#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 4.41 1.06 1.61 1.04 -1.26 -5.11 113.70 115.46 1wf8 s SER 2 Ca 0.00 -1.19 -0.19 0.00 0.48 0.00 0.00 55.95 55.05 1wf8 s SER 2 Cb 0.00 -0.19 0.03 0.00 0.10 0.00 0.00 66.02 65.97 1wf8 s SER 2 CO 0.00 -0.68 -0.18 -1.54 0.98 0.00 0.00 173.24 171.82 1wf8 n SER 3 N -1.33 -2.62 -0.07 7.02 3.41 -1.26 -5.03 113.62 113.75 1wf8 n SER 3 Ca -0.04 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 1wf8 n SER 3 Cb 0.65 -0.93 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 1wf8 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wf8 n GLY 4 N 2.21 1.71 1.76 5.00 0.00 -1.26 -5.05 105.19 109.56 1wf8 n GLY 4 Ca 0.01 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.35 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 -7.65 -3.49 1.61 7.64 -1.26 -5.09 113.62 105.37 1wf8 n SER 5 Ca 0.00 1.12 -0.11 0.00 1.01 0.00 0.00 58.87 60.89 1wf8 n SER 5 Cb 0.00 -4.29 -0.03 0.00 -1.01 0.00 0.00 64.21 58.88 1wf8 n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1wf8 s SER 6 N -0.46 -0.45 0.00 6.43 0.01 -1.26 -5.09 113.70 112.88 1wf8 s SER 6 Ca 0.00 0.12 -0.01 0.00 1.31 0.00 0.00 55.95 57.36 1wf8 s SER 6 Cb 0.00 0.45 -0.01 0.00 0.21 0.00 0.00 66.02 66.67 1wf8 s SER 6 CO 0.00 -0.68 1.02 1.23 0.41 0.00 0.00 173.24 175.22 1wf8 h GLY 7 N 2.16 -0.30 -4.00 3.44 0.00 -1.97 -3.42 103.07 98.98 1wf8 h GLY 7 Ca -0.25 0.13 -0.63 0.00 0.00 0.00 0.00 47.33 46.57 1wf8 h GLY 7 CO 0.34 -0.11 -0.68 1.08 0.00 0.00 0.00 176.54 177.17 1wf8 s LEU 8 N -4.39 3.29 -0.32 3.11 2.01 -1.26 -3.42 118.68 117.69 1wf8 s LEU 8 Ca -0.01 -0.33 -0.09 0.00 0.01 0.00 0.00 54.13 53.71 1wf8 s LEU 8 Cb 0.00 -2.00 0.00 0.00 0.01 0.00 0.00 46.19 44.20 1wf8 s LEU 8 CO 0.02 0.14 0.15 -1.83 1.01 0.00 0.00 176.35 175.84 1wf8 s GLU 9 N -2.58 3.21 -0.42 1.70 -1.05 0.57 -4.86 118.70 115.26 1wf8 s GLU 9 Ca 0.25 -0.81 -0.17 0.00 -0.15 0.00 0.00 54.97 54.10 1wf8 s GLU 9 Cb -0.10 -3.57 0.02 0.00 -0.44 0.00 0.00 34.13 30.04 1wf8 s GLU 9 CO 0.17 -0.47 0.44 -0.51 0.95 0.00 0.00 175.26 175.84 1wf8 s LEU 10 N 1.58 4.85 -0.06 1.83 1.43 -1.25 -1.04 118.68 126.02 1wf8 s LEU 10 Ca 0.04 -0.66 0.04 0.00 -1.03 0.00 0.00 54.13 52.52 1wf8 s LEU 10 Cb -0.17 -2.39 0.00 0.00 0.03 0.00 0.00 46.19 43.65 1wf8 s LEU 10 CO 0.06 -0.58 -0.18 0.72 0.23 0.00 0.00 176.35 176.60 1wf8 s PHE 11 N 2.14 1.84 -0.12 0.29 -0.71 -0.69 -4.95 117.98 115.78 1wf8 s PHE 11 Ca 0.12 -0.61 -0.29 0.00 -1.04 0.00 0.00 56.93 55.11 1wf8 s PHE 11 Cb -0.17 -1.26 -0.02 0.00 -1.21 0.00 0.00 43.02 40.36 1wf8 s PHE 11 CO 0.14 -0.24 1.25 -1.25 -1.34 0.00 0.00 175.22 173.78 1wf8 s PRO 12 N 0.22 4.27 -0.18 1.99 0.04 -1.26 -2.03 135.00 138.05 1wf8 s PRO 12 Ca -0.09 1.68 -0.03 0.00 0.04 0.00 0.00 61.00 62.60 1wf8 s PRO 12 Cb -0.14 -3.70 -0.02 0.00 0.04 0.00 0.00 34.50 30.69 1wf8 s PRO 12 CO 0.04 -0.63 -0.06 0.08 0.04 0.00 0.00 177.00 176.48 1wf8 s VAL 13 N 3.08 3.48 0.13 -0.36 1.01 0.48 -4.87 120.40 123.36 1wf8 s VAL 13 Ca 0.56 -0.48 -0.25 0.00 0.00 0.00 0.00 61.98 61.81 1wf8 s VAL 13 Cb -0.23 -2.54 -0.07 0.00 0.00 0.00 0.00 36.38 33.53 1wf8 s VAL 13 CO 0.17 0.46 0.77 -1.61 0.00 0.00 0.00 175.10 174.90 1wf8 s GLU 14 N 0.92 4.54 -0.06 2.72 2.02 -1.26 0.20 118.70 127.78 1wf8 s GLU 14 Ca -0.01 1.13 -0.05 0.00 0.02 0.00 0.00 54.97 56.06 1wf8 s GLU 14 Cb -0.15 -3.29 0.02 0.00 0.10 0.00 0.00 34.13 30.82 1wf8 s GLU 14 CO 0.01 0.50 0.16 -0.51 0.02 0.00 0.00 175.26 175.44 