#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wgo s SER 2 N 0.00 0.89 -0.15 1.61 0.15 -1.26 -5.02 113.70 109.92 1wgo s SER 2 Ca 0.00 -0.07 -0.06 0.00 0.70 0.00 0.00 55.95 56.52 1wgo s SER 2 Cb 0.00 0.73 -0.07 0.00 -1.71 0.00 0.00 66.02 64.96 1wgo s SER 2 CO 0.00 -0.32 -0.18 -0.24 1.20 0.00 0.00 173.24 173.70 1wgo n SER 3 N 5.34 1.51 -3.59 5.45 2.88 -1.26 -5.03 113.62 118.92 1wgo n SER 3 Ca -0.04 0.12 -0.11 0.00 -1.33 0.00 0.00 58.87 57.52 1wgo n SER 3 Cb 0.50 -0.40 -0.03 0.00 -0.75 0.00 0.00 64.21 63.53 1wgo n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wgo s GLY 4 N -5.31 -0.37 -0.08 0.46 0.00 -1.26 -5.06 107.32 95.70 1wgo s GLY 4 Ca -0.21 0.13 -0.17 0.00 0.00 0.00 0.00 44.72 44.47 1wgo s GLY 4 CO 0.28 -0.06 0.65 1.76 0.00 0.00 0.00 173.10 175.74 1wgo h SER 5 N 2.12 0.43 -3.59 1.64 0.02 -2.04 -3.46 113.55 108.67 1wgo h SER 5 Ca -0.31 -0.88 -0.68 0.00 -0.84 0.00 0.00 61.79 59.08 1wgo h SER 5 Cb 1.28 -0.14 -0.19 0.00 0.14 0.00 0.00 62.40 63.50 1wgo h SER 5 CO 0.38 1.58 -0.68 -0.94 -1.14 0.00 0.00 176.83 176.03 1wgo s SER 6 N -7.05 4.74 -0.20 3.07 1.04 -1.26 -5.11 113.70 108.93 1wgo s SER 6 Ca -0.18 -0.00 -0.07 0.00 0.48 0.00 0.00 55.95 56.18 1wgo s SER 6 Cb 0.04 -1.25 0.10 0.00 0.10 0.00 0.00 66.02 65.00 1wgo s SER 6 CO 0.79 0.35 0.42 -0.83 0.98 0.00 0.00 173.24 174.96 1wgo s GLY 7 N -0.75 -0.38 -0.23 7.32 0.00 -1.26 -5.03 107.32 106.99 1wgo s GLY 7 Ca 0.11 1.50 0.00 0.00 0.00 0.00 0.00 44.72 46.33 1wgo s GLY 7 CO 0.02 2.45 -0.21 0.00 0.00 0.00 0.00 173.10 175.36 1wgo n GLU 9 N -3.24 0.36 -3.76 0.00 0.00 -1.26 -4.96 120.64 107.77 1wgo n GLU 9 Ca -0.41 0.13 0.03 0.00 0.00 0.00 0.00 57.16 56.91 1wgo n GLU 9 Cb 0.92 -1.33 0.00 0.00 0.00 0.00 0.00 31.44 31.03 1wgo n GLU 9 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 1wgo s GLY 10 N -0.98 -0.32 0.00 8.31 0.00 -1.26 -5.19 107.32 107.88 1wgo s GLY 10 Ca 0.62 0.48 0.00 0.00 0.00 0.00 0.00 44.72 45.83 1wgo s GLY 10 CO 0.59 2.47 0.00 0.61 0.00 0.00 0.00 173.10 176.78 1wgo n GLY 11 N -0.67 -0.56 3.59 0.20 0.00 -1.26 -5.16 105.19 101.34 1wgo n GLY 11 Ca -0.04 -1.57 -0.11 0.00 0.00 0.00 0.00 46.02 44.31 1wgo n GLY 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wgo s VAL 12 N -2.20 0.00 0.70 1.61 0.11 -1.26 -5.17 120.40 114.19 1wgo s VAL 12 Ca 0.00 0.00 -0.11 0.00 -2.93 0.00 0.00 61.98 58.94 1wgo s VAL 12 Cb 0.00 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.86 1wgo s VAL 12 CO 0.00 0.00 1.08 1.51 -3.33 0.00 0.00 175.10 174.36 1wgo s ASP 13 N -0.68 5.45 1.07 3.54 1.47 -1.26 -5.05 116.67 121.21 1wgo s ASP 13 Ca -0.01 1.24 -0.13 0.00 1.18 0.00 0.00 52.55 54.83 1wgo s ASP 13 Cb -0.02 -2.08 0.23 0.00 -0.34 0.00 0.00 42.92 40.71 1wgo s ASP 13 CO -0.00 -1.35 1.07 0.00 0.68 0.00 0.00 175.17 175.56 1wgo s MET 14 N -5.28 -0.17 0.20 2.11 0.23 -1.26 -5.07 119.30 110.06 1wgo s MET 14 Ca 0.58 0.61 0.09 0.00 -1.03 0.00 0.00 55.69 55.94 1wgo s MET 14 Cb -0.12 -1.66 -0.05 0.00 -1.53 0.00 0.00 34.83 31.48 1wgo s MET 14 CO 0.53 -3.16 -0.16 -0.65 -2.03 0.00 0.00 175.02 169.54 1wgo s GLN 15 N -4.78 1.36 -0.18 3.16 -1.52 -1.26 -5.15 119.66 111.30 1wgo s GLN 15 Ca 0.67 -1.56 -0.29 0.00 -1.95 0.00 0.00 55.36 52.23 1wgo s GLN 15 Cb -0.21 -1.29 0.11 0.00 -0.22 0.00 0.00 33.01 31.40 1wgo s GLN 15 CO 0.60 0.23 0.93 -1.14 -0.25 0.00 0.00 175.29 175.67 1wgo s GLN 16 N -3.35 0.67 -0.21 2.91 0.74 -1.26 -5.13 119.66 114.04 1wgo s GLN 16 Ca 0.21 0.33 -0.29 0.00 0.05 0.00 0.00 55.36 55.66 1wgo s GLN 16 Cb -0.03 0.32 -0.03 0.00 1.10 0.00 0.00 33.01 34.38 1wgo s GLN 16 CO 0.08 -0.18 1.58 -1.12 -0.55 0.00 0.00 175.29 175.10 1wgo s SER 17 N -0.71 6.46 0.07 6.67 0.01 -1.26 -4.98 113.70 119.97 1wgo s SER 17 Ca -0.02 1.65 -0.00 0.00 1.31 0.00 0.00 55.95 58.89 1wgo s SER 17 Cb -0.02 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 1wgo s SER 17 CO 0.01 -1.18 -0.03 -1.10 0.41 0.00 0.00 173.24 171.35 1wgo s GLN 18 N 4.51 0.71 0.00 12.44 -0.21 -1.26 -5.07 119.66 130.78 1wgo s GLN 18 Ca 0.69 -1.28 0.00 0.00 0.02 