#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wf8 s SER 2 N 0.00 4.34 0.03 1.61 1.04 -1.26 -5.06 113.70 114.40 1wf8 s SER 2 Ca 0.00 1.71 -0.27 0.00 0.48 0.00 0.00 55.95 57.87 1wf8 s SER 2 Cb 0.00 -2.42 0.09 0.00 0.10 0.00 0.00 66.02 63.79 1wf8 s SER 2 CO 0.00 -2.12 0.77 -0.55 0.98 0.00 0.00 173.24 172.31 1wf8 s SER 3 N -3.45 -0.48 0.00 7.02 0.15 -1.26 -5.18 113.70 110.50 1wf8 s SER 3 Ca 0.61 0.16 0.00 0.00 0.70 0.00 0.00 55.95 57.42 1wf8 s SER 3 Cb -0.17 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 1wf8 s SER 3 CO 0.56 -0.71 0.00 0.61 1.20 0.00 0.00 173.24 174.90 1wf8 n GLY 4 N 0.00 1.71 0.25 9.45 0.00 -1.26 -5.07 105.19 110.27 1wf8 n GLY 4 Ca -0.13 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 43.99 1wf8 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wf8 n SER 5 N 0.00 -0.46 -4.58 1.61 7.64 -1.26 -5.09 113.62 111.48 1wf8 n SER 5 Ca 0.00 0.51 -0.43 0.00 1.01 0.00 0.00 58.87 59.96 1wf8 n SER 5 Cb 0.00 0.83 -0.03 0.00 -1.01 0.00 0.00 64.21 64.01 1wf8 n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wf8 s SER 6 N -1.92 6.54 -0.83 6.43 0.15 -1.26 -4.96 113.70 117.85 1wf8 s SER 6 Ca 0.00 0.23 0.01 0.00 0.70 0.00 0.00 55.95 56.89 1wf8 s SER 6 Cb 0.00 -2.51 0.21 0.00 -1.71 0.00 0.00 66.02 62.00 1wf8 s SER 6 CO 0.00 -1.23 0.70 0.61 1.20 0.00 0.00 173.24 174.51 1wf8 n GLY 7 N 4.94 4.13 3.28 9.45 0.00 -1.26 -5.04 105.19 120.68 1wf8 n GLY 7 Ca 0.09 -2.60 -0.24 0.00 0.00 0.00 0.00 46.02 43.27 1wf8 n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wf8 s LEU 8 N -1.49 2.30 -0.88 0.99 2.01 -1.26 -4.21 118.68 116.14 1wf8 s LEU 8 Ca 0.27 -0.68 -0.24 0.00 0.01 0.00 0.00 54.13 53.49 1wf8 s LEU 8 Cb -0.05 -0.87 0.05 0.00 0.01 0.00 0.00 46.19 45.33 1wf8 s LEU 8 CO -0.14 0.05 1.33 -0.70 1.01 0.00 0.00 176.35 177.90 1wf8 s GLU 9 N -1.90 3.40 -0.41 1.70 2.12 0.35 -4.83 118.70 119.13 1wf8 s GLU 9 Ca 0.06 -0.80 -0.19 0.00 0.36 0.00 0.00 54.97 54.40 1wf8 s GLU 9 Cb -0.10 -4.79 0.02 0.00 0.26 0.00 0.00 34.13 29.52 1wf8 s GLU 9 CO 0.04 -2.13 0.56 -0.51 -0.54 0.00 0.00 175.26 172.68 1wf8 s LEU 10 N 5.05 4.55 -0.04 2.70 1.43 -1.25 -1.31 118.68 129.82 1wf8 s LEU 10 Ca 0.39 -0.34 0.02 0.00 -1.03 0.00 0.00 54.13 53.16 1wf8 s LEU 10 Cb -0.05 -2.61 0.01 0.00 0.03 0.00 0.00 46.19 43.58 1wf8 s LEU 10 CO 0.01 -0.66 -0.07 0.72 0.23 0.00 0.00 176.35 176.58 1wf8 s PHE 11 N 2.55 0.90 0.05 0.29 -0.71 -0.82 -4.96 117.98 115.27 1wf8 s PHE 11 Ca 0.19 -0.26 -0.30 0.00 -1.04 0.00 0.00 56.93 55.52 1wf8 s PHE 11 Cb -0.15 -0.70 -0.05 0.00 -1.21 0.00 0.00 43.02 40.90 1wf8 s PHE 11 CO 0.16 -0.16 1.17 -1.25 -1.34 0.00 0.00 175.22 173.80 1wf8 s PRO 12 N 0.57 4.45 -0.16 1.99 0.04 -1.26 -2.04 135.00 138.59 1wf8 s PRO 12 Ca -0.09 1.72 0.01 0.00 0.04 0.00 0.00 61.00 62.69 1wf8 s PRO 12 Cb -0.12 -3.37 0.01 0.00 0.04 0.00 0.00 34.50 31.06 1wf8 s PRO 12 CO 0.01 -0.23 -0.20 0.08 0.04 0.00 0.00 177.00 176.70 1wf8 s VAL 13 N 1.10 2.19 0.12 -0.36 1.01 0.46 -4.86 120.40 120.06 1wf8 s VAL 13 Ca 0.58 -0.92 -0.28 0.00 0.00 0.00 0.00 61.98 61.36 1wf8 s VAL 13 Cb -0.28 -1.90 -0.07 0.00 0.00 0.00 0.00 36.38 34.13 1wf8 s VAL 13 CO 0.29 0.54 0.88 -1.61 0.00 0.00 0.00 175.10 175.20 1wf8 s GLU 14 N 0.99 4.66 -0.03 2.72 2.02 -1.26 0.16 118.70 127.97 1wf8 s GLU 14 Ca -0.02 1.32 0.01 0.00 0.02 0.00 0.00 54.97 56.30 1wf8 s GLU 14 Cb -0.15 -3.34 0.02 0.00 0.10 0.00 0.00 34.13 30.76 1wf8 s GLU 14 CO -0.05 0.33 -0.03 -0.51 0.02 0.00 0.00 175.26 175.02 1wf8 s LEU 15 N -0.38 1.42 -0.60 1.80 1.43 0.31 -4.95 118.68 117.72 