1wf8 s LEU 15 N -0.86 1.23 -0.17 1.80 1.43 0.12 -4.93 118.68 117.29 1wf8 s LEU 15 Ca 0.36 0.33 -0.06 0.00 -1.03 0.00 0.00 54.13 53.74 1wf8 s LEU 15 Cb -0.22 0.52 -0.03 0.00 0.03 0.00 0.00 46.19 46.49 1wf8 s LEU 15 CO 0.25 -0.08 0.01 -1.61 0.23 0.00 0.00 176.35 175.16 1wf8 s GLU 16 N 0.33 3.80 0.65 1.70 2.02 -1.26 0.19 118.70 126.13 1wf8 s GLU 16 Ca -0.02 -0.44 -0.18 0.00 0.02 0.00 0.00 54.97 54.35 1wf8 s GLU 16 Cb -0.03 -3.07 -0.01 0.00 0.10 0.00 0.00 34.13 31.12 1wf8 s GLU 16 CO -0.01 0.23 1.26 1.63 0.02 0.00 0.00 175.26 178.38 1wf8 n LYS 17 N 3.62 1.07 -4.59 1.61 5.02 0.51 -4.79 118.16 120.61 1wf8 n LYS 17 Ca -0.17 0.42 -0.28 0.00 -2.02 0.00 0.00 58.31 56.27 1wf8 n LYS 17 Cb 0.52 -2.50 -0.08 0.00 -0.02 0.00 0.00 35.03 32.95 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 -1.39 3.22 0.50 4.39 1.01 0.49 -4.91 116.67 119.99 1wf8 s ASP 18 Ca 0.82 -1.61 0.43 0.00 0.71 0.00 0.00 52.55 52.90 1wf8 s ASP 18 Cb -0.38 0.37 1.58 0.00 1.01 0.00 0.00 42.92 45.50 1wf8 s ASP 18 CO 0.41 -0.83 1.47 -1.84 0.21 0.00 0.00 175.17 174.59 1wf8 n GLU 19 N -0.99 -0.01 -2.55 8.23 0.28 -1.26 0.20 120.64 124.54 1wf8 n GLU 19 Ca -0.09 1.07 -0.29 0.00 -0.16 0.00 0.00 57.16 57.68 1wf8 n GLU 19 Cb 0.66 -2.36 -0.01 0.00 1.43 0.00 0.00 31.44 31.17 1wf8 n GLU 19 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1wf8 n ASP 20 N -4.03 5.05 0.00 -1.84 2.03 -1.26 -5.07 116.55 111.42 1wf8 n ASP 20 Ca 0.41 -3.72 0.00 0.00 0.52 0.00 0.00 54.79 52.00 1wf8 n ASP 20 Cb 1.79 -0.58 0.00 0.00 -0.72 0.00 0.00 41.12 41.62 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 -0.41 1.74 0.32 0.27 0.00 0.54 -3.26 105.19 104.39 1wf8 n GLY 21 Ca 0.39 -0.48 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.63 -0.35 0.99 3.38 -1.87 1.44 115.31 118.27 1wf8 h LEU 22 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1wf8 h LEU 22 Cb 0.00 0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1wf8 h LEU 22 CO 0.00 -0.29 0.00 0.61 0.09 0.00 0.00 178.44 178.85 1wf8 n GLY 23 N -0.67 0.61 3.19 0.83 0.00 -1.20 -1.08 105.19 106.86 1wf8 n GLY 23 Ca -0.11 -0.26 -0.10 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.54 0.11 0.09 -0.61 -4.36 -1.26 -2.94 121.20 110.69 1wf8 s ILE 24 Ca 0.00 -0.93 0.05 0.00 -0.26 0.00 0.00 60.65 59.52 1wf8 s ILE 24 Cb 0.00 -0.97 -0.04 0.00 1.25 0.00 0.00 42.46 42.70 1wf8 s ILE 24 CO 0.00 -0.51 -0.04 -0.44 0.24 0.00 0.00 174.94 174.19 1wf8 s SER 25 N -2.20 4.80 0.16 4.36 0.01 0.50 -4.93 113.70 116.40 1wf8 s SER 25 Ca -0.04 -0.24 0.07 0.00 1.31 0.00 0.00 55.95 57.05 1wf8 s SER 25 Cb -0.00 -1.07 -0.04 0.00 0.21 0.00 0.00 66.02 65.11 1wf8 s SER 25 CO -0.05 0.18 -0.15 0.27 0.41 0.00 0.00 173.24 173.91 1wf8 s ILE 26 N -1.26 1.54 0.00 1.44 -4.36 -1.26 -1.48 121.20 115.83 1wf8 s ILE 26 Ca 0.24 -1.93 0.02 0.00 -0.26 0.00 0.00 60.65 58.72 1wf8 s ILE 26 Cb -0.11 -1.78 -0.01 0.00 1.25 0.00 0.00 42.46 41.81 1wf8 s ILE 26 CO 0.16 -0.47 -0.08 -0.51 0.24 0.00 0.00 174.94 174.28 1wf8 s ILE 27 N -2.46 0.58 -0.29 8.37 2.07 0.51 -4.40 121.20 125.57 1wf8 s ILE 27 Ca 0.15 -0.46 -0.14 0.00 -1.41 0.00 0.00 60.65 58.79 1wf8 s ILE 27 Cb -0.03 -0.52 -0.03 0.00 0.13 0.00 0.00 42.46 42.01 1wf8 s ILE 27 CO 0.05 0.06 0.33 -0.83 -1.91 0.00 0.00 174.94 172.64 1wf8 s GLY 28 N -0.44 1.90 0.03 1.50 0.00 -1.26 -1.10 107.32 107.95 1wf8 s GLY 28 Ca 0.01 -1.00 0.02 0.00 0.00 0.00 0.00 44.72 43.75 1wf8 s GLY 28 CO -0.00 0.92 -0.07 1.06 0.00 0.00 0.00 