#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 -0.14 0.30 1.61 1.04 -1.26 -5.19 113.70 110.05 1wgo s SER 2 Ca 0.00 -0.32 -0.19 0.00 0.48 0.00 0.00 55.95 55.93 1wgo s SER 2 Cb 0.00 0.38 0.06 0.00 0.10 0.00 0.00 66.02 66.57 1wgo s SER 2 CO 0.00 -0.71 0.89 -0.44 0.98 0.00 0.00 173.24 173.96 1wgo s SER 3 N -2.95 -0.01 0.16 7.02 0.01 -1.26 -5.19 113.70 111.48 1wgo s SER 3 Ca 0.13 -0.91 -0.01 0.00 1.31 0.00 0.00 55.95 56.46 1wgo s SER 3 Cb 0.01 0.70 0.01 0.00 0.21 0.00 0.00 66.02 66.94 1wgo s SER 3 CO 0.00 -1.38 0.23 0.61 0.41 0.00 0.00 173.24 173.11 1wgo n GLY 4 N -0.59 2.60 3.84 3.44 0.00 -1.26 -5.19 105.19 108.04 1wgo n GLY 4 Ca -0.06 -1.46 -0.04 0.00 0.00 0.00 0.00 46.02 44.46 1wgo n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wgo s SER 5 N -1.99 -0.04 0.21 1.61 0.01 -1.26 -5.19 113.70 107.06 1wgo s SER 5 Ca 0.13 -0.68 -0.03 0.00 1.31 0.00 0.00 55.95 56.68 1wgo s SER 5 Cb -0.01 0.55 -0.03 0.00 0.21 0.00 0.00 66.02 66.74 1wgo s SER 5 CO 0.09 -1.07 0.21 -0.55 0.41 0.00 0.00 173.24 172.33 1wgo s SER 6 N -3.26 0.12 0.47 2.44 0.15 -1.26 -5.18 113.70 107.18 1wgo s SER 6 Ca 0.19 -1.30 0.02 0.00 0.70 0.00 0.00 55.95 55.56 1wgo s SER 6 Cb -0.03 0.43 -0.02 0.00 -1.71 0.00 0.00 66.02 64.69 1wgo s SER 6 CO 0.05 -0.91 0.06 -0.83 1.20 0.00 0.00 173.24 172.81 1wgo s GLY 7 N -3.13 2.87 0.27 9.45 0.00 -1.26 -5.17 107.32 110.35 1wgo s GLY 7 Ca 0.36 -0.70 -0.04 0.00 0.00 0.00 0.00 44.72 44.34 1wgo s GLY 7 CO 0.12 -2.05 0.34 0.00 0.00 0.00 0.00 173.10 171.51 1wgo s GLU 9 N -3.72 1.59 0.00 0.00 1.03 -1.26 -5.18 118.70 111.16 1wgo s GLU 9 Ca 0.32 -1.90 0.00 0.00 0.03 0.00 0.00 54.97 53.42 1wgo s GLU 9 Cb 0.02 0.27 0.00 0.00 -0.80 0.00 0.00 34.13 33.63 1wgo s GLU 9 CO 0.15 -0.56 0.00 0.41 -1.33 0.00 0.00 175.26 173.93 1wgo n GLY 10 N -0.52 3.38 3.37 -3.83 0.00 -1.26 -5.17 105.19 101.16 1wgo n GLY 10 Ca 0.05 -1.83 0.01 0.00 0.00 0.00 0.00 46.02 44.26 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 5.00 0.37 3.62 -0.02 0.00 -1.26 -5.17 105.19 107.73 1wgo n GLY 11 Ca 0.00 -1.04 -0.03 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.06 -0.53 -0.19 1.61 0.11 -1.26 -5.14 120.40 112.95 1wgo s VAL 12 Ca 0.24 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 59.00 1wgo s VAL 12 Cb -0.01 -1.00 -0.00 0.00 -1.53 0.00 0.00 36.38 33.84 1wgo s VAL 12 CO 0.01 0.00 1.09 1.51 -3.33 0.00 0.00 175.10 174.38 1wgo s ASP 13 N 2.30 7.08 -0.19 3.54 -4.77 -1.26 -4.98 116.67 118.40 1wgo s ASP 13 Ca -0.07 1.50 -0.34 0.00 -3.30 0.00 0.00 52.55 50.33 1wgo s ASP 13 Cb -0.08 -2.54 0.14 0.00 -1.09 0.00 0.00 42.92 39.34 1wgo s ASP 13 CO -0.19 -0.65 1.19 0.00 0.70 0.00 0.00 175.17 176.23 1wgo s MET 14 N 3.03 0.33 -0.27 2.11 0.23 -1.26 -5.15 119.30 118.31 1wgo s MET 14 Ca 0.48 -0.10 -0.01 0.00 -1.03 0.00 0.00 55.69 55.02 1wgo s MET 14 Cb -0.18 0.15 0.16 0.00 -1.53 0.00 0.00 34.83 33.44 1wgo s MET 14 CO 0.11 -0.14 0.48 -0.65 -2.03 0.00 0.00 175.02 172.79 1wgo s GLN 15 N -2.31 0.46 0.29 3.16 -0.21 -1.26 -5.16 119.66 114.62 1wgo s GLN 15 Ca 0.09 0.68 0.02 0.00 0.02 0.00 0.00 55.36 56.17 1wgo s GLN 15 Cb -0.01 -0.01 -0.05 0.00 1.00 0.00 0.00 33.01 33.94 1wgo s GLN 15 CO -0.05 -0.70 0.10 -0.65 -2.12 0.00 0.00 175.29 171.87 1wgo s GLN 16 N 2.69 1.53 -0.27 2.91 -0.21 -1.26 -5.09 119.66 119.96 1wgo s GLN 16 Ca 0.15 -1.85 -0.40 0.00 0.02 0.00 0.00 55.36 53.29 1wgo s GLN 16 Cb -0.15 -0.42 -0.15 0.00 1.00 0.00 0.00 33.01 33.29 1wgo s GLN 16 CO -0.20 -0.30 1.79 0.43 -2.12 0.00 0.00 175.29 174.89 1wgo n SER 17 N -0.64 2.45 -4.75 5.90 7.64 -1.26 -4.88 113.62 118.07 1wgo n SER 17 Ca -0.01 1.03 -0.37 0.00 1.01 0.00 0.00 58.87 60.53 1wgo n SER 17 Cb 0.66 -1.16 0.04 0.00 -1.01 0.00 0.00 64.21 62.74 1wgo n SER 17 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1wgo s GLN 18 N 3.79 2.99 -0.94 1.43 -0.21 -1.26 -2.73 119.66 122.74 1wgo s GLN 18 Ca 0.99 1.93 -0.12 0.00 0.02 0.00 0.00 55.36 58.18 1wgo s GLN 18 Cb -1.04 -2.01 0.12 0.00 1.00 