0.00 0.00 55.36 54.79 1wgo s GLN 18 Cb -0.25 0.11 0.00 0.00 1.00 0.00 0.00 33.01 33.87 1wgo s GLN 18 CO 0.28 -0.11 0.00 1.55 -2.12 0.00 0.00 175.29 174.89 1wgo n VAL 19 N 0.04 0.00 -3.64 1.09 3.14 -1.26 -5.09 118.33 112.61 1wgo n VAL 19 Ca -0.12 0.00 -0.15 0.00 -2.96 0.00 0.00 64.34 61.10 1wgo n VAL 19 Cb 0.61 -0.57 -0.08 0.00 -1.06 0.00 0.00 33.84 32.74 1wgo n VAL 19 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 1wgo s GLN 20 N -1.97 0.81 -0.27 1.45 -1.52 -1.26 -5.17 119.66 111.73 1wgo s GLN 20 Ca 0.00 0.28 -0.26 0.00 -1.95 0.00 0.00 55.36 53.43 1wgo s GLN 20 Cb 0.00 0.38 0.15 0.00 -0.22 0.00 0.00 33.01 33.32 1wgo s GLN 20 CO 0.00 -0.21 1.18 -0.48 -0.25 0.00 0.00 175.29 175.53 1wgo s LEU 21 N -0.77 -0.29 0.09 2.90 2.34 -1.26 -5.15 118.68 116.54 1wgo s LEU 21 Ca -0.08 0.53 -0.30 0.00 0.06 0.00 0.00 54.13 54.33 1wgo s LEU 21 Cb -0.03 1.59 -0.06 0.00 -0.56 0.00 0.00 46.19 47.13 1wgo s LEU 21 CO 0.05 -0.12 1.09 0.00 -1.06 0.00 0.00 176.35 176.31 1wgo s GLN 22 N -0.05 4.55 -0.05 1.48 -2.07 -1.26 -5.04 119.66 117.22 1wgo s GLN 22 Ca 0.04 1.63 0.05 0.00 -1.82 0.00 0.00 55.36 55.27 1wgo s GLN 22 Cb -0.04 -3.35 -0.01 0.00 -1.09 0.00 0.00 33.01 28.52 1wgo s GLN 22 CO -0.09 -0.03 -0.20 0.00 -1.32 0.00 0.00 175.29 173.65 1wgo n PRO 24 N 3.08 0.13 -0.89 0.00 -0.04 -1.26 -4.91 135.00 131.11 1wgo n PRO 24 Ca -0.18 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.00 1wgo n PRO 24 Cb 0.53 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.99 1wgo n PRO 24 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1wgo n LEU 25 N 0.00 -2.56 -4.30 1.53 -0.00 -1.26 -4.96 117.00 105.45 1wgo n LEU 25 Ca 0.00 0.47 -0.27 0.00 -0.00 0.00 0.00 56.01 56.21 1wgo n LEU 25 Cb 0.00 -0.60 -0.14 0.00 -0.00 0.00 0.00 43.42 42.68 1wgo n LEU 25 CO 0.00 -3.37 -0.54 0.42 -0.00 0.00 0.00 177.39 173.90 1wgo s THR 26 N -1.41 1.86 0.50 1.47 -4.23 -1.26 -4.98 115.64 107.60 1wgo s THR 26 Ca 0.40 -1.36 -0.21 0.00 -1.18 0.00 0.00 61.69 59.34 1wgo s THR 26 Cb -0.36 -1.63 -0.07 0.00 1.34 0.00 0.00 72.50 71.79 1wgo s THR 26 CO 0.47 0.20 1.15 -2.16 -0.54 0.00 0.00 174.62 173.73 1wgo s PRO 27 N -1.40 3.54 -0.08 3.99 0.04 -1.26 -4.76 135.00 135.06 1wgo s PRO 27 Ca 0.09 1.68 -0.30 0.00 0.04 0.00 0.00 61.00 62.52 1wgo s PRO 27 Cb -0.09 -2.19 -0.04 0.00 0.04 0.00 0.00 34.50 32.22 1wgo s PRO 27 CO 0.03 -0.71 1.52 -1.25 0.04 0.00 0.00 177.00 176.63 1wgo s PRO 28 N -3.02 4.20 0.22 0.56 0.04 -1.26 -4.95 135.00 130.80 1wgo s PRO 28 Ca 0.69 2.02 0.09 0.00 0.04 0.00 0.00 61.00 63.83 1wgo s PRO 28 Cb -0.26 -3.89 -0.04 0.00 0.04 0.00 0.00 34.50 30.34 1wgo s PRO 28 CO 0.30 -0.79 -0.03 0.50 0.04 0.00 0.00 177.00 177.02 1wgo s ARG 29 N 3.77 2.23 -1.81 4.56 3.52 -1.26 -4.61 118.95 125.35 1wgo s ARG 29 Ca 0.67 -1.32 -0.20 0.00 -0.13 0.00 0.00 55.73 54.75 1wgo s ARG 29 Cb -0.30 -2.19 0.19 0.00 -1.56 0.00 0.00 34.95 31.10 1wgo s ARG 29 CO 0.25 0.40 0.54 0.41 -0.81 0.00 0.00 175.30 176.09 1wgo n GLY 30 N -0.47 -0.37 3.61 8.12 0.00 -1.26 -3.84 105.19 110.99 1wgo n GLY 30 Ca -0.08 0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1wgo n GLY 30 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wgo s LEU 31 N -7.27 3.74 0.07 0.99 1.98 -1.26 -4.15 118.68 112.78 1wgo s LEU 31 Ca 0.70 0.72 -0.10 0.00 -2.89 0.00 0.00 54.13 52.57 1wgo s LEU 31 Cb -0.41 -3.55 0.00 0.00 0.66 0.00 0.00 46.19 42.90 1wgo s LEU 31 CO 1.01 -1.14 0.21 0.00 -1.89 0.00 0.00 176.35 174.54 1wgo s GLN 32 N 4.22 0.79 0.18 1.98 0.00 -1.26 -4.20 119.66 121.37 1wgo s GLN 32 Ca 0.49 -0.79 0.05 0.00 -0.00 0.00 0.00 55.36 55.10 1wgo s GLN 32 Cb -0.10 0.32 -0.04 0.00 0.00 0.00 0.00 33.01 33.20 1wgo s GLN 32 CO 0.26 -0.24 0.22 0.14 0.00 0.00 0.00 175.29 175.66 1wgo s VAL 33 N -3.26 4.83 0.05 3.63 -7.23 -1.26 -3.86 120.40 113.30 1wgo s VAL 33 Ca 0.00 -1.00 -0.02 0.00 -1.81 0.00 0.00 61.98 59.16 1wgo s VAL 33 Cb 0.02 -3.52 -0.03 0.00 0.56 0.00 0.00 36.38 33.41 1wgo s VAL 33 CO -0.08 -0.17 -0.00 -0.94 -0.31 0.00 0.00 175.10 173.60 1wgo s SER 34 N -3.36 0.40 -0.26 4.85 1.04 -0.27 -4.99 113.70 111.11 1wgo s SER 34 Ca 0.33 -0.85 -0.08 0.00 0.48 0.00 0.00 55.95 55.83 1wgo s SER 34 Cb -0.10 0.19 -0.03 0.00 0.10 0.00 0.00 66.02 66.19 1wgo s SER 34 CO 0.26 -0.55 0.10 -0.63 0.98 0.00 0.00 173.24 173.40 1wgo s ILE 35 N -3.38 4.49 -0.65 -1.02 1.01 -1.26 0.13 121.20 120.52 1wgo s ILE 35 Ca 0.02 -0.16 -0.30 0.00 0.00 0.00 0.00 60.65 60.21 1wgo s ILE 35 Cb 0.04 -3.13 -0.17 0.00 0.01 0.00 0.00 42.46 39.21 1wgo s ILE 35 CO -0.08 0.29 2.02 1.67 0.00 0.00 0.00 174.94 178.84 1wgo n GLN 36 N 4.95 0.00 -0.36 2.79 -0.06 -0.65 -4.24 117.38 119.80 1wgo n GLN 36 Ca -0.16 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.84 1wgo n GLN 36 Cb 0.51 -1.23 0.00 0.00 -4.06 0.00 0.00 30.24 25.46 1wgo n GLN 36 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1wgo n GLY 37 N 5.70 -3.19 3.58 1.69 0.00 -1.26 -4.75 105.19 106.96 1wgo n GLY 37 Ca 0.50 -1.15 -0.42 0.00 0.00 0.00 0.00 46.02 44.96 1wgo n GLY 37 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1wgo n GLU 38 N -1.46 1.73 -3.78 1.61 2.13 -1.26 -4.93 120.64 114.68 1wgo n GLU 38 Ca 0.00 0.41 -0.37 0.00 0.66 0.00 0.00 57.16 57.86 1wgo n GLU 38 Cb 0.07 -3.26 -0.13 0.00 0.27 0.00 0.00 31.44 28.39 1wgo n GLU 38 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1wgo s ALA 39 N 9.17 3.01 -0.19 4.31 0.00 -1.26 -4.95 121.76 131.86 1wgo s ALA 39 Ca 1.01 -1.67 -0.05 0.00 0.00 0.00 0.00 51.96 51.24 1wgo s ALA 39 Cb -0.32 -2.18 -0.21 0.00 0.00 0.00 0.00 23.12 20.41 1wgo s ALA 39 CO 0.34 -1.22 0.10 1.33 0.00 0.00 0.00 175.76 176.30 1wgo n VAL 40 N 4.80 1.64 -3.66 0.00 0.24 -1.26 -4.87 118.33 115.22 1wgo n VAL 40 Ca -0.13 -0.56 -0.26 0.00 -2.04 0.00 0.00 64.34 61.35 1wgo n VAL 40 Cb 0.45 -1.66 -0.17 0.00 -1.47 0.00 0.00 33.84 30.99 1wgo n VAL 40 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1wgo s ALA 41 N -2.53 0.61 0.18 2.33 0.00 -1.26 -4.65 121.76 116.44 1wgo s ALA 41 Ca -0.28 -0.39 0.04 0.00 0.00 0.00 0.00 51.96 51.32 1wgo s ALA 41 Cb 0.08 -1.04 -0.04 0.00 0.00 0.00 0.00 23.12 22.12 1wgo s ALA 41 CO 0.68 -1.11 0.23 0.08 0.00 0.00 0.00 175.76 175.64 1wgo s VAL 42 N 2.04 4.92 0.24 0.00 1.01 -0.92 -4.86 120.40 122.83 1wgo s VAL 42 Ca 0.01 -0.95 -0.09 0.00 0.00 0.00 0.00 61.98 60.95 1wgo s VAL 42 Cb -0.16 -3.56 -0.07 0.00 0.00 0.00 0.00 36.38 32.59 1wgo s VAL 42 CO -0.08 -0.16 0.56 -0.13 0.00 0.00 0.00 175.10 175.29 1wgo s ARG 43 N -3.36 3.78 -0.36 2.72 3.00 -1.26 -0.25 118.95 123.22 1wgo s ARG 43 Ca 0.33 0.25 -0.28 0.00 0.00 0.00 0.00 55.73 56.03 1wgo s ARG 43 Cb -0.10 -2.64 -0.01 0.00 0.00 0.00 0.00 34.95 32.20 1wgo s ARG 43 CO 0.26 0.29 1.71 -1.25 0.00 0.00 0.00 175.30 176.31 1wgo s PRO 44 N -2.95 3.37 0.00 3.54 0.04 -1.26 -2.52 135.00 135.22 1wgo s PRO 44 Ca 0.47 1.28 0.00 0.00 0.04 0.00 0.00 61.00 62.79 1wgo s PRO 44 Cb -0.11 -4.16 0.00 0.00 0.04 0.00 0.00 34.50 30.27 1wgo s PRO 44 CO 0.23 -1.82 0.00 0.41 0.04 0.00 0.00 177.00 175.86 1wgo n GLY 45 N 5.35 1.24 3.58 0.56 0.00 -0.79 -4.91 105.19 110.22 1wgo n GLY 45 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1wgo n GLY 45 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wgo s GLU 46 N -0.30 3.81 -0.80 1.61 0.41 -1.05 -4.80 118.70 117.58 1wgo s GLU 46 Ca 0.00 -0.06 -0.20 0.00 -0.41 0.00 0.00 54.97 54.30 1wgo s GLU 46 Cb 0.00 -3.73 -0.18 0.00 -1.78 0.00 0.00 34.13 28.43 1wgo s GLU 46 CO 0.00 -0.46 2.05 -0.25 -0.49 0.00 0.00 175.26 176.10 1wgo n ASP 47 N 5.53 0.55 -4.78 -0.19 8.00 -1.26 -4.49 116.55 119.91 1wgo n ASP 47 Ca -0.06 -1.71 -0.36 0.00 0.71 0.00 0.00 54.79 53.37 1wgo n ASP 47 Cb 0.50 -1.36 -0.02 0.00 -0.02 0.00 0.00 41.12 40.21 1wgo n ASP 47 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1wgo s VAL 48 N 11.36 3.41 -0.06 2.53 0.11 0.21 -4.74 120.40 133.22 1wgo s VAL 48 Ca 0.80 1.01 0.04 0.00 -2.93 0.00 0.00 61.98 60.91 1wgo s VAL 48 Cb -0.19 -3.49 -0.02 0.00 -1.53 0.00 0.00 36.38 31.15 1wgo s VAL 48 CO 0.18 -0.06 -0.18 -0.76 -3.33 0.00 0.00 175.10 170.95 1wgo s LEU 49 N -3.07 2.50 -0.23 