#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 5.43 -1.46 1.61 0.01 -1.26 -4.67 113.70 113.36 1wgo s SER 2 Ca 0.00 -2.29 -0.11 0.00 1.31 0.00 0.00 55.95 54.86 1wgo s SER 2 Cb 0.00 -1.90 0.06 0.00 0.21 0.00 0.00 66.02 64.39 1wgo s SER 2 CO 0.00 -0.53 1.00 -1.20 0.41 0.00 0.00 173.24 172.93 1wgo n SER 3 N 4.29 -4.72 -3.25 2.44 7.64 -1.26 -4.95 113.62 113.80 1wgo n SER 3 Ca 0.00 -0.72 -0.05 0.00 1.01 0.00 0.00 58.87 59.11 1wgo n SER 3 Cb 0.40 -4.21 -0.04 0.00 -1.01 0.00 0.00 64.21 59.36 1wgo n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wgo s GLY 4 N -3.45 -0.82 0.31 0.23 0.00 -1.26 -5.15 107.32 97.18 1wgo s GLY 4 Ca 0.56 0.17 -0.20 0.00 0.00 0.00 0.00 44.72 45.25 1wgo s GLY 4 CO 0.80 3.31 0.83 -0.56 0.00 0.00 0.00 173.10 177.48 1wgo s SER 5 N 2.20 7.03 -0.07 1.64 0.01 -1.26 -4.53 113.70 118.72 1wgo s SER 5 Ca 0.13 1.54 -0.03 0.00 1.31 0.00 0.00 55.95 58.90 1wgo s SER 5 Cb -0.10 -2.47 0.04 0.00 0.21 0.00 0.00 66.02 63.70 1wgo s SER 5 CO -0.18 -0.13 0.12 -0.55 0.41 0.00 0.00 173.24 172.92 1wgo s SER 6 N -1.91 0.80 -0.28 2.44 0.15 -1.26 -5.14 113.70 108.51 1wgo s SER 6 Ca 0.51 0.25 -0.19 0.00 0.70 0.00 0.00 55.95 57.22 1wgo s SER 6 Cb -0.14 0.13 0.09 0.00 -1.71 0.00 0.00 66.02 64.39 1wgo s SER 6 CO 0.19 -0.24 0.75 -0.83 1.20 0.00 0.00 173.24 174.31 1wgo s GLY 7 N 2.16 -0.52 0.07 9.45 0.00 -1.26 -5.17 107.32 112.05 1wgo s GLY 7 Ca 0.03 2.39 0.07 0.00 0.00 0.00 0.00 44.72 47.20 1wgo s GLY 7 CO -0.05 2.19 -0.14 0.00 0.00 0.00 0.00 173.10 175.11 1wgo h GLU 9 N 4.06 -0.54 -5.74 0.00 4.57 -2.08 -3.48 114.58 111.37 1wgo h GLU 9 Ca -0.49 0.04 -0.35 0.00 -1.18 0.00 0.00 59.36 57.38 1wgo h GLU 9 Cb 1.16 0.12 0.15 0.00 -0.16 0.00 0.00 28.75 30.02 1wgo h GLU 9 CO 0.50 -0.23 -0.79 0.41 -1.18 0.00 0.00 179.01 177.72 1wgo n GLY 10 N -0.37 -0.39 2.85 1.92 0.00 -1.26 -4.94 105.19 102.99 1wgo n GLY 10 Ca -0.10 0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1wgo n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wgo n GLY 11 N -1.23 5.78 3.63 -0.02 0.00 -1.26 -5.04 105.19 107.05 1wgo n GLY 11 Ca -0.28 -2.72 -0.24 0.00 0.00 0.00 0.00 46.02 42.78 1wgo n GLY 11 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1wgo s VAL 12 N -4.43 3.37 -0.19 1.61 -7.23 -1.26 -5.07 120.40 107.21 1wgo s VAL 12 Ca 0.46 -1.89 -0.21 0.00 -1.81 0.00 0.00 61.98 58.53 1wgo s VAL 12 Cb 0.25 -2.78 -0.18 0.00 0.56 0.00 0.00 36.38 34.23 1wgo s VAL 12 CO -0.14 -0.33 0.25 -2.24 -0.31 0.00 0.00 175.10 172.33 1wgo h ASP 13 N 2.07 0.00 -6.96 4.85 2.03 -2.06 -3.48 116.42 112.86 1wgo h ASP 13 Ca -0.44 -0.52 -0.59 0.00 -0.73 0.00 0.00 57.03 54.75 1wgo h ASP 13 Cb 1.24 0.00 -0.27 0.00 -0.83 0.00 0.00 39.33 39.47 1wgo h ASP 13 CO 0.59 1.33 -0.89 0.23 -1.03 0.00 0.00 179.24 179.48 1wgo n MET 14 N -4.48 -1.84 -2.02 4.15 2.81 -1.26 -4.77 117.12 109.71 1wgo n MET 14 Ca -0.26 0.24 -0.31 0.00 -1.81 0.00 0.00 57.70 55.56 1wgo n MET 14 Cb 0.60 -4.66 -0.04 0.00 -0.71 0.00 0.00 33.22 28.41 1wgo n MET 14 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 1wgo s GLN 15 N -7.10 2.55 -0.27 0.03 -1.52 -1.26 -4.93 119.66 107.15 1wgo s GLN 15 Ca 0.60 0.09 -0.06 0.00 -1.95 0.00 0.00 55.36 54.04 1wgo s GLN 15 Cb -0.34 -4.80 0.00 0.00 -0.22 0.00 0.00 33.01 27.66 1wgo s GLN 15 CO 0.98 -3.17 0.04 -0.65 -0.25 0.00 0.00 175.29 172.24 1wgo s GLN 16 N 7.10 3.16 0.30 2.91 -0.21 -1.26 -5.08 119.66 126.58 1wgo s GLN 16 Ca 0.70 -0.79 -0.29 0.00 0.02 0.00 0.00 55.36 55.00 1wgo s GLN 16 Cb -0.09 -3.26 -0.13 0.00 1.00 0.00 0.00 33.01 30.53 1wgo s GLN 16 CO 0.08 -0.37 1.25 0.45 -2.12 0.00 0.00 175.29 174.58 1wgo n SER 17 N 4.84 2.36 -2.25 5.90 2.88 -1.26 -4.89 113.62 121.20 1wgo n SER 17 Ca -0.15 1.18 -0.30 0.00 -1.33 0.00 0.00 58.87 58.26 1wgo n SER 17 Cb 0.49 -1.41 0.11 0.00 -0.75 0.00 0.00 64.21 62.64 1wgo n SER 17 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wgo n GLN 18 N 1.01 2.57 -0.04 -1.46 6.02 -1.26 -4.61 117.38 119.61 1wgo n GLN 18 Ca 0.08 -3.24 