1wf8 s LEU 15 Ca 0.42 -0.08 -0.16 0.00 -1.03 0.00 0.00 54.13 53.29 1wf8 s LEU 15 Cb -0.23 -0.30 0.14 0.00 0.03 0.00 0.00 46.19 45.82 1wf8 s LEU 15 CO 0.28 -0.05 0.59 -1.61 0.23 0.00 0.00 176.35 175.79 1wf8 s GLU 16 N 0.71 3.10 0.98 1.70 2.02 -1.26 0.14 118.70 126.09 1wf8 s GLU 16 Ca -0.08 -1.76 -0.17 0.00 0.02 0.00 0.00 54.97 52.98 1wf8 s GLU 16 Cb -0.11 -4.33 -0.14 0.00 0.10 0.00 0.00 34.13 29.65 1wf8 s GLU 16 CO -0.01 -1.37 -0.72 1.63 0.02 0.00 0.00 175.26 174.82 1wf8 n LYS 17 N 5.25 -0.01 -4.68 1.61 5.02 0.76 -4.85 118.16 121.27 1wf8 n LYS 17 Ca -0.08 -0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.90 1wf8 n LYS 17 Cb 0.42 -1.05 -0.08 0.00 -0.02 0.00 0.00 35.03 34.30 1wf8 n LYS 17 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1wf8 s ASP 18 N -1.05 3.76 0.63 4.39 1.01 0.48 -4.87 116.67 121.02 1wf8 s ASP 18 Ca 0.42 -1.60 0.24 0.00 0.71 0.00 0.00 52.55 52.32 1wf8 s ASP 18 Cb -0.19 0.33 1.23 0.00 1.01 0.00 0.00 42.92 45.30 1wf8 s ASP 18 CO 0.82 -0.78 1.69 1.05 0.21 0.00 0.00 175.17 178.15 1wf8 h GLU 19 N 1.54 0.00 0.00 8.23 -0.00 -2.00 1.39 114.58 123.74 1wf8 h GLU 19 Ca -0.42 0.00 -0.19 0.00 -0.00 0.00 0.00 59.36 58.75 1wf8 h GLU 19 Cb 1.29 0.00 -0.04 0.00 -0.00 0.00 0.00 28.75 30.01 1wf8 h GLU 19 CO 0.72 0.00 -2.19 -3.47 -0.00 0.00 0.00 179.01 174.07 1wf8 n ASP 20 N -3.15 0.05 0.00 3.06 2.03 -1.26 -5.10 116.55 112.18 1wf8 n ASP 20 Ca 0.05 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.36 1wf8 n ASP 20 Cb 0.73 1.48 0.00 0.00 -0.72 0.00 0.00 41.12 42.60 1wf8 n ASP 20 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wf8 n GLY 21 N 1.53 0.19 0.20 0.27 0.00 0.48 -4.78 105.19 103.07 1wf8 n GLY 21 Ca -0.19 -1.70 -0.14 0.00 0.00 0.00 0.00 46.02 43.99 1wf8 n GLY 21 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wf8 h LEU 22 N 0.00 -0.37 -0.85 0.99 3.38 -1.92 1.39 115.31 117.93 1wf8 h LEU 22 Ca 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1wf8 h LEU 22 Cb 0.00 0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1wf8 h LEU 22 CO 0.00 -0.14 0.00 0.61 0.09 0.00 0.00 178.44 179.00 1wf8 n GLY 23 N -0.86 0.81 3.24 0.83 0.00 -1.26 -2.30 105.19 105.65 1wf8 n GLY 23 Ca -0.10 -0.40 -0.10 0.00 0.00 0.00 0.00 46.02 45.42 1wf8 n GLY 23 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1wf8 s ILE 24 N -2.54 0.09 0.06 -0.61 -4.36 -1.26 -2.61 121.20 109.97 1wf8 s ILE 24 Ca 0.00 -1.63 0.09 0.00 -0.26 0.00 0.00 60.65 58.85 1wf8 s ILE 24 Cb 0.00 -1.91 -0.03 0.00 1.25 0.00 0.00 42.46 41.77 1wf8 s ILE 24 CO 0.00 -0.40 -0.26 -0.44 0.24 0.00 0.00 174.94 174.08 1wf8 s SER 25 N -3.00 3.25 0.53 4.36 0.01 0.06 -4.92 113.70 113.99 1wf8 s SER 25 Ca 0.20 -0.61 0.01 0.00 1.31 0.00 0.00 55.95 56.86 1wf8 s SER 25 Cb 0.05 -0.30 0.00 0.00 0.21 0.00 0.00 66.02 65.99 1wf8 s SER 25 CO 0.00 0.24 0.07 0.27 0.41 0.00 0.00 173.24 174.23 1wf8 s ILE 26 N -0.87 1.15 -0.21 1.44 -4.36 -1.26 -0.43 121.20 116.67 1wf8 s ILE 26 Ca 0.12 -1.92 -0.19 0.00 -0.26 0.00 0.00 60.65 58.41 1wf8 s ILE 26 Cb -0.10 -2.07 0.06 0.00 1.25 0.00 0.00 42.46 41.59 1wf8 s ILE 26 CO 0.03 0.00 0.56 -0.51 0.24 0.00 0.00 174.94 175.26 1wf8 s ILE 27 N -2.88 -0.00 -0.44 8.37 2.07 0.17 -3.95 121.20 124.54 1wf8 s ILE 27 Ca 0.07 0.00 -0.18 0.00 -1.41 0.00 0.00 60.65 59.13 1wf8 s ILE 27 Cb 0.00 -0.79 0.03 0.00 0.13 0.00 0.00 42.46 41.83 1wf8 s ILE 27 CO 0.04 0.00 0.51 -0.83 -1.91 0.00 0.00 174.94 172.76 1wf8 s GLY 28 N 0.40 1.84 0.18 1.50 0.00 -1.26 -1.94 107.32 108.03 1wf8 s GLY 28 Ca -0.01 -1.48 0.05 0.00 0.00 