173.10 175.00 1wf8 s MET 29 N 1.99 0.50 -0.50 2.90 -1.94 -0.81 -4.99 119.30 116.44 1wf8 s MET 29 Ca 0.12 -0.66 -0.22 0.00 -1.71 0.00 0.00 55.69 53.23 1wf8 s MET 29 Cb -0.16 -0.29 0.04 0.00 2.01 0.00 0.00 34.83 36.43 1wf8 s MET 29 CO 0.11 0.05 0.78 0.20 -0.01 0.00 0.00 175.02 176.15 1wf8 s GLY 30 N -1.33 1.59 0.25 -0.03 0.00 -1.26 0.24 107.32 106.77 1wf8 s GLY 30 Ca -0.08 -1.33 -0.18 0.00 0.00 0.00 0.00 44.72 43.12 1wf8 s GLY 30 CO 0.00 1.76 0.73 0.14 0.00 0.00 0.00 173.10 175.73 1wf8 s VAL 31 N 3.28 4.60 -1.30 1.40 1.01 0.42 -4.07 120.40 125.73 1wf8 s VAL 31 Ca 0.25 1.20 -0.01 0.00 0.00 0.00 0.00 61.98 63.42 1wf8 s VAL 31 Cb -0.15 -3.79 0.01 0.00 0.00 0.00 0.00 36.38 32.45 1wf8 s VAL 31 CO 0.18 0.11 0.02 0.61 0.00 0.00 0.00 175.10 176.01 1wf8 n GLY 32 N 0.44 -0.11 3.43 4.51 0.00 -1.26 -2.06 105.19 110.15 1wf8 n GLY 32 Ca -0.01 0.15 -0.44 0.00 0.00 0.00 0.00 46.02 45.72 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 -4.12 3.63 -0.31 4.61 0.00 -1.26 -3.48 121.76 120.83 1wf8 s ALA 33 Ca 0.02 -2.99 0.07 0.00 0.00 0.00 0.00 51.96 49.06 1wf8 s ALA 33 Cb -0.01 -3.97 0.46 0.00 0.00 0.00 0.00 23.12 19.59 1wf8 s ALA 33 CO 0.84 -2.82 1.28 -0.25 0.00 0.00 0.00 175.76 174.81 1wf8 n ASP 34 N 5.89 4.68 -3.33 0.00 9.92 -1.26 -4.92 116.55 127.52 1wf8 n ASP 34 Ca 0.25 -3.77 -0.16 0.00 -0.53 0.00 0.00 54.79 50.57 1wf8 n ASP 34 Cb 0.47 -0.43 0.08 0.00 -0.64 0.00 0.00 41.12 40.60 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 -0.80 -2.30 0.00 2.24 0.00 -1.26 -4.63 120.51 113.76 1wf8 n ALA 35 Ca 0.42 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1wf8 n ALA 35 Cb 0.91 -4.45 0.00 0.00 0.00 0.00 0.00 19.45 15.91 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 -1.20 0.10 2.08 0.00 0.00 -1.26 -4.95 105.19 99.96 1wf8 n GLY 36 Ca -0.16 0.11 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 1wf8 n GLY 36 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wf8 n LEU 37 N 0.00 6.68 -4.55 0.99 4.77 -1.25 -4.92 117.00 118.72 1wf8 n LEU 37 Ca 0.00 -3.59 -0.29 0.00 -0.03 0.00 0.00 56.01 52.10 1wf8 n LEU 37 Cb 0.00 -0.90 -0.04 0.00 -2.33 0.00 0.00 43.42 40.15 1wf8 n LEU 37 CO 0.00 1.18 1.69 -0.70 -1.33 0.00 0.00 177.39 178.23 1wf8 s GLU 38 N -2.88 2.05 -0.33 3.23 2.12 -1.23 -4.03 118.70 117.64 1wf8 s GLU 38 Ca 0.49 0.92 0.02 0.00 0.36 0.00 0.00 54.97 56.77 1wf8 s GLU 38 Cb 0.40 -4.65 0.10 0.00 0.26 0.00 0.00 34.13 30.23 1wf8 s GLU 38 CO 0.04 -3.56 0.06 0.15 -0.54 0.00 0.00 175.26 171.41 1wf8 s LYS 39 N 8.21 1.23 0.23 4.30 -0.14 -0.87 -4.88 119.74 127.81 1wf8 s LYS 39 Ca 0.90 -1.57 -0.32 0.00 -1.36 0.00 0.00 55.97 53.63 1wf8 s LYS 39 Cb -0.14 -2.77 -0.12 0.00 -1.68 0.00 0.00 37.83 33.12 1wf8 s LYS 39 CO 0.18 -0.94 1.70 -1.17 -0.76 0.00 0.00 175.35 174.36 1wf8 s LEU 40 N 1.16 4.36 -0.17 3.17 1.98 -1.26 -0.44 118.68 127.48 1wf8 s LEU 40 Ca 0.10 2.90 -0.02 0.00 -2.89 0.00 0.00 54.13 54.22 1wf8 s LEU 40 Cb -0.18 -3.61 -0.01 0.00 0.66 0.00 0.00 46.19 43.05 1wf8 s LEU 40 CO -0.14 -0.97 -0.10 -0.83 -1.89 0.00 0.00 176.35 172.42 1wf8 s GLY 41 N 1.04 1.56 -0.51 7.98 0.00 0.65 -0.77 107.32 117.26 1wf8 s GLY 41 Ca 0.73 -1.03 -0.22 0.00 0.00 0.00 0.00 44.72 44.20 1wf8 s GLY 41 CO 0.35 0.11 0.79 -0.42 0.00 0.00 0.00 173.10 173.93 1wf8 s ILE 42 N 0.89 4.62 0.31 0.90 -1.09 -1.25 -1.93 121.20 123.65 1wf8 s ILE 42 Ca -0.02 0.02 0.07 0.00 -2.23 0.00 0.00 60.65 58.49 1wf8 s ILE 42 Cb -0.15 -4.40 -0.03 0.00 -1.58 