0.04 0.00 -0.01 0.00 0.00 57.00 53.87 1wgo n GLN 18 Cb 0.33 -2.24 0.40 0.00 1.02 0.00 0.00 30.24 29.75 1wgo n GLN 18 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1wgo h VAL 19 N 1.05 1.11 -5.66 5.09 2.07 -2.06 -3.46 116.25 114.39 1wgo h VAL 19 Ca 0.60 -0.22 -0.42 0.00 0.82 0.00 0.00 66.70 67.48 1wgo h VAL 19 Cb 1.48 0.42 0.06 0.00 -1.52 0.00 0.00 31.29 31.73 1wgo h VAL 19 CO 1.39 0.12 -0.68 0.00 0.02 0.00 0.00 177.57 178.41 1wgo n GLN 20 N -4.47 -6.34 -1.21 1.57 1.13 -1.26 -4.83 117.38 101.98 1wgo n GLN 20 Ca 0.04 0.76 -0.43 0.00 -1.94 0.00 0.00 57.00 55.43 1wgo n GLN 20 Cb 0.07 -5.71 -0.04 0.00 0.11 0.00 0.00 30.24 24.67 1wgo n GLN 20 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1wgo n LEU 21 N -4.63 -0.75 -4.94 1.08 4.77 -1.26 -4.93 117.00 106.34 1wgo n LEU 21 Ca -0.01 0.96 -0.24 0.00 -0.03 0.00 0.00 56.01 56.69 1wgo n LEU 21 Cb 0.56 -0.79 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 1wgo n LEU 21 CO 0.63 -2.26 0.28 0.00 -1.33 0.00 0.00 177.39 174.72 1wgo s GLN 22 N -0.60 3.24 0.04 3.23 -2.07 -1.26 -5.11 119.66 117.13 1wgo s GLN 22 Ca 0.61 -0.34 0.06 0.00 -1.82 0.00 0.00 55.36 53.87 1wgo s GLN 22 Cb -0.87 -2.55 -0.02 0.00 -1.09 0.00 0.00 33.01 28.48 1wgo s GLN 22 CO 0.47 -0.16 -0.17 0.00 -1.32 0.00 0.00 175.29 174.12 1wgo s PRO 24 N -1.20 2.54 -0.00 0.00 0.04 -1.26 -4.87 135.00 130.25 1wgo s PRO 24 Ca 0.04 -0.48 -0.26 0.00 0.04 0.00 0.00 61.00 60.34 1wgo s PRO 24 Cb -0.08 -5.10 0.06 0.00 0.04 0.00 0.00 34.50 29.42 1wgo s PRO 24 CO 0.02 -3.51 0.59 -0.48 0.04 0.00 0.00 177.00 173.66 1wgo s LEU 25 N 10.28 -0.32 0.03 -3.56 0.05 -1.26 -5.02 118.68 118.88 1wgo s LEU 25 Ca 0.70 0.44 0.09 0.00 0.05 0.00 0.00 54.13 55.41 1wgo s LEU 25 Cb -0.05 2.29 -0.03 0.00 -2.05 0.00 0.00 46.19 46.35 1wgo s LEU 25 CO 0.02 -0.65 -0.26 0.42 -0.55 0.00 0.00 176.35 175.33 1wgo s THR 26 N -1.75 2.10 0.88 5.48 -4.23 -1.26 -5.04 115.64 111.82 1wgo s THR 26 Ca -0.09 -1.32 -0.11 0.00 -1.18 0.00 0.00 61.69 58.99 1wgo s THR 26 Cb -0.01 -1.78 0.12 0.00 1.34 0.00 0.00 72.50 72.17 1wgo s THR 26 CO 0.04 0.41 1.09 -2.16 -0.54 0.00 0.00 174.62 173.46 1wgo s PRO 27 N -1.10 1.36 -0.20 3.99 0.04 -1.26 -4.46 135.00 133.37 1wgo s PRO 27 Ca 0.11 0.86 -0.29 0.00 0.04 0.00 0.00 61.00 61.72 1wgo s PRO 27 Cb -0.10 -1.82 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 1wgo s PRO 27 CO 0.01 -2.18 1.60 -1.25 0.04 0.00 0.00 177.00 175.22 1wgo s PRO 28 N -4.93 3.85 0.01 0.56 0.04 -1.26 -4.91 135.00 128.36 1wgo s PRO 28 Ca 0.63 1.70 0.06 0.00 0.04 0.00 0.00 61.00 63.44 1wgo s PRO 28 Cb -0.18 -4.02 -0.02 0.00 0.04 0.00 0.00 34.50 30.33 1wgo s PRO 28 CO 0.57 -1.23 -0.20 0.50 0.04 0.00 0.00 177.00 176.68 1wgo s ARG 29 N 4.56 1.50 -1.59 4.56 3.00 -1.26 -4.58 118.95 125.14 1wgo s ARG 29 Ca 0.71 -0.78 0.00 0.00 -1.00 0.00 0.00 55.73 54.65 1wgo s ARG 29 Cb -0.25 -1.51 0.00 0.00 0.00 0.00 0.00 34.95 33.19 1wgo s ARG 29 CO 0.28 0.40 0.00 0.41 0.00 0.00 0.00 175.30 176.40 1wgo n GLY 30 N 2.33 0.45 3.60 8.12 0.00 -1.26 -2.89 105.19 115.54 1wgo n GLY 30 Ca -0.16 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.25 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 -4.50 3.49 0.12 0.99 1.98 -1.26 -3.82 118.68 115.67 1wgo s LEU 31 Ca 0.00 1.57 -0.07 0.00 -2.89 0.00 0.00 54.13 52.74 1wgo s LEU 31 Cb 0.00 -3.52 -0.01 0.00 0.66 0.00 0.00 46.19 43.32 1wgo s LEU 31 CO 0.00 -1.80 0.20 -1.10 -1.89 0.00 0.00 176.35 171.76 1wgo s GLN 32 N 5.92 0.97 0.22 1.98 -0.21 -1.25 -4.09 119.66 123.21 1wgo s GLN 32 Ca 0.89 -1.11 0.11 0.00 0.02 0.00 0.00 55.36 55.27 1wgo s GLN 32 Cb -0.27 0.34 -0.05 0.00 1.00 0.00 0.00 33.01 34.03 1wgo s GLN 32 CO 0.34 -0.32 -0.22 0.14 -2.12 0.00 0.00 175.29 173.11 1wgo s VAL 33 N -3.93 2.33 0.07 1.09 -7.23 -1.26 -3.71 120.40 107.76 1wgo s VAL 33 Ca 0.12 -2.17 -0.05 0.00 -1.81 0.00 0.00 61.98 58.07 1wgo s VAL 33 Cb 0.05 -2.16 -0.02 0.00 0.56 0.00 0.00 36.38 34.81 1wgo s VAL 33 CO -0.05 -0.25 0.09 -0.55 -0.31 0.00 0.00 