2.54 2.01 -1.26 -1.71 118.68 119.45 1wgo s LEU 49 Ca 0.63 -0.32 -0.01 0.00 0.01 0.00 0.00 54.13 54.44 1wgo s LEU 49 Cb -0.24 -1.50 0.02 0.00 0.01 0.00 0.00 46.19 44.49 1wgo s LEU 49 CO 0.29 0.29 -0.09 -0.36 1.01 0.00 0.00 176.35 177.49 1wgo s PHE 50 N -0.39 3.02 -0.19 0.29 0.08 -1.05 -1.64 117.98 118.10 1wgo s PHE 50 Ca 0.04 -1.59 -0.18 0.00 0.12 0.00 0.00 56.93 55.32 1wgo s PHE 50 Cb -0.12 -2.02 -0.04 0.00 -0.57 0.00 0.00 43.02 40.27 1wgo s PHE 50 CO 0.02 -0.74 0.48 0.08 -0.10 0.00 0.00 175.22 174.95 1wgo s VAL 51 N 1.31 5.14 -0.14 -0.44 1.01 0.35 -3.06 120.40 124.56 1wgo s VAL 51 Ca 0.01 0.88 -0.07 0.00 0.00 0.00 0.00 61.98 62.80 1wgo s VAL 51 Cb -0.16 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 1wgo s VAL 51 CO -0.06 0.22 0.09 0.54 0.00 0.00 0.00 175.10 175.88 1wgo s VAL 52 N 1.42 5.04 0.02 2.92 0.11 -1.26 -1.12 120.40 127.54 1wgo s VAL 52 Ca 0.23 0.04 -0.15 0.00 -2.93 0.00 0.00 61.98 59.17 1wgo s VAL 52 Cb -0.15 -3.22 0.02 0.00 -1.53 0.00 0.00 36.38 31.50 1wgo s VAL 52 CO 0.09 0.54 0.33 -0.60 -3.33 0.00 0.00 175.10 172.14 1wgo s ARG 53 N -0.39 0.78 0.18 1.54 3.52 -1.25 -4.78 118.95 118.54 1wgo s ARG 53 Ca 0.10 -0.35 0.08 0.00 -0.13 0.00 0.00 55.73 55.43 1wgo s ARG 53 Cb -0.12 0.34 -0.04 0.00 -1.56 0.00 0.00 34.95 33.57 1wgo s ARG 53 CO 0.02 -0.24 -0.16 -1.14 -0.81 0.00 0.00 175.30 172.97 1wgo s GLN 54 N -2.03 1.26 -0.06 5.12 0.74 -1.26 -4.02 119.66 119.41 1wgo s GLN 54 Ca -0.08 -1.46 -0.18 0.00 0.05 0.00 0.00 55.36 53.68 1wgo s GLN 54 Cb -0.02 -1.19 -0.30 0.00 1.10 0.00 0.00 33.01 32.59 1wgo s GLN 54 CO 0.00 0.22 0.76 1.05 -0.55 0.00 0.00 175.29 176.78 1wgo h GLU 55 N 3.01 0.31 0.00 1.67 4.11 -1.72 -3.37 114.58 118.58 1wgo h GLU 55 Ca -0.40 -0.52 -0.00 0.00 0.07 0.00 0.00 59.36 58.50 1wgo h GLU 55 Cb 1.21 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.65 1wgo h GLU 55 CO 0.55 1.25 -0.14 1.04 0.07 0.00 0.00 179.01 181.78 1wgo n GLN 56 N -3.98 1.27 -3.19 1.06 6.02 -1.26 -4.97 117.38 112.32 1wgo n GLN 56 Ca -0.19 -2.65 -0.45 0.00 -0.01 0.00 0.00 57.00 53.70 1wgo n GLN 56 Cb 0.89 -1.46 -0.04 0.00 1.02 0.00 0.00 30.24 30.65 1wgo n GLN 56 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1wgo s GLY 57 N -2.85 1.96 -0.14 1.08 0.00 -1.26 -4.81 107.32 101.30 1wgo s GLY 57 Ca 0.32 -2.44 0.10 0.00 0.00 0.00 0.00 44.72 42.69 1wgo s GLY 57 CO 0.00 1.44 0.01 1.34 0.00 0.00 0.00 173.10 175.89 1wgo n ASP 58 N 5.78 1.94 -3.48 1.64 2.03 -1.26 -4.73 116.55 118.48 1wgo n ASP 58 Ca -0.08 -0.02 0.01 0.00 0.52 0.00 0.00 54.79 55.22 1wgo n ASP 58 Cb 0.42 0.62 -0.05 0.00 -0.72 0.00 0.00 41.12 41.39 1wgo n ASP 58 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1wgo s VAL 59 N -2.32 -0.25 -0.02 5.18 0.11 -1.26 -5.07 120.40 116.76 1wgo s VAL 59 Ca -0.10 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 58.65 1wgo s VAL 59 Cb 0.04 -1.00 0.12 0.00 -1.53 0.00 0.00 36.38 34.01 1wgo s VAL 59 CO 0.51 0.00 1.25 -1.48 -3.33 0.00 0.00 175.10 172.05 1wgo s LEU 60 N 1.92 -0.08 -0.75 2.54 2.34 -1.26 -4.76 118.68 118.63 1wgo s LEU 60 Ca -0.05 -0.14 -0.03 0.00 0.06 0.00 0.00 54.13 53.97 1wgo s LEU 60 Cb -0.04 1.44 0.19 0.00 -0.56 0.00 0.00 46.19 47.22 1wgo s LEU 60 CO -0.16 -0.34 0.60 0.28 -1.06 0.00 0.00 176.35 175.68 1wgo s THR 61 N -2.49 4.14 -0.13 5.48 -1.32 -1.26 -4.82 115.64 115.24 1wgo s THR 61 Ca 0.13 -3.27 0.00 0.00 -1.21 0.00 0.00 61.69 57.34 1wgo s THR 61 Cb 0.04 -3.63 0.02 0.00 -1.51 0.00 0.00 72.50 67.42 1wgo s THR 61 CO -0.04 -0.97 -0.12 -0.89 -2.21 0.00 0.00 174.62 170.39 1wgo s THR 62 N -0.55 1.35 -0.16 5.08 2.01 -1.26 -4.70 115.64 117.41 1wgo s THR 62 Ca 0.21 -0.50 -0.29 0.00 0.31 0.00 0.00 61.69 61.42 1wgo s THR 62 Cb -0.14 -1.30 -0.00 0.00 0.01 0.00 0.00 72.50 71.07 1wgo s THR 62 CO -0.07 0.42 1.02 -0.54 -0.69 0.00 0.00 174.62 174.75 1wgo s LYS 63 N 1.53 4.35 -0.07 4.92 -0.14 -1.26 -4.12 119.74 124.95 1wgo s LYS 63 Ca 0.04 1.37 -0.06 0.00 -1.36 0.00 0.00 55.97 55.96 1wgo s LYS 63 Cb -0.13 -3.58 -0.04 0.00 -1.68 0.00 0.00 37.83 32.40 