0.00 0.00 44.72 43.29 1wf8 s GLY 28 CO -0.01 1.29 -0.10 1.06 0.00 0.00 0.00 173.10 175.35 1wf8 s MET 29 N 2.36 1.19 -0.34 2.90 1.00 -1.12 -4.99 119.30 120.30 1wf8 s MET 29 Ca 0.15 -1.53 -0.09 0.00 0.00 0.00 0.00 55.69 54.22 1wf8 s MET 29 Cb -0.17 -0.79 0.02 0.00 0.00 0.00 0.00 34.83 33.89 1wf8 s MET 29 CO 0.15 0.09 0.16 0.20 0.00 0.00 0.00 175.02 175.61 1wf8 s GLY 30 N -3.24 1.88 0.00 -0.03 0.00 -1.26 0.77 107.32 105.44 1wf8 s GLY 30 Ca 0.20 -1.62 0.00 0.00 0.00 0.00 0.00 44.72 43.30 1wf8 s GLY 30 CO 0.04 0.77 0.00 -0.62 0.00 0.00 0.00 173.10 173.29 1wf8 n VAL 31 N 4.94 0.00 -1.19 1.40 0.31 -0.21 -4.73 118.33 118.85 1wf8 n VAL 31 Ca -0.13 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 63.95 1wf8 n VAL 31 Cb 0.47 -1.17 -0.15 0.00 -0.91 0.00 0.00 33.84 32.07 1wf8 n VAL 31 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wf8 n GLY 32 N 5.00 -0.39 2.90 2.92 0.00 -1.26 -4.48 105.19 109.87 1wf8 n GLY 32 Ca 0.00 0.48 -0.30 0.00 0.00 0.00 0.00 46.02 46.19 1wf8 n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wf8 s ALA 33 N 3.72 2.05 -0.35 4.61 0.00 -1.26 -3.86 121.76 126.66 1wf8 s ALA 33 Ca 1.07 -1.71 0.03 0.00 0.00 0.00 0.00 51.96 51.34 1wf8 s ALA 33 Cb -0.85 -1.61 0.49 0.00 0.00 0.00 0.00 23.12 21.15 1wf8 s ALA 33 CO 0.42 -1.44 1.72 -0.25 0.00 0.00 0.00 175.76 176.20 1wf8 n ASP 34 N 4.63 3.85 -3.34 0.00 9.92 -1.26 -4.85 116.55 125.50 1wf8 n ASP 34 Ca -0.05 -3.22 -0.16 0.00 -0.53 0.00 0.00 54.79 50.82 1wf8 n ASP 34 Cb 0.43 -0.78 0.08 0.00 -0.64 0.00 0.00 41.12 40.22 1wf8 n ASP 34 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1wf8 n ALA 35 N -0.70 -2.24 0.00 2.24 0.00 -1.26 -4.70 120.51 113.84 1wf8 n ALA 35 Ca 0.45 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.93 1wf8 n ALA 35 Cb 1.32 -4.06 0.00 0.00 0.00 0.00 0.00 19.45 16.72 1wf8 n ALA 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wf8 n GLY 36 N -1.18 -0.50 2.50 0.00 0.00 -1.26 -4.97 105.19 99.77 1wf8 n GLY 36 Ca -0.18 0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 1wf8 n GLY 36 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1wf8 n LEU 37 N 0.00 5.70 -4.73 0.99 -0.00 -1.26 -5.04 117.00 112.67 1wf8 n LEU 37 Ca 0.00 -4.97 -0.42 0.00 -0.00 0.00 0.00 56.01 50.63 1wf8 n LEU 37 Cb 0.00 -0.63 -0.03 0.00 -0.00 0.00 0.00 43.42 42.76 1wf8 n LEU 37 CO 0.00 2.03 1.18 -1.83 -0.00 0.00 0.00 177.39 178.77 1wf8 s GLU 38 N -3.71 4.24 -0.23 1.47 -1.05 -1.26 -4.62 118.70 113.54 1wf8 s GLU 38 Ca 0.51 2.33 -0.00 0.00 -0.15 0.00 0.00 54.97 57.66 1wf8 s GLU 38 Cb 0.42 -3.14 0.06 0.00 -0.44 0.00 0.00 34.13 31.03 1wf8 s GLU 38 CO -0.19 -0.53 -0.04 0.15 0.95 0.00 0.00 175.26 175.60 1wf8 s LYS 39 N 0.56 1.43 -0.20 -4.83 -0.14 -1.25 -4.88 119.74 110.43 1wf8 s LYS 39 Ca 0.66 -0.87 -0.29 0.00 -1.36 0.00 0.00 55.97 54.11 1wf8 s LYS 39 Cb -0.43 -2.49 -0.03 0.00 -1.68 0.00 0.00 37.83 33.21 1wf8 s LYS 39 CO 0.36 -0.60 1.55 -1.17 -0.76 0.00 0.00 175.35 174.73 1wf8 s LEU 40 N 1.49 3.98 -0.25 3.17 2.96 -1.26 -1.05 118.68 127.72 1wf8 s LEU 40 Ca -0.05 1.66 -0.14 0.00 -0.22 0.00 0.00 54.13 55.39 1wf8 s LEU 40 Cb -0.18 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 1wf8 s LEU 40 CO -0.07 -1.15 0.33 -0.83 -1.32 0.00 0.00 176.35 173.32 1wf8 s GLY 41 N 3.74 1.94 -0.44 7.98 0.00 0.23 -1.76 107.32 119.01 1wf8 s GLY 41 Ca 0.68 -0.80 -0.26 0.00 0.00 0.00 0.00 44.72 44.34 1wf8 s GLY 41 CO 0.27 0.83 0.93 -0.42 0.00 0.00 0.00 173.10 174.71 1wf8 s ILE 42 N 1.75 4.50 0.33 0.90 -1.09 -1.25 -2.78 121.20 123.56 1wf8 s ILE 42 