175.10 174.03 1wgo s SER 34 N -3.00 0.27 -0.27 4.85 0.15 -0.59 -4.96 113.70 110.16 1wgo s SER 34 Ca 0.24 -0.77 -0.11 0.00 0.70 0.00 0.00 55.95 56.01 1wgo s SER 34 Cb -0.06 0.27 -0.05 0.00 -1.71 0.00 0.00 66.02 64.47 1wgo s SER 34 CO 0.11 -0.64 0.18 -0.63 1.20 0.00 0.00 173.24 173.46 1wgo s ILE 35 N -3.69 5.24 -0.77 6.45 1.01 -1.26 0.29 121.20 128.48 1wgo s ILE 35 Ca 0.04 0.15 -0.34 0.00 0.00 0.00 0.00 60.65 60.50 1wgo s ILE 35 Cb 0.05 -3.49 -0.20 0.00 0.01 0.00 0.00 42.46 38.84 1wgo s ILE 35 CO -0.10 0.27 2.35 1.67 0.00 0.00 0.00 174.94 179.13 1wgo n GLN 36 N 4.95 0.00 -0.13 2.79 -0.06 -0.81 -4.14 117.38 119.99 1wgo n GLN 36 Ca -0.14 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.86 1wgo n GLN 36 Cb 0.52 -1.41 0.00 0.00 -4.06 0.00 0.00 30.24 25.29 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 6.45 -1.90 3.58 1.69 0.00 -1.26 -4.86 105.19 108.89 1wgo n GLY 37 Ca 0.58 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.16 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 0.70 1.71 -4.21 1.61 4.07 -1.26 -4.95 120.64 118.31 1wgo n GLU 38 Ca 0.00 0.40 -0.23 0.00 -0.06 0.00 0.00 57.16 57.27 1wgo n GLU 38 Cb 0.00 -3.24 -0.06 0.00 -0.06 0.00 0.00 31.44 28.08 1wgo n GLU 38 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1wgo s ALA 39 N 9.16 3.35 0.03 4.31 0.00 -1.26 -5.06 121.76 132.29 1wgo s ALA 39 Ca 1.01 -1.58 -0.01 0.00 0.00 0.00 0.00 51.96 51.38 1wgo s ALA 39 Cb -0.33 -0.97 -0.01 0.00 0.00 0.00 0.00 23.12 21.81 1wgo s ALA 39 CO 0.34 0.24 -0.02 0.28 0.00 0.00 0.00 175.76 176.60 1wgo n VAL 40 N -1.02 0.60 -3.67 0.00 0.31 -1.26 -5.03 118.33 108.26 1wgo n VAL 40 Ca -0.07 0.16 -0.25 0.00 -0.01 0.00 0.00 64.34 64.17 1wgo n VAL 40 Cb 0.59 -1.57 -0.17 0.00 -0.91 0.00 0.00 33.84 31.77 1wgo n VAL 40 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wgo s ALA 41 N -2.04 0.59 0.35 3.52 0.00 -1.26 -4.74 121.76 118.18 1wgo s ALA 41 Ca -0.02 -0.34 -0.06 0.00 0.00 0.00 0.00 51.96 51.53 1wgo s ALA 41 Cb 0.01 -1.00 -0.05 0.00 0.00 0.00 0.00 23.12 22.07 1wgo s ALA 41 CO 0.03 -1.03 0.65 0.08 0.00 0.00 0.00 175.76 175.49 1wgo s VAL 42 N 2.05 4.94 0.25 0.00 1.01 -0.56 -4.84 120.40 123.24 1wgo s VAL 42 Ca 0.02 0.23 -0.10 0.00 0.00 0.00 0.00 61.98 62.13 1wgo s VAL 42 Cb -0.15 -3.75 -0.07 0.00 0.00 0.00 0.00 36.38 32.40 1wgo s VAL 42 CO -0.08 -0.45 0.57 -0.13 0.00 0.00 0.00 175.10 175.01 1wgo s ARG 43 N -3.81 3.80 -0.03 2.72 3.00 -1.26 -0.89 118.95 122.47 1wgo s ARG 43 Ca 0.46 0.29 -0.30 0.00 0.00 0.00 0.00 55.73 56.18 1wgo s ARG 43 Cb -0.10 -2.62 -0.05 0.00 0.00 0.00 0.00 34.95 32.17 1wgo s ARG 43 CO 0.32 0.29 1.47 -1.25 0.00 0.00 0.00 175.30 176.13 1wgo s PRO 44 N -2.91 4.24 0.00 3.54 0.04 -1.25 -2.71 135.00 135.95 1wgo s PRO 44 Ca 0.48 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.53 1wgo s PRO 44 Cb -0.11 -3.71 0.00 0.00 0.04 0.00 0.00 34.50 30.72 1wgo s PRO 44 CO 0.22 -0.68 0.00 0.41 0.04 0.00 0.00 177.00 176.99 1wgo n GLY 45 N 3.80 1.29 3.80 0.56 0.00 0.63 -4.97 105.19 110.31 1wgo n GLY 45 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.61 4.29 0.28 1.61 0.41 -1.10 -4.67 118.70 118.91 1wgo s GLU 46 Ca 0.00 0.85 -0.28 0.00 -0.41 0.00 0.00 54.97 55.13 1wgo s GLU 46 Cb 0.00 -3.18 -0.09 0.00 -1.78 0.00 0.00 34.13 29.08 1wgo s GLU 46 CO 0.00 0.58 0.94 0.16 -0.49 0.00 0.00 175.26 176.45 1wgo s ASP 47 N -1.23 7.50 -0.07 -0.19 1.47 -1.26 -4.07 116.67 118.82 1wgo s ASP 47 Ca 0.33 1.90 0.04 0.00 1.18 0.00 0.00 52.55 56.00 1wgo s ASP 47 Cb -0.20 -2.60 -0.02 0.00 -0.34 0.00 0.00 42.92 39.77 1wgo s ASP 47 CO 0.21 0.05 -0.19 0.54 0.68 0.00 0.00 175.17 176.46 1wgo s VAL 48 N -1.38 2.55 -0.20 2.11 0.11 -0.58 -4.89 120.40 118.13 1wgo s VAL 48 Ca 0.45 -0.88 -0.14 0.00 -2.93 0.00 0.00 61.98 58.47 1wgo s VAL 48 Cb -0.23 -1.98 -0.04 0.00 -1.53 0.00 0.00 36.38 32.60 1wgo s VAL 48 CO 0.28 0.57 0.33 -0.76 -3.33 0.00 0.00 175.10 172.19 1wgo s LEU 49 N -0.21 4.17 -0.32 2.54 2.01 -1.26 -2.86 118.68 122.76 