1wgo s LYS 63 CO -0.09 -0.44 0.18 0.71 -0.76 0.00 0.00 175.35 174.94 1wgo s TYR 64 N 2.50 3.59 -0.36 3.18 2.02 -0.39 -3.87 117.35 124.02 1wgo s TYR 64 Ca 0.46 0.52 -0.04 0.00 -0.37 0.00 0.00 57.07 57.64 1wgo s TYR 64 Cb -0.17 -1.94 0.08 0.00 -0.40 0.00 0.00 41.96 39.53 1wgo s TYR 64 CO 0.13 0.70 0.12 -1.14 -1.57 0.00 0.00 175.55 173.79 1wgo s GLN 65 N -1.33 2.30 -0.39 -0.62 0.74 0.19 -2.55 119.66 117.99 1wgo s GLN 65 Ca 0.20 -1.50 -0.23 0.00 0.05 0.00 0.00 55.36 53.88 1wgo s GLN 65 Cb -0.13 -3.44 0.01 0.00 1.10 0.00 0.00 33.01 30.56 1wgo s GLN 65 CO 0.09 -0.84 0.76 0.08 -0.55 0.00 0.00 175.29 174.84 1wgo s VAL 66 N 1.24 4.73 -0.30 1.34 1.01 -1.07 -2.10 120.40 125.25 1wgo s VAL 66 Ca 0.02 0.71 -0.02 0.00 0.00 0.00 0.00 61.98 62.69 1wgo s VAL 66 Cb -0.21 -4.22 0.05 0.00 0.00 0.00 0.00 36.38 32.00 1wgo s VAL 66 CO -0.01 -0.50 -0.00 -0.62 0.00 0.00 0.00 175.10 173.96 1wgo s ASP 67 N 1.92 4.88 0.10 3.32 -1.08 -0.87 -3.31 116.67 121.63 1wgo s ASP 67 Ca 0.30 -1.29 -0.03 0.00 -0.52 0.00 0.00 52.55 51.01 1wgo s ASP 67 Cb -0.13 -1.71 -0.19 0.00 -1.46 0.00 0.00 42.92 39.43 1wgo s ASP 67 CO 0.18 -0.26 1.22 -0.07 0.52 0.00 0.00 175.17 176.76 1wgo h LEU 68 N 7.99 0.41 0.00 -1.34 -0.00 -1.78 -2.71 115.31 117.87 1wgo h LEU 68 Ca -0.21 -0.39 0.00 0.00 -0.00 0.00 0.00 57.88 57.28 1wgo h LEU 68 Cb 1.06 -0.13 0.00 0.00 -0.00 0.00 0.00 40.66 41.59 1wgo h LEU 68 CO 0.53 1.26 0.00 0.61 -0.00 0.00 0.00 178.44 180.84 1wgo n GLY 69 N 1.29 2.95 0.00 0.83 0.00 -1.26 -4.10 105.19 104.90 1wgo n GLY 69 Ca -0.07 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.16 1wgo n GLY 69 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1wgo n ASP 70 N 1.53 0.00 -0.52 1.61 2.03 -1.26 -4.82 116.55 115.12 1wgo n ASP 70 Ca 0.00 0.92 -0.02 0.00 0.52 0.00 0.00 54.79 56.21 1wgo n ASP 70 Cb 0.00 -0.42 -0.02 0.00 -0.72 0.00 0.00 41.12 39.96 1wgo n ASP 70 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wgo n GLY 71 N -0.93 0.26 3.11 0.27 0.00 -1.26 -5.11 105.19 101.53 1wgo n GLY 71 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1wgo n GLY 71 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1wgo s PHE 72 N 0.00 3.00 -0.25 1.61 5.36 -1.26 -5.09 117.98 121.36 1wgo s PHE 72 Ca 0.00 -1.91 0.01 0.00 -0.96 0.00 0.00 56.93 54.07 1wgo s PHE 72 Cb 0.00 -1.94 0.06 0.00 -0.34 0.00 0.00 43.02 40.81 1wgo s PHE 72 CO 0.00 -0.83 -0.06 0.15 -1.46 0.00 0.00 175.22 173.02 1wgo s LYS 73 N 1.22 1.75 0.20 10.12 3.01 -1.26 -3.14 119.74 131.64 1wgo s LYS 73 Ca -0.01 -1.12 0.05 0.00 -1.01 0.00 0.00 55.97 53.87 1wgo s LYS 73 Cb -0.16 -2.68 -0.05 0.00 -1.01 0.00 0.00 37.83 33.93 1wgo s LYS 73 CO -0.09 -0.61 -0.06 0.00 0.51 0.00 0.00 175.35 175.10 1wgo s ALA 74 N 1.30 1.74 -0.19 5.17 0.00 -1.21 -5.09 121.76 123.49 1wgo s ALA 74 Ca -0.06 -1.66 -0.02 0.00 0.00 0.00 0.00 51.96 50.22 1wgo s ALA 74 Cb -0.19 0.25 0.06 0.00 0.00 0.00 0.00 23.12 23.23 1wgo s ALA 74 CO -0.06 -0.15 0.01 1.41 0.00 0.00 0.00 175.76 176.97 1wgo s MET 75 N -3.79 0.84 0.23 0.00 1.75 -1.26 -2.60 119.30 114.47 1wgo s MET 75 Ca 0.24 -0.46 0.07 0.00 -1.25 0.00 0.00 55.69 54.29 1wgo s MET 75 Cb 0.04 -2.07 -0.04 0.00 2.84 0.00 0.00 34.83 35.60 1wgo s MET 75 CO 0.06 -0.59 0.16 0.71 -0.65 0.00 0.00 175.02 174.70 1wgo s TYR 76 N 1.79 3.06 -0.04 4.11 1.51 -1.06 -4.98 117.35 121.75 1wgo s TYR 76 Ca -0.01 -0.10 -0.02 0.00 -1.01 0.00 0.00 57.07 55.93 1wgo s TYR 76 Cb -0.17 -1.40 0.02 0.00 -0.11 0.00 0.00 41.96 40.31 1wgo s TYR 76 CO -0.07 0.53 0.08 0.54 -1.11 0.00 0.00 175.55 175.52 1wgo s VAL 77 N -2.06 -0.03 -1.28 0.71 0.11 -1.26 -1.26 120.40 115.33 1wgo s VAL 77 Ca 0.32 0.12 -0.01 0.00 -2.93 0.00 0.00 61.98 59.48 1wgo s VAL 77 Cb -0.08 -0.14 -0.00 0.00 -1.53 0.00 0.00 36.38 34.62 1wgo s VAL 77 CO 0.24 0.05 0.73 0.59 -3.33 0.00 0.00 175.10 173.37 1wgo n ASN 78 N 3.74 -1.56 -0.22 3.54 3.02 -1.26 -4.71 115.26 117.81 1wgo n ASN 78 Ca -0.21 -0.81 0.02 0.00 -0.03 0.00 0.00 54.58 53.55 1wgo n ASN 78 Cb 0.54 -4.13 0.12 0.00 -0.61 0.00 0.00 39.78 35.70 