#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1we9 s SER 2 N 0.00 5.73 -0.93 1.61 0.15 -1.26 -4.94 113.70 114.06 1we9 s SER 2 Ca 0.00 0.12 -0.19 0.00 0.70 0.00 0.00 55.95 56.58 1we9 s SER 2 Cb 0.00 -2.54 0.13 0.00 -1.71 0.00 0.00 66.02 61.90 1we9 s SER 2 CO 0.00 -2.06 1.13 -0.44 1.20 0.00 0.00 173.24 173.07 1we9 s SER 3 N 6.00 6.64 0.47 5.45 0.01 -1.26 -5.00 113.70 126.01 1we9 s SER 3 Ca 0.55 -2.07 0.05 0.00 1.31 0.00 0.00 55.95 55.79 1we9 s SER 3 Cb -0.11 -2.40 -0.02 0.00 0.21 0.00 0.00 66.02 63.70 1we9 s SER 3 CO 0.20 -1.05 0.16 -0.83 0.41 0.00 0.00 173.24 172.13 1we9 s GLY 4 N 3.61 2.56 0.87 3.44 0.00 -1.26 -5.11 107.32 111.43 1we9 s GLY 4 Ca 0.33 -1.47 -0.14 0.00 0.00 0.00 0.00 44.72 43.44 1we9 s GLY 4 CO -0.09 -2.02 0.39 -1.26 0.00 0.00 0.00 173.10 170.11 1we9 n SER 5 N -1.33 -1.98 -3.15 1.64 2.88 -1.26 -5.02 113.62 105.40 1we9 n SER 5 Ca -0.07 0.42 0.05 0.00 -1.33 0.00 0.00 58.87 57.94 1we9 n SER 5 Cb 0.65 -1.19 -0.01 0.00 -0.75 0.00 0.00 64.21 62.91 1we9 n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1we9 s SER 6 N -1.77 -0.79 -0.31 -3.46 0.15 -1.26 -5.14 113.70 101.12 1we9 s SER 6 Ca 0.59 0.49 -0.19 0.00 0.70 0.00 0.00 55.95 57.54 1we9 s SER 6 Cb -0.26 1.66 -0.01 0.00 -1.71 0.00 0.00 66.02 65.70 1we9 s SER 6 CO 0.65 -0.15 0.56 -0.83 1.20 0.00 0.00 173.24 174.67 1we9 s GLY 7 N 2.92 1.81 -0.10 9.45 0.00 -1.26 -5.04 107.32 115.10 1we9 s GLY 7 Ca 0.07 -0.78 -0.01 0.00 0.00 0.00 0.00 44.72 44.00 1we9 s GLY 7 CO -0.15 1.33 -0.01 1.20 0.00 0.00 0.00 173.10 175.47 1we9 s GLN 8 N 2.46 0.80 0.11 2.90 -0.21 -1.26 -4.83 119.66 119.62 1we9 s GLN 8 Ca 0.22 -0.06 -0.31 0.00 0.02 0.00 0.00 55.36 55.23 1we9 s GLN 8 Cb -0.15 -1.29 -0.11 0.00 1.00 0.00 0.00 33.01 32.47 1we9 s GLN 8 CO 0.12 -0.35 1.86 0.00 -2.12 0.00 0.00 175.29 174.79 1we9 h GLY 10 N 8.79 1.13 0.38 0.00 0.00 -1.97 1.48 103.07 112.87 1we9 h GLY 10 Ca -0.47 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 46.48 1we9 h GLY 10 CO 0.95 0.32 -0.50 0.00 0.00 0.00 0.00 176.54 177.31 1we9 h ALA 11 N 1.33 -1.06 0.00 3.60 0.00 -1.95 -3.40 119.26 117.78 1we9 h ALA 11 Ca 0.31 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1we9 h ALA 11 Cb 0.01 0.77 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1we9 h ALA 11 CO -0.11 -1.15 -0.93 0.00 0.00 0.00 0.00 179.25 177.07 1we9 n GLY 13 N 3.12 0.60 3.91 0.00 0.00 0.51 -4.86 105.19 108.46 1we9 n GLY 13 Ca 0.00 -0.46 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 1we9 n GLY 13 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1we9 s GLU 14 N -3.59 0.63 0.77 1.61 0.41 -1.26 -4.60 118.70 112.67 1we9 s GLU 14 Ca 0.00 -0.36 -0.11 0.00 -0.41 0.00 0.00 54.97 54.09 1we9 s GLU 14 Cb 0.00 -1.84 0.05 0.00 -1.78 0.00 0.00 34.13 30.56 1we9 s GLU 14 CO 0.00 -2.43 1.08 -1.12 -0.49 0.00 0.00 175.26 172.31 1we9 s SER 15 N -4.82 4.76 0.06 -0.19 0.01 -1.26 -4.52 113.70 107.74 