0.00 0.00 42.46 36.30 1wf8 s ILE 42 CO 0.00 -0.92 0.26 -0.36 -1.23 0.00 0.00 174.94 172.70 1wf8 s PHE 43 N 3.32 2.96 -0.53 3.97 0.40 -0.26 -0.90 117.98 126.94 1wf8 s PHE 43 Ca 0.24 -0.25 -0.23 0.00 -0.60 0.00 0.00 56.93 56.09 1wf8 s PHE 43 Cb -0.15 -1.68 0.04 0.00 0.51 0.00 0.00 43.02 41.75 1wf8 s PHE 43 CO 0.17 0.29 0.87 0.08 0.70 0.00 0.00 175.22 177.33 1wf8 s VAL 44 N -2.26 4.50 0.21 -0.44 1.01 0.97 0.19 120.40 124.58 1wf8 s VAL 44 Ca 0.38 0.20 -0.10 0.00 0.00 0.00 0.00 61.98 62.47 1wf8 s VAL 44 Cb -0.06 -4.47 0.16 0.00 0.00 0.00 0.00 36.38 32.01 1wf8 s VAL 44 CO 0.26 -1.01 1.88 0.50 0.00 0.00 0.00 175.10 176.73 1wf8 h LYS 45 N 9.22 0.99 -2.05 2.72 3.64 -1.47 0.93 116.57 130.55 1wf8 h LYS 45 Ca -0.26 -0.06 0.24 0.00 -1.27 0.00 0.00 60.65 59.30 1wf8 h LYS 45 Cb 1.08 -0.22 -0.09 0.00 -0.41 0.00 0.00 32.23 32.59 1wf8 h LYS 45 CO 1.05 0.65 0.64 -0.08 -2.27 0.00 0.00 179.45 179.45 1wf8 s THR 46 N -6.13 0.00 -0.15 1.00 -1.32 -1.24 -4.57 115.64 103.23 1wf8 s THR 46 Ca -0.13 -0.47 0.00 0.00 -1.21 0.00 0.00 61.69 59.88 1wf8 s THR 46 Cb 0.15 -2.19 0.03 0.00 -1.51 0.00 0.00 72.50 68.98 1wf8 s THR 46 CO 0.78 0.00 -0.13 -0.69 -2.21 0.00 0.00 174.62 172.37 1wf8 s VAL 47 N -2.74 1.55 0.21 5.08 1.01 -1.26 -0.37 120.40 123.87 1wf8 s VAL 47 Ca 0.15 -0.66 -0.32 0.00 0.00 0.00 0.00 61.98 61.16 1wf8 s VAL 47 Cb 0.01 -1.48 -0.15 0.00 0.00 0.00 0.00 36.38 34.76 1wf8 s VAL 47 CO 0.01 0.41 1.20 0.41 0.00 0.00 0.00 175.10 177.13 1wf8 n THR 48 N 4.77 1.08 -2.04 3.92 -1.04 -1.15 -4.80 114.28 115.02 1wf8 n THR 48 Ca -0.16 -0.27 -0.36 0.00 -2.04 0.00 0.00 64.05 61.22 1wf8 n THR 48 Cb 0.50 -1.04 -0.04 0.00 -1.82 0.00 0.00 70.33 67.93 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 -0.57 2.61 0.00 -2.82 2.12 -1.26 -1.24 118.70 117.53 1wf8 s GLU 49 Ca 0.70 0.38 0.00 0.00 0.36 0.00 0.00 54.97 56.40 1wf8 s GLU 49 Cb -0.77 -4.56 0.00 0.00 0.26 0.00 0.00 34.13 29.06 1wf8 s GLU 49 CO 0.53 -2.90 0.00 0.41 -0.54 0.00 0.00 175.26 172.76 1wf8 n GLY 50 N 5.99 1.19 3.83 -1.50 0.00 -1.26 -5.11 105.19 108.33 1wf8 n GLY 50 Ca 0.25 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 1wf8 n GLY 50 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wf8 s GLY 51 N -2.00 1.59 0.08 -0.02 0.00 -0.38 -4.70 107.32 101.90 1wf8 s GLY 51 Ca 0.00 -0.62 -0.33 0.00 0.00 0.00 0.00 44.72 43.77 1wf8 s GLY 51 CO 0.00 -0.06 1.61 0.00 0.00 0.00 0.00 173.10 174.65 1wf8 h ALA 52 N -1.40 -0.90 -0.66 3.20 0.00 -1.31 0.76 119.26 118.95 1wf8 h ALA 52 Ca -0.48 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 54.34 1wf8 h ALA 52 Cb 1.32 0.47 -0.04 0.00 0.00 0.00 0.00 17.79 19.54 1wf8 h ALA 52 CO 0.61 -1.03 0.44 0.00 0.00 0.00 0.00 179.25 179.27 1wf8 h ALA 53 N -0.53 1.86 0.68 0.00 0.00 -1.78 -0.16 119.26 119.33 1wf8 h ALA 53 Ca -0.06 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1wf8 h ALA 53 Cb 0.73 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.39 1wf8 h ALA 53 CO 0.05 0.01 -0.33 0.37 0.00 0.00 0.00 179.25 179.35 1wf8 h GLN 54 N 0.58 -0.88 -1.01 0.00 -0.00 -1.57 -2.54 115.11 109.69 1wf8 h GLN 54 Ca 0.30 0.06 0.24 0.00 -0.00 0.00 0.00 58.65 59.25 1wf8 h GLN 54 Cb 0.41 0.20 -0.12 0.00 0.00 0.00 0.00 27.48 27.97 1wf8 h GLN 54 CO -0.10 -0.59 0.60 0.00 0.00 0.00 0.00 178.83 178.75 1wf8 h ARG 55 N -1.22 0.58 0.07 1.69 3.08 0.91 0.72 114.38 120.22 1wf8 h ARG 55 Ca -0.09 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 59.94 1wf8 h ARG 