Ca 0.14 0.86 0.08 0.00 -2.23 0.00 0.00 60.65 59.49 1wf8 s ILE 42 Cb -0.15 -4.41 -0.03 0.00 -1.58 0.00 0.00 42.46 36.28 1wf8 s ILE 42 CO 0.09 -0.77 0.21 -0.36 -1.23 0.00 0.00 174.94 172.88 1wf8 s PHE 43 N 3.70 2.81 -0.53 3.97 0.40 -0.82 0.33 117.98 127.84 1wf8 s PHE 43 Ca 0.37 -0.33 -0.23 0.00 -0.60 0.00 0.00 56.93 56.14 1wf8 s PHE 43 Cb -0.10 -1.69 0.04 0.00 0.51 0.00 0.00 43.02 41.78 1wf8 s PHE 43 CO 0.25 0.28 0.85 0.08 0.70 0.00 0.00 175.22 177.38 1wf8 s VAL 44 N -2.36 4.53 0.23 -0.44 1.01 -0.40 0.44 120.40 123.41 1wf8 s VAL 44 Ca 0.39 0.11 -0.08 0.00 0.00 0.00 0.00 61.98 62.40 1wf8 s VAL 44 Cb -0.04 -4.46 0.19 0.00 0.00 0.00 0.00 36.38 32.07 1wf8 s VAL 44 CO 0.24 -1.00 1.86 0.50 0.00 0.00 0.00 175.10 176.71 1wf8 h LYS 45 N 9.20 0.95 -2.27 2.72 1.63 -0.87 1.51 116.57 129.44 1wf8 h LYS 45 Ca -0.26 -0.06 0.23 0.00 -0.85 0.00 0.00 60.65 59.71 1wf8 h LYS 45 Cb 1.08 -0.21 -0.06 0.00 -0.60 0.00 0.00 32.23 32.44 1wf8 h LYS 45 CO 1.05 0.63 0.67 -0.08 -3.45 0.00 0.00 179.45 178.27 1wf8 s THR 46 N -6.10 0.00 -0.09 1.00 -1.32 -1.20 -4.56 115.64 103.37 1wf8 s THR 46 Ca -0.13 -0.46 0.01 0.00 -1.21 0.00 0.00 61.69 59.90 1wf8 s THR 46 Cb 0.17 -2.64 0.02 0.00 -1.51 0.00 0.00 72.50 68.53 1wf8 s THR 46 CO 0.78 0.00 -0.09 -0.69 -2.21 0.00 0.00 174.62 172.41 1wf8 s VAL 47 N -2.34 1.05 0.29 5.08 1.01 -1.26 -0.76 120.40 123.47 1wf8 s VAL 47 Ca 0.21 -0.35 -0.30 0.00 0.00 0.00 0.00 61.98 61.54 1wf8 s VAL 47 Cb -0.01 -1.03 -0.12 0.00 0.00 0.00 0.00 36.38 35.22 1wf8 s VAL 47 CO 0.02 0.36 1.60 0.41 0.00 0.00 0.00 175.10 177.50 1wf8 n THR 48 N 4.52 0.95 -2.19 3.92 -1.04 -1.07 -4.88 114.28 114.49 1wf8 n THR 48 Ca -0.17 -0.24 -0.42 0.00 -2.04 0.00 0.00 64.05 61.18 1wf8 n THR 48 Cb 0.51 -1.96 -0.03 0.00 -1.82 0.00 0.00 70.33 67.03 1wf8 n THR 48 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1wf8 s GLU 49 N -0.40 3.35 0.00 -2.82 2.12 -1.26 -1.83 118.70 117.86 1wf8 s GLU 49 Ca 0.65 1.03 0.00 0.00 0.36 0.00 0.00 54.97 57.00 1wf8 s GLU 49 Cb -0.50 -4.14 0.00 0.00 0.26 0.00 0.00 34.13 29.75 1wf8 s GLU 49 CO 0.47 -1.85 0.00 0.41 -0.54 0.00 0.00 175.26 173.76 1wf8 n GLY 50 N 5.30 0.96 0.00 -1.50 0.00 -1.26 -5.09 105.19 103.60 1wf8 n GLY 50 Ca 0.19 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1wf8 n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wf8 n GLY 51 N -2.07 -0.48 0.06 -0.02 0.00 -0.76 -4.81 105.19 97.10 1wf8 n GLY 51 Ca 0.00 -1.72 -0.04 0.00 0.00 0.00 0.00 46.02 44.26 1wf8 n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wf8 h ALA 52 N -1.71 0.01 -0.58 4.61 0.00 -1.67 -2.06 119.26 117.86 1wf8 h ALA 52 Ca 0.00 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.80 1wf8 h ALA 52 Cb 0.00 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1wf8 h ALA 52 CO 0.00 0.07 0.39 0.00 0.00 0.00 0.00 179.25 179.71 1wf8 h ALA 53 N -0.77 1.94 0.31 0.00 0.00 -1.79 -1.39 119.26 117.56 1wf8 h ALA 53 Ca -0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1wf8 h ALA 53 Cb 0.31 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1wf8 h ALA 53 CO -0.01 -0.06 -0.15 0.37 0.00 0.00 0.00 179.25 179.41 1wf8 h GLN 54 N 0.46 -0.40 -0.97 0.00 -0.00 -1.79 -1.34 115.11 111.07 1wf8 h GLN 54 Ca 0.26 0.03 0.26 0.00 -0.00 0.00 0.00 58.65 59.20 1wf8 h GLN 54 Cb 0.43 0.09 -0.18 0.00 0.00 0.00 0.00 27.48 27.82 1wf8 h GLN 54 CO -0.07 -0.27 0.03 0.00 0.00 0.00 0.00 178.83 178.51 1wf8 h ARG 55 N -0.63 0.02 -0.10 1.69 3.08 -1.12 0.93 114.38 118.25 1wf8 h ARG 55 Ca -0.04 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1wf8 