0.00 0.00 33.01 31.09 1wgo s GLN 18 CO 0.64 -1.22 0.30 1.55 -2.12 0.00 0.00 175.29 174.44 1wgo n VAL 19 N -1.46 0.00 -3.97 1.09 3.14 -1.26 -4.84 118.33 111.02 1wgo n VAL 19 Ca 0.13 0.00 -0.09 0.00 -2.96 0.00 0.00 64.34 61.42 1wgo n VAL 19 Cb 0.48 -0.25 -0.10 0.00 -1.06 0.00 0.00 33.84 32.91 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 -5.09 0.42 -0.29 1.45 -0.21 -1.11 -5.16 119.66 109.67 1wgo s GLN 20 Ca 0.42 -0.68 -0.24 0.00 0.02 0.00 0.00 55.36 54.88 1wgo s GLN 20 Cb -0.24 0.15 0.13 0.00 1.00 0.00 0.00 33.01 34.06 1wgo s GLN 20 CO 0.51 -0.08 1.08 -1.17 -2.12 0.00 0.00 175.29 173.51 1wgo s LEU 21 N -1.73 -0.40 -0.39 2.90 2.96 -1.26 -4.73 118.68 116.02 1wgo s LEU 21 Ca -0.11 0.76 -0.20 0.00 -0.22 0.00 0.00 54.13 54.35 1wgo s LEU 21 Cb -0.06 1.75 0.01 0.00 0.50 0.00 0.00 46.19 48.40 1wgo s LEU 21 CO -0.02 -0.13 0.61 -1.58 -1.32 0.00 0.00 176.35 173.91 1wgo s GLN 22 N 0.36 3.46 0.04 1.98 -0.44 -1.26 -5.05 119.66 118.75 1wgo s GLN 22 Ca 0.02 -0.21 0.08 0.00 -2.50 0.00 0.00 55.36 52.75 1wgo s GLN 22 Cb -0.05 -3.88 -0.03 0.00 -1.64 0.00 0.00 33.01 27.42 1wgo s GLN 22 CO -0.09 -0.85 -0.23 0.00 0.50 0.00 0.00 175.29 174.63 1wgo s PRO 24 N -1.10 -1.05 0.07 0.00 0.04 -1.26 -5.09 135.00 126.60 1wgo s PRO 24 Ca 0.09 -0.01 0.03 0.00 0.04 0.00 0.00 61.00 61.16 1wgo s PRO 24 Cb -0.09 -1.61 -0.03 0.00 0.04 0.00 0.00 34.50 32.81 1wgo s PRO 24 CO 0.01 -3.61 -0.10 -0.48 0.04 0.00 0.00 177.00 172.87 1wgo s LEU 25 N -6.89 2.31 0.26 -3.56 2.34 -1.26 -5.16 118.68 106.73 1wgo s LEU 25 Ca 0.70 -0.66 -0.08 0.00 0.06 0.00 0.00 54.13 54.15 1wgo s LEU 25 Cb -0.11 -0.27 -0.06 0.00 -0.56 0.00 0.00 46.19 45.19 1wgo s LEU 25 CO 0.56 -0.21 0.56 0.42 -1.06 0.00 0.00 176.35 176.63 1wgo s THR 26 N -1.77 4.95 0.84 5.48 -4.23 -1.26 -4.91 115.64 114.74 1wgo s THR 26 Ca -0.03 0.35 -0.11 0.00 -1.18 0.00 0.00 61.69 60.72 1wgo s THR 26 Cb -0.07 -3.66 0.09 0.00 1.34 0.00 0.00 72.50 70.20 1wgo s THR 26 CO 0.00 -0.18 1.09 -2.16 -0.54 0.00 0.00 174.62 172.84 1wgo s PRO 27 N -3.12 1.74 -0.47 3.99 0.04 -1.26 -4.77 135.00 131.15 1wgo s PRO 27 Ca 0.46 0.99 -0.28 0.00 0.04 0.00 0.00 61.00 62.22 1wgo s PRO 27 Cb -0.11 -1.85 -0.02 0.00 0.04 0.00 0.00 34.50 32.56 1wgo s PRO 27 CO 0.25 -1.95 1.78 -1.25 0.04 0.00 0.00 177.00 175.86 1wgo s PRO 28 N -4.92 3.04 -0.04 0.56 0.04 -1.26 -4.88 135.00 127.54 1wgo s PRO 28 Ca 0.62 0.98 0.05 0.00 0.04 0.00 0.00 61.00 62.69 1wgo s PRO 28 Cb -0.18 -4.26 -0.01 0.00 0.04 0.00 0.00 34.50 30.10 1wgo s PRO 28 CO 0.56 -2.22 -0.18 0.50 0.04 0.00 0.00 177.00 175.71 1wgo s ARG 29 N 6.20 1.74 0.00 4.56 3.52 -1.26 -4.45 118.95 129.26 1wgo s ARG 29 Ca 0.71 -0.63 0.00 0.00 -0.13 0.00 0.00 55.73 55.68 1wgo s ARG 29 Cb -0.17 -1.55 0.00 0.00 -1.56 0.00 0.00 34.95 31.68 1wgo s ARG 29 CO 0.28 0.29 0.00 0.41 -0.81 0.00 0.00 175.30 175.46 1wgo n GLY 30 N 3.01 0.46 3.64 8.12 0.00 -1.26 -3.75 105.19 115.41 1wgo n GLY 30 Ca -0.17 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.47 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 0.00 3.98 -0.00 0.99 1.98 -1.26 -3.90 118.68 120.47 1wgo s LEU 31 Ca 0.00 1.21 -0.27 0.00 -2.89 0.00 0.00 54.13 52.18 1wgo s LEU 31 Cb 0.00 -3.54 0.06 0.00 0.66 0.00 0.00 46.19 43.37 1wgo s LEU 31 CO 0.00 -0.87 0.60 -1.58 -1.89 0.00 0.00 176.35 172.61 1wgo s GLN 32 N 3.65 1.04 0.14 1.98 2.00 -1.26 -4.40 119.66 122.82 1wgo s GLN 32 Ca 0.48 0.03 0.08 0.00 -2.00 0.00 0.00 55.36 53.95 1wgo s GLN 32 Cb -0.15 0.49 -0.04 0.00 0.80 0.00 0.00 33.01 34.11 1wgo s GLN 32 CO 0.15 -0.35 -0.10 0.14 -0.50 0.00 0.00 175.29 174.63 1wgo s VAL 33 N -1.77 3.28 0.05 1.34 -7.23 -1.26 -4.20 120.40 110.62 1wgo s VAL 33 Ca -0.09 -1.46 -0.13 0.00 -1.81 0.00 0.00 61.98 58.49 1wgo s VAL 33 Cb -0.01 -2.58 0.02 0.00 0.56 0.00 0.00 36.38 34.37 1wgo s VAL 33 CO 0.04 0.00 0.29 -0.55 -0.31 0.00 0.00 175.10 174.58 1wgo s SER 34 N -2.52 -0.10 0.04 4.85 0.15 -1.05 -4.90 113.70 110.18 1wgo s SER 34 Ca 0.23 -0.26 -0.30 0.00 0.70 0.00 