55 Cb 0.70 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.58 1wf8 h ARG 55 CO 0.15 0.39 -0.24 0.22 -1.07 0.00 0.00 179.97 179.42 1wf8 h ASP 56 N 0.60 -0.70 0.00 7.04 1.82 -0.96 -3.46 116.42 120.76 1wf8 h ASP 56 Ca 0.63 0.09 0.00 0.00 -0.39 0.00 0.00 57.03 57.36 1wf8 h ASP 56 Cb 1.19 0.27 0.00 0.00 0.68 0.00 0.00 39.33 41.47 1wf8 h ASP 56 CO -0.45 -0.32 0.00 0.61 -1.61 0.00 0.00 179.24 177.47 1wf8 n GLY 57 N -1.36 1.05 0.02 -0.78 0.00 0.24 -4.93 105.19 99.43 1wf8 n GLY 57 Ca -0.06 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.96 1wf8 n GLY 57 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1wf8 h ARG 58 N 3.59 -0.01 -6.35 1.61 2.47 -1.84 -3.44 114.38 110.42 1wf8 h ARG 58 Ca 0.00 0.00 -0.54 0.00 -1.26 0.00 0.00 59.98 58.18 1wf8 h ARG 58 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.32 1wf8 h ARG 58 CO 0.00 -0.00 0.96 0.42 0.56 0.00 0.00 179.97 181.90 1wf8 s ILE 59 N -1.19 3.53 0.49 2.04 1.01 -1.26 -5.00 121.20 120.82 1wf8 s ILE 59 Ca -0.00 0.85 0.06 0.00 0.00 0.00 0.00 60.65 61.56 1wf8 s ILE 59 Cb 0.00 -3.54 0.01 0.00 0.01 0.00 0.00 42.46 38.93 1wf8 s ILE 59 CO 0.00 -0.03 0.34 -1.10 0.00 0.00 0.00 174.94 174.16 1wf8 s GLN 60 N 3.02 2.31 0.46 2.79 -1.52 -1.26 -4.70 119.66 120.75 1wf8 s GLN 60 Ca 0.69 -1.89 -0.21 0.00 -1.95 0.00 0.00 55.36 51.99 1wf8 s GLN 60 Cb -0.34 -2.12 -0.09 0.00 -0.22 0.00 0.00 33.01 30.25 1wf8 s GLN 60 CO 0.28 -0.42 1.02 0.08 -0.25 0.00 0.00 175.29 176.00 1wf8 s VAL 61 N -2.68 3.90 0.00 1.09 1.01 -1.26 -2.89 120.40 119.58 1wf8 s VAL 61 Ca 0.38 1.23 0.00 0.00 0.00 0.00 0.00 61.98 63.59 1wf8 s VAL 61 Cb -0.01 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.85 1wf8 s VAL 61 CO 0.22 -0.21 0.00 0.59 0.00 0.00 0.00 175.10 175.70 1wf8 n ASN 62 N -0.74 -0.05 -4.41 3.32 3.02 0.32 -4.94 115.26 111.78 1wf8 n ASN 62 Ca 0.08 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.35 1wf8 n ASN 62 Cb 0.52 -0.31 0.25 0.00 -0.61 0.00 0.00 39.78 39.64 1wf8 n ASN 62 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1wf8 s ASP 63 N -2.87 0.85 -0.19 6.41 1.11 -1.14 -4.50 116.67 116.34 1wf8 s ASP 63 Ca 0.00 1.38 -0.00 0.00 0.18 0.00 0.00 52.55 54.10 1wf8 s ASP 63 Cb 0.00 -2.13 0.05 0.00 1.07 0.00 0.00 42.92 41.91 1wf8 s ASP 63 CO 0.00 -4.26 -0.04 -1.58 1.18 0.00 0.00 175.17 170.46 1wf8 s GLN 64 N -4.57 1.43 -1.10 8.23 0.74 -1.26 -0.02 119.66 123.10 1wf8 s GLN 64 Ca 0.68 -0.68 -0.20 0.00 0.05 0.00 0.00 55.36 55.22 1wf8 s GLN 64 Cb -0.23 -2.24 0.08 0.00 1.10 0.00 0.00 33.01 31.72 1wf8 s GLN 64 CO 0.64 -0.51 1.48 0.42 -0.55 0.00 0.00 175.29 176.76 1wf8 s ILE 65 N 1.57 4.23 0.31 -2.34 1.01 -0.08 -2.03 121.20 123.88 1wf8 s ILE 65 Ca -0.02 -1.43 0.02 0.00 0.00 0.00 0.00 60.65 59.22 1wf8 s ILE 65 Cb -0.17 -5.04 0.14 0.00 0.01 0.00 0.00 42.46 37.41 1wf8 s ILE 65 CO -0.07 -1.86 1.84 0.58 0.00 0.00 0.00 174.94 175.43 1wf8 h VAL 66 N 6.05 1.21 -3.58 2.92 2.07 -1.50 -3.38 116.25 120.05 1wf8 h VAL 66 Ca 0.28 -0.85 -0.10 0.00 0.82 0.00 0.00 66.70 66.85 1wf8 h VAL 66 Cb 0.96 0.91 -0.16 0.00 -1.52 0.00 0.00 31.29 31.47 1wf8 h VAL 66 CO 1.36 0.30 -0.34 -0.70 0.02 0.00 0.00 177.57 178.21 1wf8 s GLU 67 N -4.99 0.78 -0.14 1.57 2.12 -1.16 -1.61 118.70 115.27 1wf8 s GLU 67 Ca -0.08 -0.71 -0.04 0.00 0.36 0.00 0.00 54.97 54.50 1wf8 s GLU 67 Cb 0.15 0.33 0.06 0.00 0.26 0.00 0.00 34.13 34.93 1wf8 s GLU 67 CO 0.78 -0.24 0.16 0.08 -0.54 0.00 0.00 175.26 175.50 1wf8 s VAL 68 N -3.04 -0.24 -1.57 3.70 1.01 0.50 -0.82 120.40 119.94 1wf8 s VAL 68 Ca -0.01 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.05 1wf8 s VAL 68 Cb 0.01 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.91 1wf8 s VAL 68 CO -0.06 -0.06 0.00 -0.67 0.00 0.00 0.00 175.10 174.30 1wf8 n ASP 69 N 5.31 -4.85 0.00 3.32 2.03 0.75 0.51 116.55 123.62 1wf8 n ASP 69 Ca -0.05 0.19 0.00 0.00 0.52 0.00 0.00 54.79 55.45 1wf8 n ASP 69 Cb 0.50 -4.16 0.00 0.00 -0.72 0.00 0.00 41.12 36.74 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 -0.73 3.16 3.77 0.27 0.00 -1.26 -4.93 105.19 105.47 1wf8 n GLY 70 Ca -0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.94 2.91 -0.08 -0.61 1.01 0.18 -5.00 121.20 116.68 1wf8 s ILE 71 Ca 0.00 0.89 -0.14 0.00 0.00 0.00 0.00 60.65 61.40 1wf8 s ILE 71 Cb 0.00 -3.56 -0.05 0.00 0.01 0.00 0.00 42.46 38.86 1wf8 s ILE 71 CO 0.00 0.19 0.36 -0.55 0.00 0.00 0.00 174.94 174.94 1wf8 s SER 72 N -0.66 6.63 -0.27 3.58 0.15 -1.26 0.19 113.70 122.06 1wf8 s SER 72 Ca 0.50 0.75 0.09 0.00 0.70 0.00 0.00 55.95 57.98 1wf8 s SER 72 Cb -0.37 -2.22 0.45 0.00 -1.71 0.00 0.00 66.02 62.17 1wf8 s SER 72 CO 0.49 0.20 1.29 0.18 1.20 0.00 0.00 173.24 176.60 1wf8 n LEU 73 N 2.73 3.91 -4.60 3.45 4.77 -0.63 -4.93 117.00 121.69 1wf8 n LEU 73 Ca -0.13 -4.18 -0.34 0.00 -0.03 0.00 0.00 56.01 51.33 1wf8 n LEU 73 Cb 0.52 -0.51 -0.11 0.00 -2.33 0.00 0.00 43.42 41.00 1wf8 n LEU 73 CO 0.39 1.62 -0.31 -0.69 -1.33 0.00 0.00 177.39 177.06 1wf8 s VAL 74 N -3.75 4.25 -1.39 4.08 1.01 -1.26 -3.83 120.40 119.51 1wf8 s VAL 74 Ca 0.45 -0.25 -0.04 0.00 0.00 0.00 0.00 61.98 62.14 1wf8 s VAL 74 Cb 0.40 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.94 1wf8 s VAL 74 CO -0.02 0.53 0.58 0.61 0.00 0.00 0.00 175.10 176.80 1wf8 n GLY 75 N 3.00 -0.40 3.12 4.51 0.00 0.05 -4.89 105.19 110.58 1wf8 n GLY 75 Ca -0.18 0.04 -0.20 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.13 1.06 0.33 1.61 -7.23 -1.24 -4.66 120.40 107.14 1wf8 s VAL 76 Ca 0.29 -0.86 -0.28 0.00 -1.81 0.00 0.00 61.98 59.31 1wf8 s VAL 76 Cb -0.13 -0.94 -0.10 0.00 0.56 0.00 0.00 36.38 35.77 1wf8 s VAL 76 CO 0.35 0.08 1.26 0.28 -0.31 0.00 0.00 175.10 176.76 1wf8 s THR 77 N -0.70 2.88 0.32 5.32 -1.32 -1.26 -4.64 115.64 116.25 1wf8 s THR 77 Ca 0.02 0.87 0.12 0.00 -1.21 0.00 0.00 61.69 61.49 1wf8 s THR 77 Cb -0.07 -3.54 0.35 0.00 -1.51 0.00 0.00 72.50 67.73 1wf8 s THR 77 CO 0.01 0.19 1.47 1.67 -2.21 0.00 0.00 174.62 175.75 1wf8 n GLN 78 N 0.75 -0.06 -0.27 7.08 7.27 -1.26 0.20 117.38 131.08 1wf8 n GLN 78 Ca 0.00 1.33 0.07 0.00 0.07 0.00 0.00 57.00 58.48 1wf8 n GLN 78 Cb 0.43 -2.27 0.19 0.00 2.41 0.00 0.00 30.24 31.00 1wf8 n GLN 78 CO 0.00 0.00 0.00 -0.97 0.07 0.00 0.00 177.06 176.16 1wf8 h ASN 79 N 0.00 -0.27 0.55 1.69 -1.24 -1.99 0.56 115.58 114.87 1wf8 h ASN 79 Ca 0.70 0.20 -0.02 0.00 0.71 0.00 0.00 56.30 57.89 1wf8 h ASN 79 Cb 1.71 0.33 -0.01 0.00 0.73 0.00 0.00 38.32 41.09 1wf8 h ASN 79 CO -0.78 -0.18 -0.34 0.15 -1.29 0.00 0.00 177.43 174.99 1wf8 h PHE 80 N 0.13 -0.89 -0.57 0.67 3.04 0.19 -0.40 116.94 119.10 1wf8 h PHE 80 Ca 0.45 -0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.49 1wf8 h PHE 80 Cb 0.83 0.32 -0.08 0.00 2.56 0.00 0.00 35.95 39.58 1wf8 h PHE 80 CO -0.39 -0.52 0.14 0.00 -2.02 0.00 0.00 178.31 175.52 1wf8 h ALA 81 N -0.46 0.68 -0.70 2.41 0.00 -0.92 0.33 119.26 120.61 1wf8 h ALA 81 Ca -0.07 0.11 0.11 0.00 0.00 0.00 0.00 54.91 55.07 1wf8 h ALA 81 Cb 