h ARG 55 Cb 0.32 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.36 1wf8 h ARG 55 CO 0.07 0.02 0.06 0.22 -1.07 0.00 0.00 179.97 179.27 1wf8 h ASP 56 N 0.02 0.11 0.00 7.04 3.58 -1.28 -3.46 116.42 122.43 1wf8 h ASP 56 Ca 0.58 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 58.01 1wf8 h ASP 56 Cb 1.17 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 42.20 1wf8 h ASP 56 CO -0.90 0.10 0.00 0.61 -2.88 0.00 0.00 179.24 176.18 1wf8 n GLY 57 N -1.06 2.29 0.11 -0.78 0.00 0.32 -4.87 105.19 101.20 1wf8 n GLY 57 Ca -0.05 -0.30 -0.03 0.00 0.00 0.00 0.00 46.02 45.64 1wf8 n GLY 57 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1wf8 n ARG 58 N 0.00 -0.12 -2.12 1.61 0.00 -1.26 -4.25 116.66 110.53 1wf8 n ARG 58 Ca 0.00 1.06 -0.41 0.00 -0.00 0.00 0.00 57.85 58.49 1wf8 n ARG 58 Cb 0.00 -1.57 -0.03 0.00 0.00 0.00 0.00 32.46 30.86 1wf8 n ARG 58 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1wf8 s ILE 59 N -3.72 2.88 0.49 5.15 1.01 -1.26 -5.02 121.20 120.74 1wf8 s ILE 59 Ca -0.03 0.77 0.02 0.00 0.00 0.00 0.00 60.65 61.41 1wf8 s ILE 59 Cb 0.03 -3.49 -0.02 0.00 0.01 0.00 0.00 42.46 38.98 1wf8 s ILE 59 CO 0.17 0.14 0.01 -1.10 0.00 0.00 0.00 174.94 174.15 1wf8 s GLN 60 N -0.65 2.15 0.30 2.79 -1.52 -1.26 -4.75 119.66 116.72 1wf8 s GLN 60 Ca 0.55 -2.35 -0.18 0.00 -1.95 0.00 0.00 55.36 51.44 1wf8 s GLN 60 Cb -0.39 -1.52 -0.09 0.00 -0.22 0.00 0.00 33.01 30.79 1wf8 s GLN 60 CO 0.44 -0.32 0.76 0.08 -0.25 0.00 0.00 175.29 176.00 1wf8 s VAL 61 N -2.86 4.59 0.00 1.09 1.01 -1.26 -3.45 120.40 119.52 1wf8 s VAL 61 Ca 0.11 1.15 0.00 0.00 0.00 0.00 0.00 61.98 63.24 1wf8 s VAL 61 Cb 0.03 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.70 1wf8 s VAL 61 CO 0.06 -0.05 0.00 0.59 0.00 0.00 0.00 175.10 175.70 1wf8 n ASN 62 N 0.03 -0.88 -3.43 3.32 3.02 0.52 -4.93 115.26 112.91 1wf8 n ASN 62 Ca 0.02 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.26 1wf8 n ASN 62 Cb 0.52 -0.36 0.28 0.00 -0.61 0.00 0.00 39.78 39.61 1wf8 n ASN 62 CO 0.00 0.00 0.00 1.51 -2.62 0.00 0.00 177.26 176.15 1wf8 s ASP 63 N -2.67 -0.55 -0.16 6.41 -4.77 -1.22 -4.54 116.67 109.17 1wf8 s ASP 63 Ca 0.00 0.66 -0.01 0.00 -3.30 0.00 0.00 52.55 49.90 1wf8 s ASP 63 Cb 0.00 -0.89 0.05 0.00 -1.09 0.00 0.00 42.92 40.99 1wf8 s ASP 63 CO 0.00 -5.03 -0.01 -1.58 0.70 0.00 0.00 175.17 169.25 1wf8 s GLN 64 N -5.31 1.05 -1.06 2.11 0.74 -1.26 -1.28 119.66 114.65 1wf8 s GLN 64 Ca 0.70 -0.41 -0.19 0.00 0.05 0.00 0.00 55.36 55.51 1wf8 s GLN 64 Cb -0.10 -1.91 0.10 0.00 1.10 0.00 0.00 33.01 32.21 1wf8 s GLN 64 CO 0.56 -0.49 1.38 0.42 -0.55 0.00 0.00 175.29 176.61 1wf8 s ILE 65 N 1.75 4.44 0.20 -2.34 1.01 0.15 -2.27 121.20 124.13 1wf8 s ILE 65 Ca 0.00 -1.57 -0.09 0.00 0.00 0.00 0.00 60.65 59.00 1wf8 s ILE 65 Cb -0.16 -4.95 0.12 0.00 0.01 0.00 0.00 42.46 37.48 1wf8 s ILE 65 CO -0.07 -1.74 1.74 0.58 0.00 0.00 0.00 174.94 175.45 1wf8 h VAL 66 N 5.88 1.26 -3.86 2.92 2.07 -1.51 -3.38 116.25 119.62 1wf8 h VAL 66 Ca 0.24 -0.88 -0.09 0.00 0.82 0.00 0.00 66.70 66.79 1wf8 h VAL 66 Cb 0.97 0.46 -0.14 0.00 -1.52 0.00 0.00 31.29 31.05 1wf8 h VAL 66 CO 1.29 0.34 -0.43 -0.70 0.02 0.00 0.00 177.57 178.09 1wf8 s GLU 67 N -5.44 0.79 -0.16 1.57 2.12 -1.18 -1.20 118.70 115.20 1wf8 s GLU 67 Ca -0.12 -0.97 -0.04 0.00 0.36 0.00 0.00 54.97 54.19 1wf8 s GLU 67 Cb 0.15 0.31 0.07 0.00 0.26 0.00 0.00 34.13 34.92 1wf8 s GLU 67 CO 0.84 -0.23 0.17 0.08 -0.54 0.00 0.00 175.26 175.57 1wf8 s VAL 68 N -3.75 -0.25 -1.70 3.70 1.01 0.43 -0.94 120.40 118.91 