0.00 55.95 56.32 1wgo s SER 34 Cb -0.10 0.36 -0.05 0.00 -1.71 0.00 0.00 66.02 64.52 1wgo s SER 34 CO 0.14 -0.64 1.15 -0.63 1.20 0.00 0.00 173.24 174.46 1wgo s ILE 35 N -2.78 4.24 -0.87 6.45 -1.09 -1.26 -0.77 121.20 125.12 1wgo s ILE 35 Ca -0.03 1.61 -0.26 0.00 -2.23 0.00 0.00 60.65 59.73 1wgo s ILE 35 Cb -0.00 -4.03 -0.20 0.00 -1.58 0.00 0.00 42.46 36.65 1wgo s ILE 35 CO -0.05 0.12 2.54 1.67 -1.23 0.00 0.00 174.94 177.99 1wgo n GLN 36 N 3.95 0.27 -0.19 2.79 -0.06 -0.94 -4.39 117.38 118.79 1wgo n GLN 36 Ca 0.08 -0.05 0.01 0.00 -2.00 0.00 0.00 57.00 55.04 1wgo n GLN 36 Cb 0.47 -1.99 -0.01 0.00 -4.06 0.00 0.00 30.24 24.65 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 6.26 -2.83 3.53 1.69 0.00 -1.26 -4.74 105.19 107.84 1wgo n GLY 37 Ca 0.59 -1.33 -0.44 0.00 0.00 0.00 0.00 46.02 44.83 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 -2.01 1.42 -4.30 1.61 4.07 -1.26 -4.94 120.64 115.22 1wgo n GLU 38 Ca -0.01 0.33 -0.31 0.00 -0.06 0.00 0.00 57.16 57.11 1wgo n GLU 38 Cb 0.08 -2.94 -0.09 0.00 -0.06 0.00 0.00 31.44 28.43 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 8.69 3.13 -0.09 4.31 0.00 -1.26 -5.05 121.76 131.50 1wgo s ALA 39 Ca 1.05 -1.07 -0.11 0.00 0.00 0.00 0.00 51.96 51.83 1wgo s ALA 39 Cb -0.53 -1.15 -0.04 0.00 0.00 0.00 0.00 23.12 21.40 1wgo s ALA 39 CO 0.39 0.65 -0.22 0.28 0.00 0.00 0.00 175.76 176.86 1wgo n VAL 40 N 1.11 1.31 -3.90 0.00 0.31 -1.26 -5.04 118.33 110.85 1wgo n VAL 40 Ca -0.14 0.15 -0.17 0.00 -0.01 0.00 0.00 64.34 64.17 1wgo n VAL 40 Cb 0.52 -1.99 -0.16 0.00 -0.91 0.00 0.00 33.84 31.30 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 -2.51 0.29 0.30 3.52 0.00 -1.26 -4.83 121.76 117.26 1wgo s ALA 41 Ca -0.19 0.18 -0.08 0.00 0.00 0.00 0.00 51.96 51.87 1wgo s ALA 41 Cb 0.04 -0.32 -0.06 0.00 0.00 0.00 0.00 23.12 22.77 1wgo s ALA 41 CO 0.27 -0.09 0.61 0.08 0.00 0.00 0.00 175.76 176.63 1wgo s VAL 42 N 1.06 4.92 0.11 0.00 1.01 -0.73 -4.82 120.40 121.95 1wgo s VAL 42 Ca -0.09 0.36 -0.22 0.00 0.00 0.00 0.00 61.98 62.03 1wgo s VAL 42 Cb -0.13 -3.69 -0.07 0.00 0.00 0.00 0.00 36.38 32.49 1wgo s VAL 42 CO -0.02 -0.28 0.67 -0.13 0.00 0.00 0.00 175.10 175.35 1wgo s ARG 43 N -3.35 4.39 -1.11 2.72 0.52 -1.26 -0.93 118.95 119.93 1wgo s ARG 43 Ca 0.47 0.94 -0.23 0.00 -0.52 0.00 0.00 55.73 56.39 1wgo s ARG 43 Cb -0.11 -3.26 -0.08 0.00 0.52 0.00 0.00 34.95 32.02 1wgo s ARG 43 CO 0.27 0.57 1.94 -1.25 0.02 0.00 0.00 175.30 176.85 1wgo s PRO 44 N -1.01 2.51 0.00 3.54 0.04 -1.26 -1.99 135.00 136.83 1wgo s PRO 44 Ca 0.33 -0.93 0.00 0.00 0.04 0.00 0.00 61.00 60.43 1wgo s PRO 44 Cb -0.21 -5.19 0.00 0.00 0.04 0.00 0.00 34.50 29.13 1wgo s PRO 44 CO 0.22 -3.83 0.00 0.41 0.04 0.00 0.00 177.00 173.84 1wgo n GLY 45 N 6.09 0.47 3.88 0.56 0.00 -1.24 -4.88 105.19 110.07 1wgo n GLY 45 Ca 0.44 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.15 1wgo n GLY 45 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1wgo s GLU 46 N 0.00 3.76 -0.84 1.61 -1.05 -0.84 -4.65 118.70 116.69 1wgo s GLU 46 Ca 0.00 0.22 -0.25 0.00 -0.15 0.00 0.00 54.97 54.79 1wgo s GLU 46 Cb 0.00 -2.63 0.02 0.00 -0.44 0.00 0.00 34.13 31.08 1wgo s GLU 46 CO 0.00 0.27 1.52 -0.51 0.95 0.00 0.00 175.26 177.49 1wgo s ASP 47 N -2.59 6.00 0.20 0.83 1.11 -1.26 -4.11 116.67 116.84 1wgo s ASP 47 Ca 0.47 -0.70 -0.30 0.00 0.18 0.00 0.00 52.55 52.20 1wgo s ASP 47 Cb -0.11 -2.56 -0.08 0.00 1.07 0.00 0.00 42.92 41.24 1wgo s ASP 47 CO 0.24 -1.94 1.00 0.54 1.18 0.00 0.00 175.17 176.20 1wgo s VAL 48 N 6.59 4.06 -0.21 -1.27 0.11 -0.37 -4.86 120.40 124.45 1wgo s VAL 48 Ca 0.48 1.89 -0.07 0.00 -2.93 0.00 0.00 61.98 61.36 1wgo s VAL 48 Cb -0.06 -4.21 -0.03 0.00 -1.53 0.00 0.00 36.38 30.55 1wgo s VAL 48 CO 0.05 0.38 0.05 -0.76 -3.33 0.00 0.00 175.10 171.50 1wgo s LEU 49 N -0.72 3.60 -0.30 2.54 2.01 -1.26 -2.63 118.68 121.92 1wgo s LEU 49 Ca 0.45 -0.05 -0.08 0.00 0.01 0.00 0.00 54.13 54.46 1wgo s LEU 49 Cb -0.27 -1.93 0.00 0.00 0.01 0.00 0.00 