1wgo n ASN 78 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1wgo h LEU 79 N -1.84 -0.28 -2.00 3.41 -0.00 -1.93 0.45 115.31 113.13 1wgo h LEU 79 Ca -0.61 0.16 0.17 0.00 -0.00 0.00 0.00 57.88 57.60 1wgo h LEU 79 Cb 1.36 0.28 -0.02 0.00 -0.00 0.00 0.00 40.66 42.28 1wgo h LEU 79 CO 0.55 -0.12 0.42 0.71 -0.00 0.00 0.00 178.44 180.00 1wgo h THR 80 N 0.12 0.70 0.14 0.22 1.35 -1.89 0.58 112.91 114.13 1wgo h THR 80 Ca 0.35 0.00 -0.20 0.00 -0.55 0.00 0.00 66.41 66.01 1wgo h THR 80 Cb 0.58 0.71 0.02 0.00 -1.73 0.00 0.00 68.15 67.72 1wgo h THR 80 CO -0.56 0.00 -0.90 0.25 -0.25 0.00 0.00 175.52 174.06 1wgo h LEU 81 N 0.00 0.46 -1.17 3.87 6.46 -0.51 -3.29 115.31 121.13 1wgo h LEU 81 Ca 0.28 -0.94 -0.00 0.00 -0.12 0.00 0.00 57.88 57.09 1wgo h LEU 81 Cb 1.12 -0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 40.90 1wgo h LEU 81 CO -0.00 1.42 -0.01 0.71 -0.62 0.00 0.00 178.44 179.94 1wgo h THR 82 N -0.36 0.03 -2.25 1.05 1.35 -0.03 -3.46 112.91 109.24 1wgo h THR 82 Ca -0.16 -0.63 -0.30 0.00 -0.55 0.00 0.00 66.41 64.76 1wgo h THR 82 Cb 1.66 1.62 -0.08 0.00 -1.73 0.00 0.00 68.15 69.62 1wgo h THR 82 CO 0.14 0.01 -0.31 0.61 -0.25 0.00 0.00 175.52 175.71 1wgo n GLY 83 N 0.25 0.62 3.30 5.82 0.00 0.19 -4.93 105.19 110.44 1wgo n GLY 83 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1wgo n GLY 83 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wgo s GLU 84 N -3.98 3.18 0.68 1.61 2.02 -1.25 -5.08 118.70 115.88 1wgo s GLU 84 Ca 0.00 -0.77 -0.14 0.00 0.02 0.00 0.00 54.97 54.08 1wgo s GLU 84 Cb 0.00 -3.14 0.01 0.00 0.10 0.00 0.00 34.13 31.10 1wgo s GLU 84 CO 0.00 -0.32 1.11 -1.25 0.02 0.00 0.00 175.26 174.81 1wgo s PRO 85 N 1.46 2.70 -0.79 0.39 0.04 -1.26 -4.96 135.00 132.57 1wgo s PRO 85 Ca 0.03 1.35 -0.23 0.00 0.04 0.00 0.00 61.00 62.20 1wgo s PRO 85 Cb -0.16 -1.94 0.07 0.00 0.04 0.00 0.00 34.50 32.51 1wgo s PRO 85 CO -0.01 -1.33 1.15 0.42 0.04 0.00 0.00 177.00 177.27 1wgo s ILE 86 N -2.45 4.22 0.09 0.56 1.01 -1.17 -4.91 121.20 118.54 1wgo s ILE 86 Ca 0.66 -0.53 -0.26 0.00 0.00 0.00 0.00 60.65 60.53 1wgo s ILE 86 Cb -0.20 -4.82 -0.06 0.00 0.01 0.00 0.00 42.46 37.39 1wgo s ILE 86 CO 0.44 -1.63 0.79 -0.60 0.00 0.00 0.00 174.94 173.94 1wgo s ARG 87 N 4.27 4.54 -0.09 2.79 3.52 -1.26 -2.53 118.95 130.19 1wgo s ARG 87 Ca 0.31 1.14 -0.30 0.00 -0.13 0.00 0.00 55.73 56.75 1wgo s ARG 87 Cb -0.10 -3.34 0.10 0.00 -1.56 0.00 0.00 34.95 30.06 1wgo s ARG 87 CO 0.04 0.36 0.85 -1.58 -0.81 0.00 0.00 175.30 174.16 1wgo s HIS 88 N -0.36 -0.49 0.04 5.12 2.46 -0.70 -4.99 115.29 116.38 1wgo s HIS 88 Ca 0.39 0.79 0.02 0.00 0.47 0.00 0.00 55.06 56.72 1wgo s HIS 88 Cb -0.22 0.44 -0.02 0.00 -0.13 0.00 0.00 32.58 32.65 1wgo s HIS 88 CO 0.25 -0.48 -0.07 -0.98 -2.47 0.00 0.00 174.74 170.99 1wgo s ARG 89 N -1.38 0.53 0.40 2.88 1.70 -1.26 0.66 118.95 122.48 1wgo s ARG 89 Ca -0.05 -0.79 0.07 0.00 -0.47 0.00 0.00 55.73 54.50 1wgo s ARG 89 Cb -0.00 -0.25 0.01 0.00 -0.57 0.00 0.00 34.95 34.13 1wgo s ARG 89 CO 0.04 0.04 0.55 0.71 -1.08 0.00 0.00 175.30 175.55 1wgo s TYR 90 N -1.55 2.90 -0.20 5.89 2.02 -1.26 -4.92 117.35 120.23 1wgo s TYR 90 Ca -0.09 -0.33 -0.12 0.00 -0.37 0.00 0.00 57.07 56.15 1wgo s TYR 90 Cb -0.09 -2.28 -0.08 0.00 -0.40 0.00 0.00 41.96 39.10 1wgo s TYR 90 CO -0.00 -0.32 -0.29 0.39 -1.57 0.00 0.00 175.55 173.76 1wgo n GLU 91 N -1.81 0.46 -4.29 -0.62 1.02 -1.26 -1.88 120.64 112.26 1wgo n GLU 91 Ca 0.06 0.20 -0.24 0.00 -0.02 0.00 0.00 57.16 57.16 1wgo n GLU 91 Cb 0.59 -1.29 -0.08 0.00 -0.02 0.00 0.00 31.44 30.64 1wgo n GLU 91 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1wgo s SER 92 N -6.70 4.51 0.91 1.62 0.01 -1.26 -4.60 113.70 108.18 1wgo s SER 92 Ca -0.29 -0.61 -0.12 0.00 1.31 0.00 0.00 55.95 56.24 1wgo s SER 92 Cb 0.09 -0.84 0.14 0.00 0.21 0.00 0.00 66.02 65.62 1wgo s SER 92 CO 0.38 0.03 1.09 -2.16 0.41 0.00 0.00 173.24 173.00 1wgo s PRO 93 N -3.43 1.15 0.00 12.44 0.04 -1.26 -4.94 135.00 138.99 1wgo s PRO 93 Ca 0.30 0.77 0.00 0.00 0.04 0.00 0.00 61.00 62.11 