1wf8 s VAL 68 Ca 0.04 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.05 1wf8 s VAL 68 Cb 0.05 -0.53 0.00 0.00 0.00 0.00 0.00 36.38 35.90 1wf8 s VAL 68 CO -0.10 -0.11 0.00 -0.67 0.00 0.00 0.00 175.10 174.22 1wf8 n ASP 69 N 5.31 -5.15 0.00 3.32 2.03 0.72 0.07 116.55 122.86 1wf8 n ASP 69 Ca -0.06 0.19 0.00 0.00 0.52 0.00 0.00 54.79 55.44 1wf8 n ASP 69 Cb 0.49 -4.40 0.00 0.00 -0.72 0.00 0.00 41.12 36.49 1wf8 n ASP 69 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wf8 n GLY 70 N -0.74 2.84 3.77 0.27 0.00 -1.26 -4.95 105.19 105.12 1wf8 n GLY 70 Ca -0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 1wf8 n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wf8 s ILE 71 N -2.78 2.63 -0.25 -0.61 1.01 0.11 -4.98 121.20 116.33 1wf8 s ILE 71 Ca 0.00 0.59 -0.14 0.00 0.00 0.00 0.00 60.65 61.10 1wf8 s ILE 71 Cb 0.00 -3.36 -0.04 0.00 0.01 0.00 0.00 42.46 39.07 1wf8 s ILE 71 CO 0.00 0.11 0.31 -0.55 0.00 0.00 0.00 174.94 174.81 1wf8 s SER 72 N -0.61 6.23 -0.33 3.58 0.15 -1.26 0.16 113.70 121.62 1wf8 s SER 72 Ca 0.54 0.25 0.09 0.00 0.70 0.00 0.00 55.95 57.53 1wf8 s SER 72 Cb -0.39 -2.18 0.63 0.00 -1.71 0.00 0.00 66.02 62.37 1wf8 s SER 72 CO 0.51 -0.09 1.68 0.18 1.20 0.00 0.00 173.24 176.72 1wf8 n LEU 73 N 4.92 5.37 -4.66 3.45 4.77 -0.34 -4.90 117.00 125.61 1wf8 n LEU 73 Ca -0.11 -3.46 -0.35 0.00 -0.03 0.00 0.00 56.01 52.07 1wf8 n LEU 73 Cb 0.51 -0.71 -0.09 0.00 -2.33 0.00 0.00 43.42 40.80 1wf8 n LEU 73 CO 0.37 0.98 -0.26 -0.69 -1.33 0.00 0.00 177.39 176.46 1wf8 s VAL 74 N -3.12 4.72 -1.13 4.08 1.01 -1.24 -3.81 120.40 120.90 1wf8 s VAL 74 Ca 0.51 -0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.40 1wf8 s VAL 74 Cb 0.43 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.72 1wf8 s VAL 74 CO 0.08 0.51 0.25 0.61 0.00 0.00 0.00 175.10 176.55 1wf8 n GLY 75 N 3.13 -0.17 3.21 4.51 0.00 -0.72 -4.89 105.19 110.24 1wf8 n GLY 75 Ca -0.17 -0.21 -0.19 0.00 0.00 0.00 0.00 46.02 45.44 1wf8 n GLY 75 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1wf8 s VAL 76 N -2.87 1.27 0.33 1.61 -7.23 -1.24 -4.69 120.40 107.59 1wf8 s VAL 76 Ca 0.12 -1.42 -0.28 0.00 -1.81 0.00 0.00 61.98 58.60 1wf8 s VAL 76 Cb -0.05 -1.24 -0.10 0.00 0.56 0.00 0.00 36.38 35.55 1wf8 s VAL 76 CO 0.15 -0.22 1.25 0.28 -0.31 0.00 0.00 175.10 176.26 1wf8 s THR 77 N -1.37 2.89 0.45 5.32 -1.32 -1.26 -4.59 115.64 115.76 1wf8 s THR 77 Ca 0.01 0.87 0.34 0.00 -1.21 0.00 0.00 61.69 61.70 1wf8 s THR 77 Cb -0.09 -3.55 0.52 0.00 -1.51 0.00 0.00 72.50 67.87 1wf8 s THR 77 CO 0.03 0.19 1.59 -0.61 -2.21 0.00 0.00 174.62 173.61 1wf8 h GLN 78 N 3.33 0.03 0.11 7.08 4.15 -1.94 0.92 115.11 128.79 1wf8 h GLN 78 Ca -0.49 -0.00 0.02 0.00 0.77 0.00 0.00 58.65 58.95 1wf8 h GLN 78 Cb 1.23 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.88 1wf8 h GLN 78 CO 0.65 0.02 -0.25 -0.97 -1.93 0.00 0.00 178.83 176.35 1wf8 h ASN 79 N 0.03 -0.71 -0.37 -0.69 -1.24 -1.99 0.13 115.58 110.75 1wf8 h ASN 79 Ca 0.87 0.08 0.07 0.00 0.71 0.00 0.00 56.30 58.03 1wf8 h ASN 79 Cb 2.85 0.27 -0.09 0.00 0.73 0.00 0.00 38.32 42.08 1wf8 h ASN 79 CO -0.40 -0.34 -0.35 0.15 -1.29 0.00 0.00 177.43 175.20 1wf8 h PHE 80 N -0.45 -0.98 -0.47 0.67 3.04 0.52 0.48 116.94 119.75 1wf8 h PHE 80 Ca 0.03 0.06 0.07 0.00 3.98 0.00 0.00 57.97 62.11 1wf8 h PHE 80 Cb 0.48 0.48 -0.06 0.00 2.56 0.00 0.00 35.95 39.42 1wf8 h PHE 80 CO -0.23 -0.40 0.13 0.00 -2.02 0.00 0.00 178.31 175.78 1wf8 h ALA 81 N 0.64 0.54 -0.62 2.41 0.00 -1.28 0.30 119.26 121.25 1wf8 h ALA 81 Ca 0.16 