46.19 44.01 1wgo s LEU 49 CO 0.33 0.09 0.11 -0.36 1.01 0.00 0.00 176.35 177.53 1wgo s PHE 50 N 0.85 3.16 -0.06 0.29 0.08 -1.12 -2.22 117.98 118.96 1wgo s PHE 50 Ca 0.03 -0.82 -0.30 0.00 0.12 0.00 0.00 56.93 55.96 1wgo s PHE 50 Cb -0.14 -2.29 -0.02 0.00 -0.57 0.00 0.00 43.02 40.00 1wgo s PHE 50 CO 0.02 -0.53 1.04 0.08 -0.10 0.00 0.00 175.22 175.73 1wgo s VAL 51 N 1.54 4.68 -0.12 -0.44 1.01 0.05 -2.51 120.40 124.61 1wgo s VAL 51 Ca 0.03 1.94 0.01 0.00 0.00 0.00 0.00 61.98 63.97 1wgo s VAL 51 Cb -0.17 -4.25 0.02 0.00 0.00 0.00 0.00 36.38 31.98 1wgo s VAL 51 CO 0.04 0.05 -0.14 0.54 0.00 0.00 0.00 175.10 175.59 1wgo s VAL 52 N 1.71 1.45 0.04 2.92 0.11 -1.26 -2.52 120.40 122.86 1wgo s VAL 52 Ca 0.51 -0.58 -0.24 0.00 -2.93 0.00 0.00 61.98 58.74 1wgo s VAL 52 Cb -0.21 -1.36 0.06 0.00 -1.53 0.00 0.00 36.38 33.34 1wgo s VAL 52 CO 0.22 0.44 0.57 -0.60 -3.33 0.00 0.00 175.10 172.39 1wgo s ARG 53 N 1.29 1.08 0.23 1.54 3.52 -1.26 -4.79 118.95 120.56 1wgo s ARG 53 Ca -0.00 -0.16 0.09 0.00 -0.13 0.00 0.00 55.73 55.53 1wgo s ARG 53 Cb -0.14 0.50 -0.04 0.00 -1.56 0.00 0.00 34.95 33.71 1wgo s ARG 53 CO -0.06 -0.39 -0.04 -1.14 -0.81 0.00 0.00 175.30 172.85 1wgo s GLN 54 N -2.37 2.20 -0.04 5.12 0.74 -1.26 -4.17 119.66 119.89 1wgo s GLN 54 Ca -0.06 -1.35 -0.24 0.00 0.05 0.00 0.00 55.36 53.76 1wgo s GLN 54 Cb -0.01 -2.17 -0.19 0.00 1.10 0.00 0.00 33.01 31.75 1wgo s GLN 54 CO -0.01 0.40 1.08 1.49 -0.55 0.00 0.00 175.29 177.70 1wgo h GLU 55 N 2.33 -0.11 0.00 1.67 4.22 -1.68 -3.40 114.58 117.62 1wgo h GLU 55 Ca -0.45 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.00 1wgo h GLU 55 Cb 1.23 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1wgo h GLU 55 CO 0.58 0.40 0.00 0.94 -2.18 0.00 0.00 179.01 178.75 1wgo n GLN 56 N -4.88 3.06 -2.07 1.92 -0.06 -1.26 -4.78 117.38 109.31 1wgo n GLN 56 Ca -0.08 -0.14 -0.37 0.00 -2.00 0.00 0.00 57.00 54.41 1wgo n GLN 56 Cb 0.28 -0.57 0.03 0.00 -4.06 0.00 0.00 30.24 25.92 1wgo n GLN 56 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1wgo n GLY 57 N 0.48 5.65 0.12 1.69 0.00 -1.26 -4.63 105.19 107.23 1wgo n GLY 57 Ca 0.00 -2.56 -0.18 0.00 0.00 0.00 0.00 46.02 43.29 1wgo n GLY 57 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1wgo h ASP 58 N 2.90 0.48 0.12 1.61 2.03 -1.87 -3.38 116.42 118.32 1wgo h ASP 58 Ca 0.50 -0.57 -0.36 0.00 -0.73 0.00 0.00 57.03 55.87 1wgo h ASP 58 Cb 0.25 -0.16 -0.05 0.00 -0.83 0.00 0.00 39.33 38.55 1wgo h ASP 58 CO 1.29 1.46 -2.18 0.55 -1.03 0.00 0.00 179.24 179.32 1wgo n VAL 59 N -3.53 1.58 -1.03 4.15 3.14 -1.26 -2.98 118.33 118.40 1wgo n VAL 59 Ca -0.13 -0.69 -0.34 0.00 -2.96 0.00 0.00 64.34 60.21 1wgo n VAL 59 Cb 1.05 -1.27 0.02 0.00 -1.06 0.00 0.00 33.84 32.58 1wgo n VAL 59 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1wgo n LEU 60 N -3.19 -4.61 -4.23 6.55 4.77 -1.26 -4.76 117.00 110.27 1wgo n LEU 60 Ca -0.34 0.36 -0.42 0.00 -0.03 0.00 0.00 56.01 55.58 1wgo n LEU 60 Cb 1.05 -0.74 -0.04 0.00 -2.33 0.00 0.00 43.42 41.36 1wgo n LEU 60 CO 0.38 -5.07 0.37 -0.89 -1.33 0.00 0.00 177.39 170.84 1wgo s THR 61 N -1.85 4.98 -0.08 -5.08 2.01 -1.26 -4.73 115.64 109.63 1wgo s THR 61 Ca 0.44 -2.97 0.04 0.00 0.31 0.00 0.00 61.69 59.50 1wgo s THR 61 Cb -0.30 -4.09 0.00 0.00 0.01 0.00 0.00 72.50 68.12 1wgo s THR 61 CO 0.70 -1.02 -0.20 -0.89 -0.69 0.00 0.00 174.62 172.51 1wgo s THR 62 N -0.36 1.74 0.11 -0.82 2.01 -1.26 -4.86 115.64 112.19 1wgo s THR 62 Ca 0.21 -0.84 -0.30 0.00 0.31 0.00 0.00 61.69 61.07 1wgo s THR 62 Cb -0.12 -1.52 -0.06 0.00 0.01 0.00 0.00 72.50 70.80 1wgo s THR 62 CO -0.08 0.49 1.17 -0.54 -0.69 0.00 0.00 174.62 174.97 1wgo s LYS 63 N 0.40 4.49 -0.26 4.92 1.02 -1.26 -3.54 119.74 125.51 1wgo s LYS 63 Ca -0.16 1.77 0.03 0.00 0.02 0.00 0.00 55.97 57.62 1wgo s LYS 63 Cb -0.17 -3.31 0.06 0.00 -0.52 0.00 0.00 37.83 33.89 1wgo s LYS 63 CO 0.07 -0.14 -0.09 0.71 -0.92 0.00 0.00 175.35 174.98 1wgo s TYR 64 N 0.54 3.16 -0.42 3.18 2.02 -1.05 -3.23 