1wgo s PRO 93 Cb -0.07 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.67 1wgo s PRO 93 CO 0.19 -2.31 0.00 0.41 0.04 0.00 0.00 177.00 175.33 1wgo n GLY 94 N -1.13 3.74 3.72 0.56 0.00 -1.03 -5.04 105.19 106.00 1wgo n GLY 94 Ca 0.07 -1.50 -0.43 0.00 0.00 0.00 0.00 46.02 44.17 1wgo n GLY 94 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1wgo n ILE 95 N -0.59 0.25 -4.17 -0.61 -0.00 -1.26 -4.19 119.36 108.78 1wgo n ILE 95 Ca 0.00 -0.06 -0.28 0.00 -0.00 0.00 0.00 62.75 62.41 1wgo n ILE 95 Cb 0.00 -1.91 -0.08 0.00 -0.00 0.00 0.00 39.64 37.65 1wgo n ILE 95 CO 0.00 0.00 0.00 -0.31 -0.00 0.00 0.00 176.55 176.24 1wgo s TYR 96 N 0.85 2.90 -0.37 1.39 2.02 -0.22 -4.95 117.35 118.97 1wgo s TYR 96 Ca 0.73 -0.09 -0.10 0.00 -0.37 0.00 0.00 57.07 57.23 1wgo s TYR 96 Cb -0.53 -1.45 0.03 0.00 -0.40 0.00 0.00 41.96 39.62 1wgo s TYR 96 CO 0.37 0.49 0.20 0.50 -1.57 0.00 0.00 175.55 175.54 1wgo s ARG 97 N -2.66 2.78 -0.19 -0.62 3.00 -1.26 -1.79 118.95 118.22 1wgo s ARG 97 Ca 0.26 -1.11 -0.02 0.00 -1.00 0.00 0.00 55.73 53.86 1wgo s ARG 97 Cb -0.10 -3.70 -0.01 0.00 0.00 0.00 0.00 34.95 31.13 1wgo s ARG 97 CO 0.18 -0.71 -0.08 0.08 0.00 0.00 0.00 175.30 174.77 1wgo s VAL 98 N 1.53 3.19 0.21 7.11 1.01 0.61 -4.06 120.40 130.00 1wgo s VAL 98 Ca 0.01 -0.57 0.05 0.00 0.00 0.00 0.00 61.98 61.48 1wgo s VAL 98 Cb -0.19 -2.41 -0.05 0.00 0.00 0.00 0.00 36.38 33.73 1wgo s VAL 98 CO 0.06 0.47 -0.08 -0.44 0.00 0.00 0.00 175.10 175.11 1wgo s SER 99 N 1.09 2.17 -0.08 3.32 0.01 -1.02 0.50 113.70 119.69 1wgo s SER 99 Ca 0.01 -1.10 -0.01 0.00 1.31 0.00 0.00 55.95 56.15 1wgo s SER 99 Cb -0.15 -0.06 0.03 0.00 0.21 0.00 0.00 66.02 66.05 1wgo s SER 99 CO -0.01 -0.34 -0.00 0.54 0.41 0.00 0.00 173.24 173.84 1wgo s VAL 100 N -3.21 0.42 -0.05 3.43 0.11 -0.68 -2.06 120.40 118.36 1wgo s VAL 100 Ca 0.23 0.06 -0.02 0.00 -2.93 0.00 0.00 61.98 59.33 1wgo s VAL 100 Cb 0.03 -0.59 -0.04 0.00 -1.53 0.00 0.00 36.38 34.25 1wgo s VAL 100 CO 0.06 0.24 0.05 -0.60 -3.33 0.00 0.00 175.10 171.52 1wgo s ARG 101 N 1.95 3.05 -0.15 1.54 3.52 -0.89 -1.82 118.95 126.16 1wgo s ARG 101 Ca 0.05 -0.42 -0.08 0.00 -0.13 0.00 0.00 55.73 55.14 1wgo s ARG 101 Cb -0.13 -2.86 0.06 0.00 -1.56 0.00 0.00 34.95 30.46 1wgo s ARG 101 CO -0.06 0.68 0.37 0.00 -0.81 0.00 0.00 175.30 175.48 1wgo s ALA 102 N -1.05 -0.92 -0.26 6.12 0.00 -0.09 0.53 121.76 126.08 1wgo s ALA 102 Ca 0.18 1.39 -0.01 0.00 0.00 0.00 0.00 51.96 53.52 1wgo s ALA 102 Cb -0.12 -0.86 0.14 0.00 0.00 0.00 0.00 23.12 22.28 1wgo s ALA 102 CO 0.08 -0.26 0.39 -2.00 0.00 0.00 0.00 175.76 173.97 1wgo s GLU 103 N 1.40 0.38 0.39 0.00 2.12 -1.25 -0.15 118.70 121.59 1wgo s GLU 103 Ca -0.09 0.36 0.08 0.00 0.36 0.00 0.00 54.97 55.68 1wgo s GLU 103 Cb -0.09 -0.40 -0.06 0.00 0.26 0.00 0.00 34.13 33.84 1wgo s GLU 103 CO -0.12 -0.81 0.09 0.54 -0.54 0.00 0.00 175.26 174.42 1wgo s ASN 104 N 2.54 4.22 0.35 -1.70 2.20 0.36 -4.69 114.94 118.22 1wgo s ASN 104 Ca 0.12 -1.12 0.15 0.00 -0.94 0.00 0.00 52.86 51.06 1wgo s ASN 104 Cb -0.14 -0.48 1.06 0.00 -2.00 0.00 0.00 41.25 39.69 1wgo s ASN 104 CO -0.22 -0.43 1.69 0.00 -2.94 0.00 0.00 177.10 175.20 1wgo h THR 105 N 1.63 0.38 0.00 0.54 1.03 -2.01 -2.60 112.91 111.87 1wgo h THR 105 Ca -0.43 -0.13 0.00 0.00 -0.01 0.00 0.00 66.41 65.84 1wgo h THR 105 Cb 1.25 -0.04 0.00 0.00 -1.07 0.00 0.00 68.15 68.29 1wgo h THR 105 CO 0.72 0.07 0.00 0.00 -0.01 0.00 0.00 175.52 176.30 1wgo n ALA 106 N -2.34 -0.34 -2.94 0.00 0.00 -1.26 -5.02 120.51 108.60 1wgo n ALA 106 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1wgo n ALA 106 Cb 0.94 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.39 1wgo n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wgo n GLY 107 N -0.27 4.82 3.55 0.00 0.00 -0.98 -4.77 105.19 107.54 1wgo n GLY 107 Ca 0.00 -0.88 -0.09 0.00 0.00 0.00 0.00 46.02 45.05 1wgo n GLY 107 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1wgo s HIS 108 N 0.52 -0.06 -0.09 1.61 -3.43 -1.26 -0.49 115.29 112.09 1wgo s HIS 108 Ca 0.00 -0.29 -0.30 