0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.22 1wf8 h ALA 81 Cb 0.55 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.37 1wf8 h ALA 81 CO -0.52 -0.27 0.30 0.00 0.00 0.00 0.00 179.25 178.75 1wf8 h ALA 82 N 1.34 0.82 -0.13 0.00 0.00 0.11 0.30 119.26 121.70 1wf8 h ALA 82 Ca 0.23 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1wf8 h ALA 82 Cb 0.27 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1wf8 h ALA 82 CO -0.27 -0.08 0.07 1.15 0.00 0.00 0.00 179.25 180.12 1wf8 h THR 83 N 0.54 1.10 0.45 0.00 2.02 0.15 -1.10 112.91 116.07 1wf8 h THR 83 Ca 0.29 -0.29 -0.01 0.00 0.77 0.00 0.00 66.41 67.18 1wf8 h THR 83 Cb 0.27 1.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 1wf8 h THR 83 CO -0.23 0.09 -0.40 0.58 0.37 0.00 0.00 175.52 175.94 1wf8 h VAL 84 N 0.10 0.19 -0.45 3.16 2.07 0.33 0.51 116.25 122.16 1wf8 h VAL 84 Ca 0.04 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.70 1wf8 h VAL 84 Cb 0.09 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 1wf8 h VAL 84 CO -0.01 0.00 0.52 -0.07 0.02 0.00 0.00 177.57 178.03 1wf8 h LEU 85 N -0.85 0.00 0.00 2.57 3.38 -0.36 1.65 115.31 121.70 1wf8 h LEU 85 Ca -0.04 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.84 1wf8 h LEU 85 Cb 0.74 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1wf8 h LEU 85 CO -0.03 0.00 -0.88 0.03 0.09 0.00 0.00 178.44 177.64 1wf8 h ARG 86 N 0.00 0.00 0.15 1.13 3.08 0.45 -3.31 114.38 115.88 1wf8 h ARG 86 Ca 0.21 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.98 1wf8 h ARG 86 Cb 1.25 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.31 1wf8 h ARG 86 CO -0.00 0.24 -1.32 -0.91 -1.07 0.00 0.00 179.97 176.91 1wf8 h ASN 87 N 0.00 0.48 -1.56 7.04 2.35 0.70 -3.47 115.58 121.13 1wf8 h ASN 87 Ca -0.06 -0.54 -0.49 0.00 -0.55 0.00 0.00 56.30 54.66 1wf8 h ASN 87 Cb 1.32 -0.16 0.25 0.00 0.05 0.00 0.00 38.32 39.78 1wf8 h ASN 87 CO 0.03 1.42 -2.13 0.35 -1.65 0.00 0.00 177.43 175.46 1wf8 n THR 88 N -3.55 0.00 -3.94 2.81 -2.24 0.83 -5.02 114.28 103.17 1wf8 n THR 88 Ca -0.11 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 1wf8 n THR 88 Cb 1.04 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 1wf8 n THR 88 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1wf8 n LYS 89 N 1.16 0.62 0.00 -0.78 4.76 -1.26 -5.04 118.16 117.62 1wf8 n LYS 89 Ca -0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 1wf8 n LYS 89 Cb 0.69 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.88 1wf8 n LYS 89 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wf8 n GLY 90 N 1.45 -0.52 3.75 0.72 0.00 -1.26 -4.00 105.19 105.33 1wf8 n GLY 90 Ca 0.00 0.11 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1wf8 n GLY 90 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1wf8 s ASN 91 N -0.59 7.51 -0.03 1.61 3.04 -1.26 0.27 114.94 125.50 1wf8 s ASN 91 Ca 0.00 1.80 -0.01 0.00 0.04 0.00 0.00 52.86 54.69 1wf8 s ASN 91 Cb 0.00 -2.57 0.03 0.00 -1.54 0.00 0.00 41.25 37.17 1wf8 s ASN 91 CO 0.00 0.08 0.06 -0.69 -3.04 0.00 0.00 177.10 173.51 1wf8 s VAL 92 N -0.67 -0.04 -0.24 -5.21 1.01 0.37 -4.90 120.40 110.71 1wf8 s VAL 92 Ca 0.42 0.16 -0.10 0.00 0.00 0.00 0.00 61.98 62.45 1wf8 s VAL 92 Cb -0.24 -0.11 -0.05 0.00 0.00 0.00 0.00 36.38 35.98 1wf8 s VAL 92 CO 0.29 0.06 0.16 -0.13 0.00 0.00 0.00 175.10 175.49 1wf8 s ARG 93 N 0.84 4.06 -0.20 2.72 3.00 -1.25 0.11 118.95 128.23 1wf8 s ARG 93 Ca -0.07 -0.28 -0.02 0.00 0.00 0.00 0.00 55.73 55.37 1wf8 s ARG 93 Cb -0.10 -3.54 0.00 0.00 0.00 0.00 0.00 34.95 31.32 1wf8 s ARG 