117.35 121.55 1wgo s TYR 64 Ca 0.55 -2.29 -0.27 0.00 -0.37 0.00 0.00 57.07 54.69 1wgo s TYR 64 Cb -0.30 -1.96 0.02 0.00 -0.40 0.00 0.00 41.96 39.33 1wgo s TYR 64 CO 0.32 -0.87 0.98 1.14 -1.57 0.00 0.00 175.55 175.55 1wgo s GLN 65 N 1.13 3.73 -0.24 -0.62 1.03 0.63 -2.64 119.66 122.69 1wgo s GLN 65 Ca -0.07 0.47 -0.22 0.00 0.04 0.00 0.00 55.36 55.58 1wgo s GLN 65 Cb -0.20 -3.86 -0.01 0.00 0.03 0.00 0.00 33.01 28.96 1wgo s GLN 65 CO -0.06 -1.14 0.72 0.08 -2.54 0.00 0.00 175.29 172.36 1wgo s VAL 66 N 3.81 4.92 -0.27 3.63 1.01 -0.72 -2.64 120.40 130.14 1wgo s VAL 66 Ca 0.40 1.35 0.03 0.00 0.00 0.00 0.00 61.98 63.76 1wgo s VAL 66 Cb -0.10 -4.02 0.06 0.00 0.00 0.00 0.00 36.38 32.32 1wgo s VAL 66 CO 0.24 0.00 -0.09 -0.62 0.00 0.00 0.00 175.10 174.63 1wgo s ASP 67 N 1.36 4.47 -0.01 3.32 -1.08 -1.01 -3.04 116.67 120.68 1wgo s ASP 67 Ca 0.31 -1.47 -0.25 0.00 -0.52 0.00 0.00 52.55 50.62 1wgo s ASP 67 Cb -0.16 -1.55 -0.19 0.00 -1.46 0.00 0.00 42.92 39.56 1wgo s ASP 67 CO 0.09 -0.21 1.28 -0.07 0.52 0.00 0.00 175.17 176.77 1wgo h LEU 68 N 7.76 -0.04 0.00 -1.34 -0.00 -1.85 -2.57 115.31 117.27 1wgo h LEU 68 Ca -0.18 -0.42 0.00 0.00 -0.00 0.00 0.00 57.88 57.28 1wgo h LEU 68 Cb 1.04 0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.71 1wgo h LEU 68 CO 0.47 0.41 0.00 0.61 -0.00 0.00 0.00 178.44 179.92 1wgo n GLY 69 N 0.11 2.55 0.00 0.83 0.00 -1.26 -3.81 105.19 103.61 1wgo n GLY 69 Ca -0.08 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1wgo n GLY 69 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1wgo n ASP 70 N 0.00 0.00 -0.43 1.61 5.75 -1.26 -4.63 116.55 117.60 1wgo n ASP 70 Ca 0.00 0.77 -0.00 0.00 -0.01 0.00 0.00 54.79 55.54 1wgo n ASP 70 Cb 0.00 -0.27 -0.00 0.00 -1.03 0.00 0.00 41.12 39.82 1wgo n ASP 70 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1wgo n GLY 71 N -0.99 0.80 3.59 6.12 0.00 -1.26 -5.12 105.19 108.32 1wgo n GLY 71 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 3.10 -0.02 1.61 5.36 -1.26 -5.10 117.98 121.66 1wgo s PHE 72 Ca 0.00 -0.05 -0.00 0.00 -0.96 0.00 0.00 56.93 55.92 1wgo s PHE 72 Cb 0.00 -1.90 0.03 0.00 -0.34 0.00 0.00 43.02 40.81 1wgo s PHE 72 CO 0.00 0.20 0.03 0.15 -1.46 0.00 0.00 175.22 174.14 1wgo s LYS 73 N -0.16 -0.04 -0.21 10.12 1.02 -1.26 -3.26 119.74 125.96 1wgo s LYS 73 Ca 0.04 0.18 -0.22 0.00 0.02 0.00 0.00 55.97 55.99 1wgo s LYS 73 Cb -0.13 -0.24 0.06 0.00 -0.52 0.00 0.00 37.83 37.01 1wgo s LYS 73 CO 0.02 -0.16 0.62 0.00 -0.92 0.00 0.00 175.35 174.91 1wgo s ALA 74 N 1.03 -1.54 -0.19 5.17 0.00 -1.17 -5.10 121.76 119.96 1wgo s ALA 74 Ca -0.09 1.69 -0.02 0.00 0.00 0.00 0.00 51.96 53.54 1wgo s ALA 74 Cb -0.12 -0.92 -0.00 0.00 0.00 0.00 0.00 23.12 22.08 1wgo s ALA 74 CO -0.03 -0.30 -0.09 1.41 0.00 0.00 0.00 175.76 176.75 1wgo s MET 75 N 0.17 3.31 -0.22 0.00 1.75 -1.26 -1.76 119.30 121.29 1wgo s MET 75 Ca -0.01 -0.68 -0.00 0.00 -1.25 0.00 0.00 55.69 53.75 1wgo s MET 75 Cb -0.04 -2.83 0.02 0.00 2.84 0.00 0.00 34.83 34.82 1wgo s MET 75 CO 0.02 -0.09 -0.12 0.71 -0.65 0.00 0.00 175.02 174.88 1wgo s TYR 76 N 1.15 2.95 0.09 4.11 2.02 -1.08 -4.99 117.35 121.60 1wgo s TYR 76 Ca 0.01 -1.59 -0.15 0.00 -0.37 0.00 0.00 57.07 54.97 1wgo s TYR 76 Cb -0.14 -1.99 -0.06 0.00 -0.40 0.00 0.00 41.96 39.36 1wgo s TYR 76 CO -0.03 -0.75 0.51 0.54 -1.57 0.00 0.00 175.55 174.25 1wgo s VAL 77 N 1.31 4.89 -1.56 0.71 0.11 -1.26 -2.53 120.40 122.06 1wgo s VAL 77 Ca 0.02 0.87 -0.05 0.00 -2.93 0.00 0.00 61.98 59.89 1wgo s VAL 77 Cb -0.15 -3.76 0.01 0.00 -1.53 0.00 0.00 36.38 30.95 1wgo s VAL 77 CO -0.08 0.38 0.61 0.59 -3.33 0.00 0.00 175.10 173.27 1wgo n ASN 78 N 1.22 -6.09 0.25 3.54 4.13 -1.23 -4.85 115.26 112.22 1wgo n ASN 78 Ca -0.08 -0.29 0.14 0.00 1.68 0.00 0.00 54.58 56.02 1wgo n ASN 78 Cb 0.52 -4.92 0.80 0.00 -1.54 0.00 0.00 39.78 34.63 1wgo n ASN 78 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 1wgo h LEU 79 N -1.38 0.00 0.05 3.41 5.85 -1.80 -1.43 115.31 120.01 1wgo h