL 57 N 4.33 0.00 -2.74 0.58 0.24 -1.26 -5.04 118.33 114.44 2wh4 n VAL 57 Ca 0.00 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 62.07 2wh4 n VAL 57 Cb 0.00 -0.35 0.03 0.00 -1.47 0.00 0.00 33.84 32.04 2wh4 n VAL 57 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2wh4 s LEU 58 N 0.00 3.42 0.00 1.34 0.20 -1.26 -5.09 118.68 117.29 2wh4 s LEU 58 Ca 0.00 0.28 0.00 0.00 0.69 0.00 0.00 54.13 55.10 2wh4 s LEU 58 Cb 0.00 -3.14 0.00 0.00 -0.43 0.00 0.00 46.19 42.62 2wh4 s LEU 58 CO 0.00 -0.94 0.00 -0.62 -0.29 0.00 0.00 176.35 174.50 2wh4 n GLU 59 N -2.29 0.00 0.00 1.98 1.02 -1.26 -5.12 120.64 114.97 2wh4 n GLU 59 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 2wh4 n GLU 59 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.00 2wh4 n GLU 59 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59