1wgo s LEU 49 Ca -0.01 0.44 -0.07 0.00 0.01 0.00 0.00 54.13 54.50 1wgo s LEU 49 Cb -0.13 -2.41 0.02 0.00 0.01 0.00 0.00 46.19 43.67 1wgo s LEU 49 CO 0.03 -0.02 0.11 -0.36 1.01 0.00 0.00 176.35 177.13 1wgo s PHE 50 N 1.09 3.19 -0.11 0.29 0.08 -1.04 -1.92 117.98 119.56 1wgo s PHE 50 Ca 0.16 -1.04 -0.18 0.00 0.12 0.00 0.00 56.93 55.99 1wgo s PHE 50 Cb -0.14 -2.29 -0.04 0.00 -0.57 0.00 0.00 43.02 39.97 1wgo s PHE 50 CO 0.06 -0.61 0.47 0.08 -0.10 0.00 0.00 175.22 175.13 1wgo s VAL 51 N 1.49 5.18 -0.11 -0.44 1.01 0.15 -2.98 120.40 124.69 1wgo s VAL 51 Ca 0.02 0.94 -0.00 0.00 0.00 0.00 0.00 61.98 62.94 1wgo s VAL 51 Cb -0.18 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 1wgo s VAL 51 CO 0.03 0.34 -0.09 0.54 0.00 0.00 0.00 175.10 175.92 1wgo s VAL 52 N 0.52 3.42 0.04 2.92 0.11 -1.26 -1.54 120.40 124.61 1wgo s VAL 52 Ca 0.26 -0.55 -0.22 0.00 -2.93 0.00 0.00 61.98 58.54 1wgo s VAL 52 Cb -0.15 -2.44 0.05 0.00 -1.53 0.00 0.00 36.38 32.31 1wgo s VAL 52 CO 0.10 0.54 0.50 -0.60 -3.33 0.00 0.00 175.10 172.31 1wgo s ARG 53 N -0.03 1.00 0.10 1.54 6.06 -1.24 -4.83 118.95 121.54 1wgo s ARG 53 Ca -0.01 -0.24 0.05 0.00 -2.50 0.00 0.00 55.73 53.03 1wgo s ARG 53 Cb -0.14 0.46 -0.04 0.00 0.06 0.00 0.00 34.95 35.29 1wgo s ARG 53 CO 0.03 -0.35 0.00 -1.14 -2.50 0.00 0.00 175.30 171.34 1wgo s GLN 54 N -2.36 2.55 0.05 5.12 2.00 -1.26 -3.81 119.66 121.95 1wgo s GLN 54 Ca -0.06 -0.85 -0.21 0.00 -2.00 0.00 0.00 55.36 52.24 1wgo s GLN 54 Cb -0.01 -2.54 -0.13 0.00 0.80 0.00 0.00 33.01 31.14 1wgo s GLN 54 CO -0.01 0.53 1.45 0.93 -0.50 0.00 0.00 175.29 177.70 1wgo h GLU 55 N 3.36 0.29 0.00 1.67 4.39 -1.63 -3.34 114.58 119.32 1wgo h GLU 55 Ca -0.48 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 59.12 1wgo h GLU 55 Cb 1.17 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 1wgo h GLU 55 CO 0.60 0.55 -0.54 1.04 -1.16 0.00 0.00 179.01 179.51 1wgo n GLN 56 N -4.71 3.80 0.00 2.33 6.02 -1.25 -5.06 117.38 118.51 1wgo n GLN 56 Ca -0.05 -0.01 0.00 0.00 -0.01 0.00 0.00 57.00 56.92 1wgo n GLN 56 Cb 0.25 -0.85 0.00 0.00 1.02 0.00 0.00 30.24 30.65 1wgo n GLN 56 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1wgo n GLY 57 N 1.44 1.93 2.38 1.08 0.00 -1.26 -4.75 105.19 106.01 1wgo n GLY 57 Ca 0.00 0.07 -0.17 0.00 0.00 0.00 0.00 46.02 45.92 1wgo n GLY 57 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wgo n ASP 58 N 0.95 -4.79 -4.57 1.61 8.00 -1.26 -4.85 116.55 111.64 1wgo n ASP 58 Ca 0.00 0.20 -0.34 0.00 0.71 0.00 0.00 54.79 55.36 1wgo n ASP 58 Cb 0.00 -4.12 -0.11 0.00 -0.02 0.00 0.00 41.12 36.87 1wgo n ASP 58 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1wgo s VAL 59 N -2.70 4.18 1.06 2.53 0.11 -1.26 -4.16 120.40 120.16 1wgo s VAL 59 Ca 0.00 -0.27 -0.14 0.00 -2.93 0.00 0.00 61.98 58.64 1wgo s VAL 59 Cb 0.00 -2.82 0.23 0.00 -1.53 0.00 0.00 36.38 32.26 1wgo s VAL 59 CO 0.00 0.52 0.51 0.00 -3.33 0.00 0.00 175.10 172.80 1wgo n LEU 60 N 3.16 0.00 -4.60 2.54 -0.00 -1.26 -4.67 117.00 112.17 1wgo n LEU 60 Ca -0.17 -0.51 -0.57 0.00 -0.00 0.00 0.00 56.01 54.75 1wgo n LEU 60 Cb 0.53 -0.78 -0.08 0.00 -0.00 0.00 0.00 43.42 43.09 1wgo n LEU 60 CO 0.32 -2.48 1.47 0.35 -0.00 0.00 0.00 177.39 177.05 1wgo n THR 61 N -4.66 0.23 -4.82 1.47 -2.24 -1.26 -4.94 114.28 98.06 1wgo n THR 61 Ca 0.08 -0.09 -0.26 0.00 -2.27 0.00 0.00 64.05 61.51 1wgo n THR 61 Cb 0.35 -1.20 -0.16 0.00 -2.10 0.00 0.00 70.33 67.22 1wgo n THR 61 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1wgo s THR 62 N 4.67 1.42 -0.09 4.28 2.01 -1.26 -4.90 115.64 121.77 1wgo s THR 62 Ca 1.04 -0.69 -0.29 0.00 0.31 0.00 0.00 61.69 62.05 1wgo s THR 62 Cb -1.10 -1.23 -0.02 0.00 0.01 0.00 0.00 72.50 70.17 1wgo s THR 62 CO 0.63 0.41 0.97 -0.54 -0.69 0.00 0.00 174.62 175.41 1wgo s LYS 63 N 0.15 4.44 -0.24 4.92 1.02 -1.26 -2.61 119.74 126.16 1wgo s LYS 63 Ca -0.06 1.35 -0.03 0.00 0.02 0.00 0.00 55.97 57.25 1wgo s LYS 63 Cb -0.12 -3.52 0.01 0.00 -0.52 0.00 0.00 37.83 33.67 1wgo s