LEU 79 Ca -0.53 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 57.92 1wgo h LEU 79 Cb 1.37 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.41 1wgo h LEU 79 CO 0.57 0.00 -1.18 0.71 -0.34 0.00 0.00 178.44 178.20 1wgo h THR 80 N 0.00 1.42 0.17 1.05 1.35 -1.86 -1.58 112.91 113.46 1wgo h THR 80 Ca 0.03 -2.77 0.00 0.00 -0.55 0.00 0.00 66.41 63.13 1wgo h THR 80 Cb 0.15 2.77 -0.03 0.00 -1.73 0.00 0.00 68.15 69.31 1wgo h THR 80 CO -0.00 0.82 -0.38 0.25 -0.25 0.00 0.00 175.52 175.96 1wgo h LEU 81 N 0.15 -1.12 -0.64 3.87 6.46 -1.15 -2.70 115.31 120.18 1wgo h LEU 81 Ca -0.14 0.11 -0.12 0.00 -0.12 0.00 0.00 57.88 57.61 1wgo h LEU 81 Cb 1.87 0.40 -0.02 0.00 -0.73 0.00 0.00 40.66 42.18 1wgo h LEU 81 CO 0.20 -0.43 -0.59 0.00 -0.62 0.00 0.00 178.44 177.00 1wgo h THR 82 N -0.60 1.27 0.00 1.05 1.03 -1.69 -3.47 112.91 110.50 1wgo h THR 82 Ca -0.02 -2.15 0.00 0.00 -0.01 0.00 0.00 66.41 64.24 1wgo h THR 82 Cb 0.58 2.21 0.00 0.00 -1.07 0.00 0.00 68.15 69.87 1wgo h THR 82 CO -0.16 0.58 0.00 0.61 -0.01 0.00 0.00 175.52 176.54 1wgo n GLY 83 N 0.49 3.01 3.49 2.99 0.00 -0.59 -4.96 105.19 109.61 1wgo n GLY 83 Ca -0.00 0.00 -0.60 0.00 0.00 0.00 0.00 46.02 45.42 1wgo n GLY 83 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wgo n GLU 84 N -2.00 0.00 -0.89 1.61 1.02 -1.26 -4.77 120.64 114.36 1wgo n GLU 84 Ca 0.00 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.88 1wgo n GLU 84 Cb 0.00 -1.47 0.22 0.00 -0.02 0.00 0.00 31.44 30.17 1wgo n GLU 84 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1wgo n PRO 85 N 2.14 -2.87 -3.75 3.49 -0.04 -1.26 -4.89 135.00 127.81 1wgo n PRO 85 Ca 0.22 -1.50 -0.36 0.00 -0.04 0.00 0.00 63.50 61.82 1wgo n PRO 85 Cb 0.04 -1.41 -0.11 0.00 -0.04 0.00 0.00 33.50 31.98 1wgo n PRO 85 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1wgo s ILE 86 N -2.70 3.43 -0.25 0.52 1.01 -1.05 -4.96 121.20 117.21 1wgo s ILE 86 Ca 0.61 -2.25 -0.26 0.00 0.00 0.00 0.00 60.65 58.75 1wgo s ILE 86 Cb -0.06 -3.32 0.00 0.00 0.01 0.00 0.00 42.46 39.09 1wgo s ILE 86 CO 0.47 -0.74 0.92 -0.60 0.00 0.00 0.00 174.94 174.99 1wgo s ARG 87 N 0.88 4.19 0.00 2.79 3.52 -1.26 -2.81 118.95 126.27 1wgo s ARG 87 Ca 0.10 1.08 -0.04 0.00 -0.13 0.00 0.00 55.73 56.75 1wgo s ARG 87 Cb -0.22 -3.65 -0.01 0.00 -1.56 0.00 0.00 34.95 29.51 1wgo s ARG 87 CO -0.04 -0.59 0.06 -1.58 -0.81 0.00 0.00 175.30 172.34 1wgo s HIS 88 N 3.03 0.10 0.09 5.12 2.46 -1.08 -5.01 115.29 120.00 1wgo s HIS 88 Ca 0.39 -0.22 0.10 0.00 0.47 0.00 0.00 55.06 55.80 1wgo s HIS 88 Cb -0.15 -0.09 -0.03 0.00 -0.13 0.00 0.00 32.58 32.18 1wgo s HIS 88 CO 0.08 -0.20 -0.26 0.50 -2.47 0.00 0.00 174.74 172.38 1wgo s ARG 89 N -1.15 1.57 0.37 2.88 3.00 -1.26 -1.24 118.95 123.12 1wgo s ARG 89 Ca -0.12 -1.23 0.07 0.00 -1.00 0.00 0.00 55.73 53.45 1wgo s ARG 89 Cb -0.07 -1.91 -0.01 0.00 0.00 0.00 0.00 34.95 32.96 1wgo s ARG 89 CO 0.00 0.47 0.42 0.71 0.00 0.00 0.00 175.30 176.91 1wgo s TYR 90 N -0.94 2.92 -0.08 5.12 2.02 -1.26 -5.02 117.35 120.11 1wgo s TYR 90 Ca 0.13 -0.33 -0.07 0.00 -0.37 0.00 0.00 57.07 56.43 1wgo s TYR 90 Cb -0.10 -2.05 -0.04 0.00 -0.40 0.00 0.00 41.96 39.37 1wgo s TYR 90 CO 0.04 -0.06 -0.15 0.39 -1.57 0.00 0.00 175.55 174.20 1wgo n GLU 91 N -1.59 0.24 -4.35 -0.62 -0.58 -1.26 -3.71 120.64 108.77 1wgo n GLU 91 Ca 0.02 0.10 -0.30 0.00 -0.42 0.00 0.00 57.16 56.56 1wgo n GLU 91 Cb 0.59 -0.91 -0.11 0.00 -0.57 0.00 0.00 31.44 30.45 1wgo n GLU 91 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1wgo s SER 92 N -6.02 4.19 0.76 1.62 0.15 -1.26 -4.66 113.70 108.48 1wgo s SER 92 Ca -0.15 -0.41 -0.11 0.00 0.70 0.00 0.00 55.95 55.99 1wgo s SER 92 Cb 0.04 -0.76 0.05 0.00 -1.71 0.00 0.00 66.02 63.65 1wgo s SER 92 CO 0.20 0.20 1.09 -2.16 1.20 0.00 0.00 173.24 173.78 1wgo s PRO 93 N -1.96 2.32 0.00 5.44 0.04 -1.26 -4.93 135.00 134.65 1wgo s PRO 93 Ca 0.19 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.43 1wgo s PRO 93 Cb -0.11 