93 CO -0.03 0.05 -0.10 -0.06 0.00 0.00 0.00 175.30 175.16 1wf8 s PHE 94 N 1.08 2.88 -0.82 -0.53 0.08 0.43 0.26 117.98 121.37 1wf8 s PHE 94 Ca 0.07 -1.14 -0.16 0.00 0.12 0.00 0.00 56.93 55.83 1wf8 s PHE 94 Cb -0.14 -2.02 0.18 0.00 -0.57 0.00 0.00 43.02 40.47 1wf8 s PHE 94 CO 0.05 -0.60 0.85 0.08 -0.10 0.00 0.00 175.22 175.50 1wf8 s VAL 95 N 1.30 5.26 0.51 -0.44 1.01 -0.11 0.17 120.40 128.09 1wf8 s VAL 95 Ca 0.04 -2.01 -0.16 0.00 0.00 0.00 0.00 61.98 59.85 1wf8 s VAL 95 Cb -0.14 -4.55 -0.08 0.00 0.00 0.00 0.00 36.38 31.61 1wf8 s VAL 95 CO -0.05 -1.17 0.97 -0.63 0.00 0.00 0.00 175.10 174.22 1wf8 s ILE 96 N 1.23 4.54 -0.27 2.22 -1.09 -0.87 -1.45 121.20 125.51 1wf8 s ILE 96 Ca 0.21 1.20 0.03 0.00 -2.23 0.00 0.00 60.65 59.86 1wf8 s ILE 96 Cb -0.11 -3.71 0.07 0.00 -1.58 0.00 0.00 42.46 37.12 1wf8 s ILE 96 CO -0.07 -0.66 -0.08 -0.83 -1.23 0.00 0.00 174.94 172.06 1wf8 s GLY 97 N -3.03 1.70 0.05 6.18 0.00 -0.96 -1.94 107.32 109.32 1wf8 s GLY 97 Ca 0.59 -1.89 0.02 0.00 0.00 0.00 0.00 44.72 43.43 1wf8 s GLY 97 CO 0.30 0.66 0.08 -1.60 0.00 0.00 0.00 173.10 172.55 1wf8 s ARG 98 N 1.07 2.96 -0.22 2.90 6.06 -0.43 -4.56 118.95 126.74 1wf8 s ARG 98 Ca -0.06 -0.62 -0.29 0.00 -2.50 0.00 0.00 55.73 52.26 1wf8 s ARG 98 Cb -0.20 -2.78 -0.03 0.00 0.06 0.00 0.00 34.95 32.00 1wf8 s ARG 98 CO -0.05 0.59 1.73 -1.21 -2.50 0.00 0.00 175.30 173.86 1wf8 s GLU 99 N -2.19 3.69 0.69 5.12 2.02 -1.26 0.13 118.70 126.90 1wf8 s GLU 99 Ca 0.27 1.74 -0.13 0.00 0.02 0.00 0.00 54.97 56.87 1wf8 s GLU 99 Cb -0.12 -4.10 0.01 0.00 0.10 0.00 0.00 34.13 30.02 1wf8 s GLU 99 CO 0.20 -1.43 1.09 0.15 0.02 0.00 0.00 175.26 175.28 1wf8 s LYS 100 N 4.97 2.72 1.07 1.61 1.02 -1.26 -4.89 119.74 124.99 1wf8 s LYS 100 Ca 0.77 1.22 -0.17 0.00 0.02 0.00 0.00 55.97 57.80 1wf8 s LYS 100 Cb -0.27 -1.95 0.24 0.00 -0.52 0.00 0.00 37.83 35.33 1wf8 s LYS 100 CO 0.32 -1.29 1.21 -1.25 -0.92 0.00 0.00 175.35 173.42 1wf8 s PRO 101 N -4.52 -0.22 -0.37 -1.68 0.04 -1.26 -5.05 135.00 121.95 1wf8 s PRO 101 Ca 0.63 -0.22 -0.03 0.00 0.04 0.00 0.00 61.00 61.42 1wf8 s PRO 101 Cb -0.18 -1.73 0.22 0.00 0.04 0.00 0.00 34.50 32.86 1wf8 s PRO 101 CO 0.48 -3.02 1.06 0.45 0.04 0.00 0.00 177.00 176.01 1wf8 n SER 102 N -4.24 -1.80 0.00 6.66 2.88 -1.26 -5.15 113.62 110.71 1wf8 n SER 102 Ca 0.14 -1.50 0.00 0.00 -1.33 0.00 0.00 58.87 56.18 1wf8 n SER 102 Cb 0.59 0.94 0.00 0.00 -0.75 0.00 0.00 64.21 64.99 1wf8 n SER 102 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wf8 n GLY 103 N 2.42 4.54 3.79 0.46 0.00 -1.26 -5.14 105.19 109.99 1wf8 n GLY 103 Ca 0.11 -1.28 -0.29 0.00 0.00 0.00 0.00 46.02 44.56 1wf8 n GLY 103 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wf8 s PRO 104 N -4.05 1.18 -0.03 1.61 0.04 -1.26 -4.75 135.00 127.74 1wf8 s PRO 104 Ca 0.00 0.31 -0.03 0.00 0.04 0.00 0.00 61.00 61.32 1wf8 s PRO 104 Cb 0.00 -1.84 0.01 0.00 0.04 0.00 0.00 34.50 32.71 1wf8 s PRO 104 CO 0.00 -2.17 0.06 0.45 0.04 0.00 0.00 177.00 175.38 1wf8 n SER 105 N -3.75 -6.09 -4.15 6.66 2.88 -1.26 -4.95 113.62 102.96 1wf8 n SER 105 Ca 0.07 1.60 -0.36 0.00 -1.33 0.00 0.00 58.87 58.84 1wf8 n SER 105 Cb 0.59 -4.52 -0.12 0.00 -0.75 0.00 0.00 64.21 59.41 1wf8 n SER 105 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wf8 s SER 106 N -0.50 5.16 0.00 -3.46 0.01 -1.26 -5.14 113.70 108.51 1wf8 s SER 106 Ca -0.06 -1.71 0.00 0.00 1.31 0.00 0.00 55.95 55.49 1wf8 s SER 106 Cb 0.00 -1.80 0.00 0.00 0.21 0.00 0.00 66.02 64.43 1wf8 s SER 106 CO 0.17 -0.44 0.00 0.61 0.41 0.00 0.00 173.24 174.00