LYS 63 CO 0.03 -0.25 -0.05 0.71 -0.92 0.00 0.00 175.35 174.87 1wgo s TYR 64 N 1.78 3.02 -0.07 3.18 2.02 -0.54 -3.54 117.35 123.21 1wgo s TYR 64 Ca 0.48 -1.34 -0.24 0.00 -0.37 0.00 0.00 57.07 55.60 1wgo s TYR 64 Cb -0.19 -2.08 -0.04 0.00 -0.40 0.00 0.00 41.96 39.26 1wgo s TYR 64 CO 0.19 -0.67 0.72 -0.65 -1.57 0.00 0.00 175.55 173.57 1wgo s GLN 65 N 1.38 4.44 -0.26 -0.62 -1.52 0.46 -2.78 119.66 120.75 1wgo s GLN 65 Ca 0.02 0.91 -0.07 0.00 -1.95 0.00 0.00 55.36 54.27 1wgo s GLN 65 Cb -0.16 -3.45 -0.02 0.00 -0.22 0.00 0.00 33.01 29.16 1wgo s GLN 65 CO -0.04 0.04 0.07 0.08 -0.25 0.00 0.00 175.29 175.19 1wgo s VAL 66 N 0.86 4.18 -0.29 1.09 1.01 -1.16 -1.98 120.40 124.10 1wgo s VAL 66 Ca 0.38 -0.34 -0.01 0.00 0.00 0.00 0.00 61.98 62.01 1wgo s VAL 66 Cb -0.18 -3.01 0.05 0.00 0.00 0.00 0.00 36.38 33.24 1wgo s VAL 66 CO 0.18 0.26 -0.02 -1.81 0.00 0.00 0.00 175.10 173.72 1wgo s ASP 67 N 1.58 4.77 -0.09 3.32 1.11 -0.54 -3.72 116.67 123.09 1wgo s ASP 67 Ca 0.05 -1.23 -0.18 0.00 0.18 0.00 0.00 52.55 51.38 1wgo s ASP 67 Cb -0.16 -1.69 -0.15 0.00 1.07 0.00 0.00 42.92 42.00 1wgo s ASP 67 CO 0.03 -0.23 0.59 -0.07 1.18 0.00 0.00 175.17 176.67 1wgo h LEU 68 N 7.98 -0.07 0.00 1.23 -0.00 -1.80 -1.97 115.31 120.68 1wgo h LEU 68 Ca -0.22 -0.47 0.00 0.00 -0.00 0.00 0.00 57.88 57.18 1wgo h LEU 68 Cb 1.07 0.02 0.00 0.00 -0.00 0.00 0.00 40.66 41.74 1wgo h LEU 68 CO 0.53 0.62 0.00 0.61 -0.00 0.00 0.00 178.44 180.20 1wgo n GLY 69 N 1.27 3.22 0.38 0.83 0.00 -1.25 -3.78 105.19 105.86 1wgo n GLY 69 Ca -0.06 -0.92 -0.13 0.00 0.00 0.00 0.00 46.02 44.92 1wgo n GLY 69 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1wgo h ASP 70 N 0.00 -1.30 0.00 1.61 3.58 -1.95 -3.44 116.42 114.92 1wgo h ASP 70 Ca 0.00 0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.59 1wgo h ASP 70 Cb 0.00 0.49 0.00 0.00 1.72 0.00 0.00 39.33 41.54 1wgo h ASP 70 CO 0.00 -0.42 0.00 0.61 -2.88 0.00 0.00 179.24 176.55 1wgo n GLY 71 N -1.37 0.00 3.26 -0.78 0.00 -1.26 -5.15 105.19 99.90 1wgo n GLY 71 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 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 2.49 -0.04 1.61 5.36 -1.26 -5.12 117.98 121.03 1wgo s PHE 72 Ca 0.00 -0.81 -0.02 0.00 -0.96 0.00 0.00 56.93 55.14 1wgo s PHE 72 Cb 0.00 -1.64 0.03 0.00 -0.34 0.00 0.00 43.02 41.07 1wgo s PHE 72 CO 0.00 -0.27 0.06 0.15 -1.46 0.00 0.00 175.22 173.70 1wgo s LYS 73 N -0.00 -0.07 -0.04 10.12 1.02 -1.26 -3.46 119.74 126.04 1wgo s LYS 73 Ca -0.08 0.37 -0.06 0.00 0.02 0.00 0.00 55.97 56.21 1wgo s LYS 73 Cb -0.15 -0.48 0.01 0.00 -0.52 0.00 0.00 37.83 36.69 1wgo s LYS 73 CO 0.05 -0.32 0.16 0.00 -0.92 0.00 0.00 175.35 174.33 1wgo s ALA 74 N 2.08 -0.39 -0.28 5.17 0.00 -1.24 -5.11 121.76 121.99 1wgo s ALA 74 Ca 0.04 0.29 -0.07 0.00 0.00 0.00 0.00 51.96 52.22 1wgo s ALA 74 Cb -0.12 -0.16 -0.00 0.00 0.00 0.00 0.00 23.12 22.84 1wgo s ALA 74 CO -0.03 -0.12 0.07 1.41 0.00 0.00 0.00 175.76 177.09 1wgo s MET 75 N -0.37 3.28 -0.13 0.00 1.75 -1.26 -2.96 119.30 119.60 1wgo s MET 75 Ca -0.05 -0.73 -0.02 0.00 -1.25 0.00 0.00 55.69 53.64 1wgo s MET 75 Cb -0.03 -3.34 -0.03 0.00 2.84 0.00 0.00 34.83 34.27 1wgo s MET 75 CO 0.01 -0.36 -0.06 0.71 -0.65 0.00 0.00 175.02 174.68 1wgo s TYR 76 N 1.54 2.98 -0.11 4.11 2.02 -1.12 -5.04 117.35 121.74 1wgo s TYR 76 Ca 0.04 -0.25 -0.02 0.00 -0.37 0.00 0.00 57.07 56.47 1wgo s TYR 76 Cb -0.16 -1.88 -0.03 0.00 -0.40 0.00 0.00 41.96 39.48 1wgo s TYR 76 CO 0.02 0.04 -0.02 0.54 -1.57 0.00 0.00 175.55 174.57 1wgo s VAL 77 N 0.05 4.11 -1.64 0.71 0.11 -1.26 -1.47 120.40 121.00 1wgo s VAL 77 Ca -0.01 -0.31 -0.01 0.00 -2.93 0.00 0.00 61.98 58.73 1wgo s VAL 77 Cb -0.14 -2.75 0.00 0.00 -1.53 0.00 0.00 36.38 31.97 1wgo s VAL 77 CO 0.03 0.57 0.08 0.59 -3.33 0.00 0.00 175.10 173.04 1wgo n ASN 78 N 2.60 -5.65 -0.31 3.54 3.02 -1.07 -4.83 115.26 112.55 1wgo n ASN 78 Ca -0.18 -0.05 0.35 0.00 -0.03 0.00 0.00 54.58 54.66 1wgo n ASN 78 Cb 0.53 -4.65 0.74 0.00 -0.61 0.00 0.00 