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.53 1wgo s PRO 93 CO 0.11 -1.60 0.00 0.41 0.04 0.00 0.00 177.00 175.96 1wgo n GLY 94 N -1.12 4.26 3.53 0.56 0.00 -0.90 -5.05 105.19 106.47 1wgo n GLY 94 Ca 0.09 -1.25 -0.41 0.00 0.00 0.00 0.00 46.02 44.45 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 -1.03 2.21 -4.29 -0.61 -0.00 -1.26 -4.26 119.36 110.11 1wgo n ILE 95 Ca 0.00 -0.50 -0.21 0.00 -0.00 0.00 0.00 62.75 62.04 1wgo n ILE 95 Cb 0.00 -0.85 -0.11 0.00 -0.00 0.00 0.00 39.64 38.67 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 -1.37 1.65 -0.39 1.39 2.02 -0.63 -4.97 117.35 115.05 1wgo s TYR 96 Ca 0.64 -0.49 -0.03 0.00 -0.37 0.00 0.00 57.07 56.82 1wgo s TYR 96 Cb -0.58 -0.85 0.10 0.00 -0.40 0.00 0.00 41.96 40.24 1wgo s TYR 96 CO 0.57 0.24 0.17 1.03 -1.57 0.00 0.00 175.55 175.98 1wgo s ARG 97 N -2.62 2.07 -0.08 -0.62 0.52 -1.26 -1.94 118.95 115.01 1wgo s ARG 97 Ca 0.12 -1.72 -0.05 0.00 -0.52 0.00 0.00 55.73 53.56 1wgo s ARG 97 Cb -0.06 -3.51 -0.04 0.00 0.52 0.00 0.00 34.95 31.86 1wgo s ARG 97 CO 0.05 -0.99 0.12 0.08 0.02 0.00 0.00 175.30 174.58 1wgo s VAL 98 N 1.16 5.21 -0.00 3.52 1.01 -0.26 -4.23 120.40 126.81 1wgo s VAL 98 Ca 0.06 0.00 0.01 0.00 0.00 0.00 0.00 61.98 62.05 1wgo s VAL 98 Cb -0.22 -3.30 -0.00 0.00 0.00 0.00 0.00 36.38 32.86 1wgo s VAL 98 CO -0.04 0.54 -0.02 -0.55 0.00 0.00 0.00 175.10 175.03 1wgo s SER 99 N -1.25 0.27 -0.36 3.32 0.15 -0.97 0.04 113.70 114.91 1wgo s SER 99 Ca 0.18 -0.04 0.00 0.00 0.70 0.00 0.00 55.95 56.79 1wgo s SER 99 Cb -0.12 -0.03 0.10 0.00 -1.71 0.00 0.00 66.02 64.25 1wgo s SER 99 CO 0.07 0.03 0.10 0.54 1.20 0.00 0.00 173.24 175.18 1wgo s VAL 100 N -0.05 2.79 0.19 4.45 0.11 0.40 -2.41 120.40 125.89 1wgo s VAL 100 Ca 0.01 -2.07 -0.00 0.00 -2.93 0.00 0.00 61.98 56.98 1wgo s VAL 100 Cb -0.01 -2.91 -0.04 0.00 -1.53 0.00 0.00 36.38 31.88 1wgo s VAL 100 CO -0.00 -0.55 0.37 -0.60 -3.33 0.00 0.00 175.10 170.99 1wgo s ARG 101 N 1.06 3.51 -0.16 1.54 3.52 -1.08 -0.33 118.95 127.01 1wgo s ARG 101 Ca 0.07 -0.37 -0.26 0.00 -0.13 0.00 0.00 55.73 55.03 1wgo s ARG 101 Cb -0.21 -2.86 0.07 0.00 -1.56 0.00 0.00 34.95 30.39 1wgo s ARG 101 CO -0.05 0.42 0.66 0.00 -0.81 0.00 0.00 175.30 175.52 1wgo s ALA 102 N -1.84 -1.68 -0.25 6.12 0.00 0.57 -0.27 121.76 124.42 1wgo s ALA 102 Ca 0.38 1.58 -0.04 0.00 0.00 0.00 0.00 51.96 53.89 1wgo s ALA 102 Cb -0.11 -0.58 0.14 0.00 0.00 0.00 0.00 23.12 22.57 1wgo s ALA 102 CO 0.29 -0.34 0.45 -2.00 0.00 0.00 0.00 175.76 174.16 1wgo s GLU 103 N -0.39 0.40 0.46 0.00 2.12 -1.20 -1.26 118.70 118.83 1wgo s GLU 103 Ca -0.05 0.79 0.06 0.00 0.36 0.00 0.00 54.97 56.13 1wgo s GLU 103 Cb -0.03 -0.01 -0.02 0.00 0.26 0.00 0.00 34.13 34.33 1wgo s GLU 103 CO 0.05 -0.53 0.27 0.54 -0.54 0.00 0.00 175.26 175.05 1wgo s ASN 104 N 2.65 4.59 0.18 -1.70 4.22 0.11 -4.50 114.94 120.49 1wgo s ASN 104 Ca 0.10 -1.10 -0.14 0.00 -2.14 0.00 0.00 52.86 49.59 1wgo s ASN 104 Cb -0.14 -0.18 0.17 0.00 1.28 0.00 0.00 41.25 42.38 1wgo s ASN 104 CO -0.16 -0.75 1.70 0.71 -2.04 0.00 0.00 177.10 176.56 1wgo h THR 105 N 1.15 0.67 0.00 0.54 1.35 -2.00 -3.22 112.91 111.40 1wgo h THR 105 Ca -0.41 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 1wgo h THR 105 Cb 1.27 0.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.20 1wgo h THR 105 CO 0.64 0.03 0.00 0.00 -0.25 0.00 0.00 175.52 175.94 1wgo n ALA 106 N -2.59 -0.29 -3.00 6.62 0.00 -1.26 -5.00 120.51 114.99 1wgo n ALA 106 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1wgo n ALA 106 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.70 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 -0.34 5.95 3.56 0.00 0.00 -1.21 -4.92 105.19 108.22 1wgo n GLY 107 Ca 0.00 -1.58 -0.14 0.00 0.00 0.00 0.00 46.02 44.29 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 -0.21 -0.71 0.07 1.61 -3.43 -1.26 0.04 115.29 111.40 1wgo s HIS 108 Ca 0.00 1.68 -0.06 0.00 -0.80 0.00 0.00 55.06 55.89 1wgo s HIS 108 Cb 0.00 0.27 -0.02 0.00 -1.43 0.00 0.00 