0.69 0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.54 1wf8 h ALA 81 CO 0.07 -0.28 0.30 0.00 0.00 0.00 0.00 179.25 179.33 1wf8 h ALA 82 N 1.44 0.96 0.00 0.00 0.00 0.35 0.57 119.26 122.59 1wf8 h ALA 82 Ca 0.29 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.29 1wf8 h ALA 82 Cb 0.41 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1wf8 h ALA 82 CO -0.36 -0.15 -0.00 1.15 0.00 0.00 0.00 179.25 179.89 1wf8 h THR 83 N 0.49 1.21 0.37 0.00 2.02 0.87 -1.39 112.91 116.48 1wf8 h THR 83 Ca 0.36 -0.61 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 1wf8 h THR 83 Cb 0.47 1.62 -0.03 0.00 -1.74 0.00 0.00 68.15 68.48 1wf8 h THR 83 CO -0.33 0.16 -0.43 0.58 0.37 0.00 0.00 175.52 175.87 1wf8 h VAL 84 N -0.26 0.14 -0.60 3.16 2.07 0.49 0.69 116.25 121.94 1wf8 h VAL 84 Ca -0.00 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.69 1wf8 h VAL 84 Cb 0.26 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.15 1wf8 h VAL 84 CO 0.00 0.00 0.54 -0.07 0.02 0.00 0.00 177.57 178.06 1wf8 h LEU 85 N -0.83 0.00 0.00 2.57 3.38 0.10 1.44 115.31 121.96 1wf8 h LEU 85 Ca -0.03 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.84 1wf8 h LEU 85 Cb 0.75 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 1wf8 h LEU 85 CO -0.10 0.00 -0.74 0.03 0.09 0.00 0.00 178.44 177.72 1wf8 h ARG 86 N 0.00 0.00 0.03 1.13 3.08 0.37 -3.30 114.38 115.69 1wf8 h ARG 86 Ca 0.28 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 60.12 1wf8 h ARG 86 Cb 1.36 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.43 1wf8 h ARG 86 CO -0.00 0.34 -0.85 -0.91 -1.07 0.00 0.00 179.97 177.48 1wf8 h ASN 87 N 0.00 0.69 -1.90 7.04 2.35 0.77 -3.46 115.58 121.07 1wf8 h ASN 87 Ca -0.05 -0.78 -0.54 0.00 -0.55 0.00 0.00 56.30 54.38 1wf8 h ASN 87 Cb 1.36 -0.21 0.24 0.00 0.05 0.00 0.00 38.32 39.76 1wf8 h ASN 87 CO 0.05 1.39 -1.95 0.35 -1.65 0.00 0.00 177.43 175.62 1wf8 n THR 88 N -4.04 0.00 -3.94 2.81 -2.24 0.30 -5.01 114.28 102.16 1wf8 n THR 88 Ca -0.11 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 1wf8 n THR 88 Cb 0.80 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 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 2.27 0.61 0.00 -0.78 4.76 -1.26 -5.03 118.16 118.72 1wf8 n LYS 89 Ca -0.02 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.42 1wf8 n LYS 89 Cb 0.59 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.78 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 1.43 0.00 3.75 0.72 0.00 -1.26 -3.86 105.19 105.97 1wf8 n GLY 90 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 0.00 7.57 -0.05 1.61 3.84 -1.26 0.19 114.94 126.84 1wf8 s ASN 91 Ca 0.00 1.95 -0.02 0.00 0.21 0.00 0.00 52.86 54.99 1wf8 s ASN 91 Cb 0.00 -2.61 0.04 0.00 -0.55 0.00 0.00 41.25 38.13 1wf8 s ASN 91 CO 0.00 0.07 0.09 -0.69 -2.79 0.00 0.00 177.10 173.79 1wf8 s VAL 92 N -0.89 -0.15 -0.38 -5.21 1.01 0.49 -4.93 120.40 110.34 1wf8 s VAL 92 Ca 0.43 0.37 -0.18 0.00 0.00 0.00 0.00 61.98 62.60 1wf8 s VAL 92 Cb -0.26 -0.19 0.01 0.00 0.00 0.00 0.00 36.38 35.93 1wf8 s VAL 92 CO 0.32 0.16 0.51 -0.60 0.00 0.00 0.00 175.10 175.48 1wf8 s ARG 93 N 2.05 3.45 -0.28 2.72 3.52 -1.26 0.12 118.95 129.27 1wf8 s ARG 93 Ca 0.02 -0.34 -0.08 0.00 -0.13 0.00 0.00 55.73 55.20 1wf8 s ARG 93 Cb -0.12 -3.86 -0.01 0.00 -1.56 0.00 0.00 34.95 29.40 1wf8 s ARG 93 CO -0.04 -0.74 0.09 -0.06 -0.81 0.00 0.00 175.30 173.75 1wf8 s PHE 94 N 2.38 3.13 -0.81 5.12 0.08 0.53 0.27 