39.78 35.79 1wgo n ASN 78 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1wgo h LEU 79 N -0.19 0.00 0.14 3.41 5.85 -1.79 -0.22 115.31 122.51 1wgo h LEU 79 Ca -0.47 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 1wgo h LEU 79 Cb 1.34 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.38 1wgo h LEU 79 CO 0.55 0.00 -0.07 0.71 -0.34 0.00 0.00 178.44 179.29 1wgo h THR 80 N 0.00 0.85 -0.48 1.05 1.35 -1.88 -2.27 112.91 111.53 1wgo h THR 80 Ca 0.56 -1.22 0.09 0.00 -0.55 0.00 0.00 66.41 65.29 1wgo h THR 80 Cb 2.31 1.46 -0.10 0.00 -1.73 0.00 0.00 68.15 70.09 1wgo h THR 80 CO -0.01 0.23 -0.29 0.25 -0.25 0.00 0.00 175.52 175.46 1wgo h LEU 81 N -0.89 -0.97 -1.59 3.87 6.46 -1.43 0.24 115.31 121.00 1wgo h LEU 81 Ca -0.02 0.20 -0.05 0.00 -0.12 0.00 0.00 57.88 57.89 1wgo h LEU 81 Cb 0.52 0.49 -0.01 0.00 -0.73 0.00 0.00 40.66 40.94 1wgo h LEU 81 CO 0.03 -0.29 -0.22 0.71 -0.62 0.00 0.00 178.44 178.06 1wgo h THR 82 N -0.18 1.06 -0.86 1.05 1.35 -1.53 -3.45 112.91 110.35 1wgo h THR 82 Ca 0.21 -0.77 -0.29 0.00 -0.55 0.00 0.00 66.41 65.01 1wgo h THR 82 Cb 0.52 1.42 -0.12 0.00 -1.73 0.00 0.00 68.15 68.25 1wgo h THR 82 CO -0.58 0.21 -0.27 0.61 -0.25 0.00 0.00 175.52 175.24 1wgo n GLY 83 N -0.82 1.36 3.74 5.82 0.00 0.84 -4.93 105.19 111.20 1wgo n GLY 83 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.16 4.62 1.01 1.61 2.02 -1.25 -5.02 118.70 118.53 1wgo s GLU 84 Ca 0.00 1.27 -0.13 0.00 0.02 0.00 0.00 54.97 56.14 1wgo s GLU 84 Cb 0.00 -3.35 0.20 0.00 0.10 0.00 0.00 34.13 31.08 1wgo s GLU 84 CO 0.00 0.30 1.09 -1.25 0.02 0.00 0.00 175.26 175.43 1wgo s PRO 85 N -0.24 0.30 -0.31 0.39 0.04 -1.26 -4.89 135.00 129.02 1wgo s PRO 85 Ca 0.42 0.48 0.02 0.00 0.04 0.00 0.00 61.00 61.95 1wgo s PRO 85 Cb -0.22 -1.73 0.08 0.00 0.04 0.00 0.00 34.50 32.67 1wgo s PRO 85 CO 0.27 -2.81 0.01 0.42 0.04 0.00 0.00 177.00 174.93 1wgo s ILE 86 N -2.97 2.53 0.14 0.56 1.01 -1.16 -4.92 121.20 116.39 1wgo s ILE 86 Ca 0.66 -1.87 -0.27 0.00 0.00 0.00 0.00 60.65 59.16 1wgo s ILE 86 Cb -0.19 -2.63 -0.07 0.00 0.01 0.00 0.00 42.46 39.58 1wgo s ILE 86 CO 0.58 -0.32 0.84 -0.60 0.00 0.00 0.00 174.94 175.44 1wgo s ARG 87 N 1.07 4.64 -0.30 2.79 3.52 -1.26 -2.48 118.95 126.92 1wgo s ARG 87 Ca 0.01 1.26 -0.11 0.00 -0.13 0.00 0.00 55.73 56.75 1wgo s ARG 87 Cb -0.20 -3.31 0.16 0.00 -1.56 0.00 0.00 34.95 30.03 1wgo s ARG 87 CO -0.05 0.43 0.81 -1.58 -0.81 0.00 0.00 175.30 174.10 1wgo s HIS 88 N -0.68 -1.05 0.03 5.12 2.46 -1.13 -4.95 115.29 115.09 1wgo s HIS 88 Ca 0.40 1.66 0.04 0.00 0.47 0.00 0.00 55.06 57.63 1wgo s HIS 88 Cb -0.23 0.57 -0.04 0.00 -0.13 0.00 0.00 32.58 32.75 1wgo s HIS 88 CO 0.27 -0.53 -0.07 -0.98 -2.47 0.00 0.00 174.74 170.96 1wgo s ARG 89 N 2.72 2.46 0.19 2.88 1.04 -1.26 -1.52 118.95 125.45 1wgo s ARG 89 Ca -0.01 -0.79 0.06 0.00 -1.04 0.00 0.00 55.73 53.95 1wgo s ARG 89 Cb -0.10 -2.46 -0.04 0.00 -2.04 0.00 0.00 34.95 30.32 1wgo s ARG 89 CO -0.18 0.58 0.10 0.71 -0.04 0.00 0.00 175.30 176.47 1wgo s TYR 90 N -1.05 3.02 -0.17 5.89 2.02 -1.26 -4.97 117.35 120.83 1wgo s TYR 90 Ca 0.18 -0.08 -0.14 0.00 -0.37 0.00 0.00 57.07 56.66 1wgo s TYR 90 Cb -0.11 -1.43 -0.06 0.00 -0.40 0.00 0.00 41.96 39.96 1wgo s TYR 90 CO 0.09 0.53 -0.26 0.39 -1.57 0.00 0.00 175.55 174.72 1wgo n GLU 91 N -0.47 0.50 -3.63 -0.62 1.02 -1.26 -0.27 120.64 115.93 1wgo n GLU 91 Ca -0.08 0.35 -0.33 0.00 -0.02 0.00 0.00 57.16 57.07 1wgo n GLU 91 Cb 0.56 -1.55 -0.05 0.00 -0.02 0.00 0.00 31.44 30.38 1wgo n GLU 91 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1wgo s SER 92 N -5.95 6.57 0.78 1.62 1.04 -1.26 -4.35 113.70 112.15 1wgo s SER 92 Ca -0.24 0.70 -0.11 0.00 0.48 0.00 0.00 55.95 56.78 1wgo s SER 92 Cb 0.04 -2.14 0.06 0.00 0.10 0.00 0.00 66.02 64.08 1wgo s SER 92 CO 0.35 0.13 1.09 -2.16 0.98 0.00 0.00 173.24 173.64 1wgo s PRO 93 N -2.19 2.16 0.00 4.02 0.04 -1.26 -4.97 135.00 132.80 1wgo s PRO 93 Ca 0.36 1.14 0.00 0.00 0.04 0.00 0.00 61.00 62.53 1wgo s PRO 93 Cb -0.13 