32.58 31.40 1wgo s HIS 108 CO 0.00 -0.39 0.10 0.34 -2.00 0.00 0.00 174.74 172.80 1wgo s ASP 109 N 0.13 0.26 -0.16 7.38 2.15 -0.39 -4.80 116.67 121.25 1wgo s ASP 109 Ca -0.02 -0.78 -0.21 0.00 0.43 0.00 0.00 52.55 51.97 1wgo s ASP 109 Cb -0.04 0.28 0.05 0.00 -0.30 0.00 0.00 42.92 42.92 1wgo s ASP 109 CO 0.02 -0.67 0.56 -0.70 -0.17 0.00 0.00 175.17 174.21 1wgo s GLU 110 N -3.84 0.74 0.34 4.34 -6.30 -1.26 -0.32 118.70 112.41 1wgo s GLU 110 Ca 0.05 0.58 0.04 0.00 -2.50 0.00 0.00 54.97 53.14 1wgo s GLU 110 Cb 0.06 0.35 -0.05 0.00 0.00 0.00 0.00 34.13 34.49 1wgo s GLU 110 CO -0.10 -0.14 0.07 0.00 0.02 0.00 0.00 175.26 175.11 1wgo s ALA 111 N -0.17 2.48 0.07 6.30 0.00 0.56 -4.97 121.76 126.03 1wgo s ALA 111 Ca -0.04 -1.84 0.02 0.00 0.00 0.00 0.00 51.96 50.10 1wgo s ALA 111 Cb -0.03 0.69 -0.03 0.00 0.00 0.00 0.00 23.12 23.74 1wgo s ALA 111 CO 0.03 -0.32 -0.07 0.08 0.00 0.00 0.00 175.76 175.49 1wgo s VAL 112 N -3.30 0.58 -0.10 0.00 1.01 -1.26 -0.45 120.40 116.88 1wgo s VAL 112 Ca 0.33 -1.56 -0.14 0.00 0.00 0.00 0.00 61.98 60.62 1wgo s VAL 112 Cb 0.07 -1.20 0.03 0.00 0.00 0.00 0.00 36.38 35.29 1wgo s VAL 112 CO 0.15 -0.68 0.36 -0.22 0.00 0.00 0.00 175.10 174.72 1wgo s LEU 113 N -2.41 0.62 -0.21 3.92 0.20 0.11 -4.82 118.68 116.09 1wgo s LEU 113 Ca 0.02 0.55 -0.01 0.00 0.69 0.00 0.00 54.13 55.38 1wgo s LEU 113 Cb -0.01 1.32 0.01 0.00 -0.43 0.00 0.00 46.19 47.08 1wgo s LEU 113 CO -0.03 -0.24 -0.12 -0.36 -0.29 0.00 0.00 176.35 175.31 1wgo s PHE 114 N -0.31 2.89 0.07 5.38 0.40 -1.26 -1.10 117.98 124.05 1wgo s PHE 114 Ca -0.05 -1.33 0.00 0.00 -0.60 0.00 0.00 56.93 54.96 1wgo s PHE 114 Cb -0.03 -2.02 -0.04 0.00 0.51 0.00 0.00 43.02 41.44 1wgo s PHE 114 CO 0.02 -0.69 0.21 0.08 0.70 0.00 0.00 175.22 175.54 1wgo s VAL 115 N 1.38 5.33 -0.36 -0.44 1.01 -0.82 -4.97 120.40 121.53 1wgo s VAL 115 Ca 0.05 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 61.59 1wgo s VAL 115 Cb -0.14 -3.61 0.11 0.00 0.00 0.00 0.00 36.38 32.73 1wgo s VAL 115 CO -0.08 0.11 0.12 -1.58 0.00 0.00 0.00 175.10 173.67 1wgo s GLN 116 N -2.59 1.15 -0.46 2.72 0.74 -1.26 -1.60 119.66 118.37 1wgo s GLN 116 Ca 0.35 -1.60 -0.18 0.00 0.05 0.00 0.00 55.36 53.97 1wgo s GLN 116 Cb -0.13 -2.55 0.04 0.00 1.10 0.00 0.00 33.01 31.47 1wgo s GLN 116 CO 0.28 -1.01 0.54 0.54 -0.55 0.00 0.00 175.29 175.09 1wgo s VAL 117 N 1.04 4.97 0.82 1.34 0.11 -1.26 -1.78 120.40 125.64 1wgo s VAL 117 Ca 0.12 -0.34 -0.13 0.00 -2.93 0.00 0.00 61.98 58.70 1wgo s VAL 117 Cb -0.20 -4.16 0.21 0.00 -1.53 0.00 0.00 36.38 30.70 1wgo s VAL 117 CO -0.14 -0.59 0.47 -0.24 -3.33 0.00 0.00 175.10 171.27 1wgo n SER 118 N 5.90 -3.12 -4.91 3.54 2.88 -0.11 -2.12 113.62 115.68 1wgo n SER 118 Ca -0.06 -0.47 -0.21 0.00 -1.33 0.00 0.00 58.87 56.80 1wgo n SER 118 Cb 0.47 -0.56 0.05 0.00 -0.75 0.00 0.00 64.21 63.42 1wgo n SER 118 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wgo s GLY 119 N -2.46 1.82 0.79 0.46 0.00 -1.26 -4.15 107.32 102.51 1wgo s GLY 119 Ca 0.36 -1.55 -0.11 0.00 0.00 0.00 0.00 44.72 43.42 1wgo s GLY 119 CO 0.30 -1.20 1.09 2.56 0.00 0.00 0.00 173.10 175.86 1wgo s PRO 120 N -4.79 2.13 -0.14 2.90 0.04 -1.26 -4.74 135.00 129.13 1wgo s PRO 120 Ca 0.60 1.12 -0.04 0.00 0.04 0.00 0.00 61.00 62.72 1wgo s PRO 120 Cb -0.09 -1.89 0.07 0.00 0.04 0.00 0.00 34.50 32.64 1wgo s PRO 120 CO 0.39 -1.72 0.20 -1.12 0.04 0.00 0.00 177.00 174.79 1wgo s SER 121 N -3.40 0.99 0.50 6.66 0.01 -1.26 -5.13 113.70 112.07 1wgo s SER 121 Ca 0.61 0.12 -0.17 0.00 1.31 0.00 0.00 55.95 57.82 1wgo s SER 121 Cb -0.17 0.38 -0.08 0.00 0.21 0.00 0.00 66.02 66.36 1wgo s SER 121 CO 0.56 -0.28 0.98 -0.94 0.41 0.00 0.00 173.24 173.97 1wgo s SER 122 N 2.33 6.65 0.00 2.44 1.04 -1.26 -5.24 113.70 119.66 1wgo s SER 122 Ca 0.04 1.61 0.00 0.00 0.48 0.00 0.00 55.95 58.08 1wgo s SER 122 Cb -0.14 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.47 1wgo s SER 122 CO -0.09 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.17