0.00 -0.80 0.00 0.00 55.06 53.66 1wgo s HIS 108 Cb 0.00 0.38 0.12 0.00 -1.43 0.00 0.00 32.58 31.65 1wgo s HIS 108 CO 0.00 -0.94 0.99 0.34 -2.00 0.00 0.00 174.74 173.12 1wgo s ASP 109 N -2.89 -0.32 -0.03 7.38 -1.08 0.78 -4.61 116.67 115.89 1wgo s ASP 109 Ca 0.11 0.12 -0.23 0.00 -0.52 0.00 0.00 52.55 52.03 1wgo s ASP 109 Cb -0.01 0.31 0.05 0.00 -1.46 0.00 0.00 42.92 41.80 1wgo s ASP 109 CO -0.01 -0.46 0.49 -0.70 0.52 0.00 0.00 175.17 175.01 1wgo s GLU 110 N -2.37 0.85 0.09 4.34 2.12 -1.26 -0.91 118.70 121.56 1wgo s GLU 110 Ca 0.04 0.04 -0.01 0.00 0.36 0.00 0.00 54.97 55.40 1wgo s GLU 110 Cb -0.01 0.39 -0.04 0.00 0.26 0.00 0.00 34.13 34.74 1wgo s GLU 110 CO -0.05 -0.25 0.02 0.00 -0.54 0.00 0.00 175.26 174.43 1wgo s ALA 111 N -1.24 0.65 0.00 6.30 0.00 -0.75 -4.54 121.76 122.19 1wgo s ALA 111 Ca -0.12 -1.32 0.02 0.00 0.00 0.00 0.00 51.96 50.54 1wgo s ALA 111 Cb -0.03 0.55 -0.01 0.00 0.00 0.00 0.00 23.12 23.64 1wgo s ALA 111 CO 0.07 -0.43 -0.07 0.08 0.00 0.00 0.00 175.76 175.41 1wgo s VAL 112 N -3.98 0.55 -0.10 0.00 1.01 -1.26 -1.69 120.40 114.94 1wgo s VAL 112 Ca 0.15 -0.39 -0.09 0.00 0.00 0.00 0.00 61.98 61.65 1wgo s VAL 112 Cb 0.08 -0.48 0.03 0.00 0.00 0.00 0.00 36.38 36.00 1wgo s VAL 112 CO -0.05 0.09 0.26 -0.22 0.00 0.00 0.00 175.10 175.19 1wgo s LEU 113 N -0.33 0.97 -0.17 3.92 0.20 0.18 -4.94 118.68 118.51 1wgo s LEU 113 Ca 0.01 0.52 -0.02 0.00 0.69 0.00 0.00 54.13 55.34 1wgo s LEU 113 Cb -0.03 0.87 -0.01 0.00 -0.43 0.00 0.00 46.19 46.59 1wgo s LEU 113 CO -0.00 -0.10 -0.10 -0.36 -0.29 0.00 0.00 176.35 175.51 1wgo s PHE 114 N 0.23 2.88 -0.23 5.38 0.40 -1.26 -0.28 117.98 125.09 1wgo s PHE 114 Ca -0.01 -0.85 -0.10 0.00 -0.60 0.00 0.00 56.93 55.37 1wgo s PHE 114 Cb -0.02 -1.96 -0.05 0.00 0.51 0.00 0.00 43.02 41.49 1wgo s PHE 114 CO -0.00 -0.40 0.15 0.08 0.70 0.00 0.00 175.22 175.74 1wgo s VAL 115 N 0.91 5.26 -0.36 -0.44 1.01 -0.74 -4.94 120.40 121.10 1wgo s VAL 115 Ca -0.02 0.14 -0.16 0.00 0.00 0.00 0.00 61.98 61.94 1wgo s VAL 115 Cb -0.15 -3.45 -0.00 0.00 0.00 0.00 0.00 36.38 32.78 1wgo s VAL 115 CO -0.00 0.36 0.38 -1.58 0.00 0.00 0.00 175.10 174.26 1wgo s GLN 116 N 1.01 3.43 -0.16 2.72 0.74 -1.26 -1.05 119.66 125.08 1wgo s GLN 116 Ca 0.07 -0.52 -0.02 0.00 0.05 0.00 0.00 55.36 54.95 1wgo s GLN 116 Cb -0.13 -3.85 -0.01 0.00 1.10 0.00 0.00 33.01 30.11 1wgo s GLN 116 CO 0.04 -0.62 -0.10 0.54 -0.55 0.00 0.00 175.29 174.60 1wgo s VAL 117 N 2.04 3.21 1.07 1.34 0.11 -1.26 -2.17 120.40 124.74 1wgo s VAL 117 Ca 0.12 -0.59 -0.18 0.00 -2.93 0.00 0.00 61.98 58.40 1wgo s VAL 117 Cb -0.17 -2.39 0.25 0.00 -1.53 0.00 0.00 36.38 32.55 1wgo s VAL 117 CO 0.12 0.49 1.30 -0.24 -3.33 0.00 0.00 175.10 173.44 1wgo n SER 118 N 3.92 -0.48 -1.53 3.54 2.88 0.65 -2.48 113.62 120.12 1wgo n SER 118 Ca -0.18 -1.41 0.00 0.00 -1.33 0.00 0.00 58.87 55.95 1wgo n SER 118 Cb 0.52 -1.04 0.00 0.00 -0.75 0.00 0.00 64.21 62.94 1wgo n SER 118 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wgo n GLY 119 N -4.14 1.93 0.00 0.46 0.00 -1.26 -4.15 105.19 98.03 1wgo n GLY 119 Ca 0.17 -2.11 0.06 0.00 0.00 0.00 0.00 46.02 44.14 1wgo n GLY 119 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wgo n PRO 120 N -0.76 0.49 -0.33 1.61 -0.04 -1.26 -3.87 135.00 130.83 1wgo n PRO 120 Ca 0.00 0.00 0.30 0.00 -0.04 0.00 0.00 63.50 63.76 1wgo n PRO 120 Cb 0.00 -1.38 0.57 0.00 -0.04 0.00 0.00 33.50 32.65 1wgo n PRO 120 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1wgo h SER 121 N 0.00 0.36 -0.33 3.54 4.64 -2.04 -2.96 113.55 116.76 1wgo h SER 121 Ca 0.00 0.24 -0.64 0.00 -0.47 0.00 0.00 61.79 60.92 1wgo h SER 121 Cb 0.00 0.23 -0.04 0.00 -0.31 0.00 0.00 62.40 62.29 1wgo h SER 121 CO 0.00 -0.36 2.40 -0.24 -0.87 0.00 0.00 176.83 177.76 1wgo n SER 122 N -5.19 3.84 0.00 4.97 2.88 -1.25 -5.29 113.62 113.57 1wgo n SER 122 Ca 0.37 -2.81 0.00 0.00 -1.33 0.00 0.00 58.87 55.09 1wgo n SER 122 Cb 1.23 -1.60 0.00 0.00 -0.75 0.00 0.00 64.21 63.09 1wgo n SER 122 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42