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1wgo s PRO 93 CO 0.20 -1.70 0.00 0.41 0.04 0.00 0.00 177.00 175.95 1wgo n GLY 94 N -1.20 4.38 3.67 0.56 0.00 -1.14 -5.05 105.19 106.41 1wgo n GLY 94 Ca 0.09 -0.82 -0.47 0.00 0.00 0.00 0.00 46.02 44.82 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 -0.45 0.61 -3.57 -0.61 5.41 -1.26 -4.50 119.36 114.98 1wgo n ILE 95 Ca 0.00 -0.12 -0.24 0.00 1.00 0.00 0.00 62.75 63.39 1wgo n ILE 95 Cb 0.00 -1.95 -0.02 0.00 -0.71 0.00 0.00 39.64 36.96 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 4.29 3.49 -0.27 1.39 2.02 -1.08 -4.95 117.35 122.22 1wgo s TYR 96 Ca 0.93 0.27 0.01 0.00 -0.37 0.00 0.00 57.07 57.91 1wgo s TYR 96 Cb -0.65 -1.82 0.05 0.00 -0.40 0.00 0.00 41.96 39.15 1wgo s TYR 96 CO 0.50 0.24 -0.07 1.03 -1.57 0.00 0.00 175.55 175.68 1wgo s ARG 97 N -4.06 2.35 -0.07 -0.62 0.52 -1.25 -2.26 118.95 113.57 1wgo s ARG 97 Ca 0.38 -1.29 0.01 0.00 -0.52 0.00 0.00 55.73 54.32 1wgo s ARG 97 Cb -0.10 -2.99 -0.03 0.00 0.52 0.00 0.00 34.95 32.36 1wgo s ARG 97 CO 0.33 -0.57 -0.09 0.08 0.02 0.00 0.00 175.30 175.07 1wgo s VAL 98 N 1.17 3.50 0.01 3.52 1.01 -0.57 -3.90 120.40 125.14 1wgo s VAL 98 Ca -0.07 -0.55 -0.06 0.00 0.00 0.00 0.00 61.98 61.30 1wgo s VAL 98 Cb -0.20 -2.42 -0.00 0.00 0.00 0.00 0.00 36.38 33.76 1wgo s VAL 98 CO -0.04 0.58 0.11 -0.44 0.00 0.00 0.00 175.10 175.32 1wgo s SER 99 N -0.63 0.09 -0.10 3.32 0.01 -0.74 -0.28 113.70 115.37 1wgo s SER 99 Ca 0.09 -0.33 0.03 0.00 1.31 0.00 0.00 55.95 57.06 1wgo s SER 99 Cb -0.11 0.20 0.01 0.00 0.21 0.00 0.00 66.02 66.33 1wgo s SER 99 CO 0.02 -0.41 -0.18 0.54 0.41 0.00 0.00 173.24 173.62 1wgo s VAL 100 N -1.75 1.61 -0.16 3.43 0.11 -0.87 -1.47 120.40 121.30 1wgo s VAL 100 Ca -0.12 -0.74 0.01 0.00 -2.93 0.00 0.00 61.98 58.20 1wgo s VAL 100 Cb -0.06 -1.44 0.02 0.00 -1.53 0.00 0.00 36.38 33.37 1wgo s VAL 100 CO -0.00 0.46 -0.17 -0.60 -3.33 0.00 0.00 175.10 171.46 1wgo s ARG 101 N 0.68 2.63 0.02 1.54 3.00 -0.84 -1.36 118.95 124.61 1wgo s ARG 101 Ca -0.13 -0.69 0.05 0.00 -1.00 0.00 0.00 55.73 53.96 1wgo s ARG 101 Cb -0.16 -2.31 -0.02 0.00 0.00 0.00 0.00 34.95 32.46 1wgo s ARG 101 CO 0.03 -0.20 -0.15 0.00 0.00 0.00 0.00 175.30 174.98 1wgo s ALA 102 N 1.34 1.22 -0.23 6.12 0.00 -0.67 -0.40 121.76 129.14 1wgo s ALA 102 Ca 0.04 -0.75 -0.03 0.00 0.00 0.00 0.00 51.96 51.21 1wgo s ALA 102 Cb -0.13 -0.24 0.12 0.00 0.00 0.00 0.00 23.12 22.86 1wgo s ALA 102 CO -0.11 0.26 0.32 -2.00 0.00 0.00 0.00 175.76 174.24 1wgo s GLU 103 N -0.81 0.29 0.38 0.00 2.12 -1.23 -1.47 118.70 117.99 1wgo s GLU 103 Ca 0.04 0.44 0.08 0.00 0.36 0.00 0.00 54.97 55.89 1wgo s GLU 103 Cb -0.07 -0.69 -0.05 0.00 0.26 0.00 0.00 34.13 33.58 1wgo s GLU 103 CO 0.01 -0.63 0.12 0.54 -0.54 0.00 0.00 175.26 174.76 1wgo s ASN 104 N 2.47 4.37 0.30 -1.70 4.22 0.52 -4.62 114.94 120.51 1wgo s ASN 104 Ca 0.10 -1.03 0.06 0.00 -2.14 0.00 0.00 52.86 49.85 1wgo s ASN 104 Cb -0.15 -0.53 0.80 0.00 1.28 0.00 0.00 41.25 42.65 1wgo s ASN 104 CO -0.14 -0.43 1.68 0.74 -2.04 0.00 0.00 177.10 176.91 1wgo h THR 105 N 1.56 0.41 0.00 0.54 2.02 -1.99 -2.81 112.91 112.64 1wgo h THR 105 Ca -0.43 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 66.63 1wgo h THR 105 Cb 1.25 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1wgo h THR 105 CO 0.69 0.07 0.00 0.00 0.37 0.00 0.00 175.52 176.64 1wgo n ALA 106 N -2.50 -0.33 -3.00 6.16 0.00 -1.26 -5.01 120.51 114.57 1wgo n ALA 106 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1wgo n ALA 106 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.17 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 -0.47 4.84 3.47 0.00 0.00 -1.06 -4.79 105.19 107.18 1wgo n GLY 107 Ca 0.00 -1.10 -0.11 0.00 0.00 0.00 0.00 46.02 44.81 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 -0.31 -0.36 0.14 1.61 -3.43 -1.26 -0.36 115.29 111.32 1wgo s HIS 108 Ca 0.00 0.07 -0.25 0.00 -0.80 0.00 0.00 55.06 54.08 1wgo s HIS 108 Cb 0.00 0.49 0.07 0.00 -1.43 