117.98 128.67 1wf8 s PHE 94 Ca 0.17 -0.65 -0.17 0.00 0.12 0.00 0.00 56.93 56.41 1wf8 s PHE 94 Cb -0.16 -2.27 0.16 0.00 -0.57 0.00 0.00 43.02 40.18 1wf8 s PHE 94 CO 0.14 -0.46 0.88 0.08 -0.10 0.00 0.00 175.22 175.76 1wf8 s VAL 95 N 1.58 5.12 0.50 -0.44 1.01 -0.00 0.18 120.40 128.35 1wf8 s VAL 95 Ca 0.05 -1.82 -0.16 0.00 0.00 0.00 0.00 61.98 60.05 1wf8 s VAL 95 Cb -0.16 -4.58 -0.08 0.00 0.00 0.00 0.00 36.38 31.56 1wf8 s VAL 95 CO 0.04 -1.22 0.95 -0.63 0.00 0.00 0.00 175.10 174.24 1wf8 s ILE 96 N 1.62 4.57 -0.32 2.22 -1.09 -0.86 -1.39 121.20 125.95 1wf8 s ILE 96 Ca 0.21 1.13 0.03 0.00 -2.23 0.00 0.00 60.65 59.79 1wf8 s ILE 96 Cb -0.12 -3.72 0.09 0.00 -1.58 0.00 0.00 42.46 37.13 1wf8 s ILE 96 CO -0.06 -0.67 0.02 -0.83 -1.23 0.00 0.00 174.94 172.18 1wf8 s GLY 97 N -3.09 1.87 -0.10 6.18 0.00 -0.86 -1.70 107.32 109.62 1wf8 s GLY 97 Ca 0.58 -2.32 -0.01 0.00 0.00 0.00 0.00 44.72 42.97 1wf8 s GLY 97 CO 0.31 0.85 -0.06 -1.60 0.00 0.00 0.00 173.10 172.60 1wf8 s ARG 98 N 0.98 3.05 0.09 2.90 3.52 -0.21 -4.55 118.95 124.73 1wf8 s ARG 98 Ca 0.05 -0.55 -0.30 0.00 -0.13 0.00 0.00 55.73 54.81 1wf8 s ARG 98 Cb -0.20 -2.69 -0.05 0.00 -1.56 0.00 0.00 34.95 30.46 1wf8 s ARG 98 CO -0.07 0.52 0.95 -1.83 -0.81 0.00 0.00 175.30 174.06 1wf8 s GLU 99 N -0.41 4.66 0.17 5.12 -1.05 -1.26 0.21 118.70 126.14 1wf8 s GLU 99 Ca 0.06 1.41 0.07 0.00 -0.15 0.00 0.00 54.97 56.36 1wf8 s GLU 99 Cb -0.12 -3.39 -0.04 0.00 -0.44 0.00 0.00 34.13 30.13 1wf8 s GLU 99 CO 0.02 0.17 -0.14 -1.59 0.95 0.00 0.00 175.26 174.68 1wf8 s LYS 100 N 0.18 1.19 -0.04 -4.83 -2.85 -1.22 -4.92 119.74 107.26 1wf8 s LYS 100 Ca 0.47 -1.46 -0.30 0.00 -1.00 0.00 0.00 55.97 53.68 1wf8 s LYS 100 Cb -0.23 -0.97 -0.04 0.00 -2.06 0.00 0.00 37.83 34.54 1wf8 s LYS 100 CO 0.29 0.16 1.21 -1.25 0.10 0.00 0.00 175.35 175.86 1wf8 s PRO 101 N -3.39 4.36 0.33 1.78 0.04 -1.26 -4.88 135.00 131.98 1wf8 s PRO 101 Ca 0.18 1.70 0.12 0.00 0.04 0.00 0.00 61.00 63.04 1wf8 s PRO 101 Cb -0.01 -3.53 1.04 0.00 0.04 0.00 0.00 34.50 32.04 1wf8 s PRO 101 CO 0.04 -0.42 1.63 0.66 0.04 0.00 0.00 177.00 178.95 1wf8 h SER 102 N 7.39 0.28 -3.45 6.66 4.64 -1.95 -3.41 113.55 123.70 1wf8 h SER 102 Ca -0.35 0.22 -0.44 0.00 -0.47 0.00 0.00 61.79 60.75 1wf8 h SER 102 Cb 1.17 0.22 -0.14 0.00 -0.31 0.00 0.00 62.40 63.34 1wf8 h SER 102 CO 0.87 -0.23 -0.65 -0.83 -0.87 0.00 0.00 176.83 175.12 1wf8 s GLY 103 N -4.22 1.76 1.00 -0.77 0.00 -1.26 -4.79 107.32 99.04 1wf8 s GLY 103 Ca -0.10 -1.88 -0.17 0.00 0.00 0.00 0.00 44.72 42.57 1wf8 s GLY 103 CO 0.78 -1.75 1.10 -1.55 0.00 0.00 0.00 173.10 171.68 1wf8 n PRO 104 N -0.53 -2.05 -3.65 2.90 -0.04 -1.26 -5.10 135.00 125.26 1wf8 n PRO 104 Ca -0.04 -1.73 -0.01 0.00 -0.04 0.00 0.00 63.50 61.68 1wf8 n PRO 104 Cb 0.64 -1.36 -0.06 0.00 -0.04 0.00 0.00 33.50 32.68 1wf8 n PRO 104 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wf8 s SER 105 N -4.81 -0.25 -0.18 3.54 0.15 -1.26 -5.14 113.70 105.76 1wf8 s SER 105 Ca 0.66 0.40 -0.09 0.00 0.70 0.00 0.00 55.95 57.63 1wf8 s SER 105 Cb -0.04 0.99 -0.05 0.00 -1.71 0.00 0.00 66.02 65.22 1wf8 s SER 105 CO 0.49 -0.06 0.10 -0.44 1.20 0.00 0.00 173.24 174.53 1wf8 s SER 106 N 1.00 5.99 0.00 5.45 0.01 -1.26 -5.26 113.70 119.64 1wf8 s SER 106 Ca -0.06 0.19 0.00 0.00 1.31 0.00 0.00 55.95 57.39 1wf8 s SER 106 Cb -0.03 -2.03 0.00 0.00 0.21 0.00 0.00 66.02 64.17 1wf8 s SER 106 CO -0.12 0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.34