0.00 0.00 32.58 31.72 1wgo s HIS 108 CO 0.00 -0.88 1.02 0.34 -2.00 0.00 0.00 174.74 173.21 1wgo s ASP 109 N -2.80 -0.13 -0.13 7.38 2.15 -0.54 -4.65 116.67 117.94 1wgo s ASP 109 Ca 0.04 -0.41 -0.25 0.00 0.43 0.00 0.00 52.55 52.36 1wgo s ASP 109 Cb -0.01 0.45 0.06 0.00 -0.30 0.00 0.00 42.92 43.12 1wgo s ASP 109 CO -0.08 -0.84 0.61 -0.70 -0.17 0.00 0.00 175.17 173.99 1wgo s GLU 110 N -2.99 0.86 0.37 4.34 -6.30 -1.26 -1.66 118.70 112.05 1wgo s GLU 110 Ca 0.14 0.49 0.05 0.00 -2.50 0.00 0.00 54.97 53.14 1wgo s GLU 110 Cb -0.01 0.41 -0.07 0.00 0.00 0.00 0.00 34.13 34.47 1wgo s GLU 110 CO 0.02 -0.20 0.04 0.00 0.02 0.00 0.00 175.26 175.14 1wgo s ALA 111 N -0.51 2.74 -0.05 6.30 0.00 -0.46 -4.92 121.76 124.86 1wgo s ALA 111 Ca -0.06 -2.04 -0.03 0.00 0.00 0.00 0.00 51.96 49.83 1wgo s ALA 111 Cb -0.03 0.47 0.03 0.00 0.00 0.00 0.00 23.12 23.59 1wgo s ALA 111 CO 0.05 -0.23 0.12 0.08 0.00 0.00 0.00 175.76 175.77 1wgo s VAL 112 N -3.07 -0.03 -0.03 0.00 1.01 -1.26 -2.06 120.40 114.96 1wgo s VAL 112 Ca 0.34 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.45 1wgo s VAL 112 Cb 0.09 -0.19 0.01 0.00 0.00 0.00 0.00 36.38 36.29 1wgo s VAL 112 CO 0.16 0.05 -0.05 -0.22 0.00 0.00 0.00 175.10 175.03 1wgo s LEU 113 N 0.70 1.63 -0.25 3.92 0.20 0.62 -4.91 118.68 120.59 1wgo s LEU 113 Ca -0.05 -0.12 -0.07 0.00 0.69 0.00 0.00 54.13 54.57 1wgo s LEU 113 Cb -0.07 -0.40 -0.03 0.00 -0.43 0.00 0.00 46.19 45.26 1wgo s LEU 113 CO -0.03 0.01 0.07 -0.36 -0.29 0.00 0.00 176.35 175.75 1wgo s PHE 114 N 0.44 3.09 0.14 5.38 0.40 -1.26 -1.51 117.98 124.66 1wgo s PHE 114 Ca -0.06 -0.39 -0.09 0.00 -0.60 0.00 0.00 56.93 55.80 1wgo s PHE 114 Cb -0.09 -2.23 -0.06 0.00 0.51 0.00 0.00 43.02 41.14 1wgo s PHE 114 CO 0.00 -0.33 0.45 0.08 0.70 0.00 0.00 175.22 176.12 1wgo s VAL 115 N 1.55 5.04 -0.21 -0.44 1.01 -0.96 -4.99 120.40 121.41 1wgo s VAL 115 Ca 0.06 0.41 0.01 0.00 0.00 0.00 0.00 61.98 62.46 1wgo s VAL 115 Cb -0.15 -3.65 0.04 0.00 0.00 0.00 0.00 36.38 32.63 1wgo s VAL 115 CO 0.04 0.14 -0.10 -1.58 0.00 0.00 0.00 175.10 173.60 1wgo s GLN 116 N -2.29 2.05 -0.21 2.72 0.74 -1.26 -2.65 119.66 118.75 1wgo s GLN 116 Ca 0.39 -0.90 0.01 0.00 0.05 0.00 0.00 55.36 54.91 1wgo s GLN 116 Cb -0.13 -2.48 0.04 0.00 1.10 0.00 0.00 33.01 31.55 1wgo s GLN 116 CO 0.20 -0.45 -0.12 0.54 -0.55 0.00 0.00 175.29 174.92 1wgo s VAL 117 N 1.37 1.82 1.08 1.34 0.11 -1.26 -1.49 120.40 123.37 1wgo s VAL 117 Ca -0.02 -1.17 -0.16 0.00 -2.93 0.00 0.00 61.98 57.71 1wgo s VAL 117 Cb -0.17 -1.88 0.23 0.00 -1.53 0.00 0.00 36.38 33.03 1wgo s VAL 117 CO -0.08 0.16 1.12 -0.94 -3.33 0.00 0.00 175.10 172.02 1wgo s SER 118 N 1.31 1.93 0.37 3.54 1.04 -0.07 -2.89 113.70 118.93 1wgo s SER 118 Ca -0.03 0.86 0.04 0.00 0.48 0.00 0.00 55.95 57.31 1wgo s SER 118 Cb -0.17 -1.31 -0.03 0.00 0.10 0.00 0.00 66.02 64.62 1wgo s SER 118 CO -0.08 -3.52 0.14 -0.83 0.98 0.00 0.00 173.24 169.93 1wgo s GLY 119 N -3.77 2.43 -1.14 7.32 0.00 -1.26 -3.89 107.32 107.01 1wgo s GLY 119 Ca 0.68 -1.47 -0.23 0.00 0.00 0.00 0.00 44.72 43.70 1wgo s GLY 119 CO 0.56 -1.76 1.94 2.56 0.00 0.00 0.00 173.10 176.40 1wgo s PRO 120 N -3.73 2.51 -0.29 2.90 0.04 -1.26 -4.81 135.00 130.36 1wgo s PRO 120 Ca 0.28 -1.04 -0.17 0.00 0.04 0.00 0.00 61.00 60.12 1wgo s PRO 120 Cb 0.04 -5.22 0.13 0.00 0.04 0.00 0.00 34.50 29.49 1wgo s PRO 120 CO 0.16 -3.89 0.93 -1.54 0.04 0.00 0.00 177.00 172.70 1wgo s SER 121 N 6.72 -0.58 -0.21 6.66 1.04 -1.26 -5.15 113.70 120.91 1wgo s SER 121 Ca 0.69 0.94 -0.11 0.00 0.48 0.00 0.00 55.95 57.95 1wgo s SER 121 Cb -0.02 1.22 -0.05 0.00 0.10 0.00 0.00 66.02 67.28 1wgo s SER 121 CO 0.11 -0.15 0.17 -0.55 0.98 0.00 0.00 173.24 173.80 1wgo s SER 122 N 1.33 6.20 0.00 7.02 0.15 -1.26 -5.19 113.70 121.96 1wgo s SER 122 Ca -0.09 0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.79 1wgo s SER 122 Cb -0.04 -2.11 0.00 0.00 -1.71 0.00 0.00 66.02 62.16 1wgo s SER 122 CO -0.15 0.11 0.45 0.61 1.20 0.00 0.00 173.24 175.46