1we9 s SER 15 Ca 0.73 1.43 -0.31 0.00 1.31 0.00 0.00 55.95 59.11 1we9 s SER 15 Cb -0.05 -2.21 -0.07 0.00 0.21 0.00 0.00 66.02 63.91 1we9 s SER 15 CO 0.53 -1.81 1.46 -0.47 0.41 0.00 0.00 173.24 173.35 1we9 s TYR 16 N -3.11 2.91 -0.00 2.43 5.04 -1.26 -5.01 117.35 118.34 1we9 s TYR 16 Ca 0.60 0.75 0.04 0.00 -2.44 0.00 0.00 57.07 56.02 1we9 s TYR 16 Cb -0.14 -3.74 -0.01 0.00 0.35 0.00 0.00 41.96 38.41 1we9 s TYR 16 CO 0.55 -2.76 -0.13 0.00 -1.34 0.00 0.00 175.55 171.86 1we9 s ALA 17 N 1.95 1.11 -0.01 3.97 0.00 -1.26 -5.05 121.76 122.47 1we9 s ALA 17 Ca 0.66 -0.61 -0.19 0.00 0.00 0.00 0.00 51.96 51.83 1we9 s ALA 17 Cb -0.35 -0.26 -0.31 0.00 0.00 0.00 0.00 23.12 22.19 1we9 s ALA 17 CO 0.29 0.26 0.97 0.00 0.00 0.00 0.00 175.76 177.29 1we9 h ALA 18 N 5.69 -0.08 -0.03 0.00 0.00 -2.05 -3.32 119.26 119.47 1we9 h ALA 18 Ca -0.34 -0.73 -0.14 0.00 0.00 0.00 0.00 54.91 53.70 1we9 h ALA 18 Cb 1.17 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 19.02 1we9 h ALA 18 CO 0.48 0.49 -0.21 -3.47 0.00 0.00 0.00 179.25 176.53 1we9 n ASP 19 N -4.00 5.35 -3.78 0.00 -0.08 -1.26 -4.77 116.55 108.00 1we9 n ASP 19 Ca -0.14 -2.50 -0.13 0.00 -1.51 0.00 0.00 54.79 50.52 1we9 n ASP 19 Cb 0.89 -1.31 -0.12 0.00 2.34 0.00 0.00 41.12 42.92 1we9 n ASP 19 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1we9 s GLU 20 N 0.51 0.23 -0.18 -0.67 0.41 -1.25 -5.15 118.70 112.61 1we9 s GLU 20 Ca 0.44 0.34 -0.11 0.00 -0.41 0.00 0.00 54.97 55.23 1we9 s GLU 20 Cb 0.21 0.06 -0.05 0.00 -1.78 0.00 0.00 34.13 32.58 1we9 s GLU 20 CO -0.01 -0.06 0.18 0.12 -0.49 0.00 0.00 175.26 175.00 1we9 s PHE 21 N 0.38 3.45 0.14 1.61 5.36 -1.26 -4.98 117.98 122.67 1we9 s PHE 21 Ca -0.02 0.44 0.05 0.00 -0.96 0.00 0.00 56.93 56.44 1we9 s PHE 21 Cb -0.04 -2.19 -0.04 0.00 -0.34 0.00 0.00 43.02 40.41 1we9 s PHE 21 CO -0.02 0.33 0.07 -1.58 -1.46 0.00 0.00 175.22 172.56 1we9 s TRP 22 N 0.22 3.06 0.23 10.12 0.52 -1.26 -0.14 118.94 131.69 1we9 s TRP 22 Ca 0.11 -0.03 0.06 0.00 0.02 0.00 0.00 56.10 56.26 1we9 s TRP 22 Cb -0.12 -1.51 -0.03 0.00 -1.15 0.00 0.00 33.47 30.66 1we9 s TRP 22 CO 0.01 0.51 0.27 0.96 0.02 0.00 0.00 176.95 178.71 1we9 s ILE 23 N -1.59 4.88 -0.28 2.03 -5.25 -1.10 -4.74 121.20 115.14 1we9 s ILE 23 Ca 0.29 -1.13 -0.03 0.00 -0.99 0.00 0.00 60.65 58.79 1we9 s ILE 23 Cb -0.11 -3.62 0.03 0.00 2.95 0.00 0.00 42.46 41.72 1we9 s ILE 23 CO 0.21 -0.29 -0.00 0.00 -1.79 0.00 0.00 174.94 173.06 1we9 n ASP 26 N -2.28 1.95 0.00 0.00 5.75 -1.25 -3.57 116.55 117.15 1we9 n ASP 26 Ca 0.01 0.32 0.00 0.00 -0.01 0.00 0.00 54.79 55.11 1we9 n ASP 26 Cb 0.56 -0.81 0.00 0.00 -1.03 0.00 0.00 41.12 39.84 1we9 n ASP 26 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1we9 n LEU 27 N -4.20 0.18 -0.08 -2.12 4.77 -1.26 -4.18 117.00 110.11 1we9 n LEU 27 Ca -0.51 0.74 -0.13 0.00 -0.03 0.00 0.00 56.01 56.08 1we9 n LEU 27 Cb 0.87 -0.42 -0.05 0.00 -2.33 0.00 0.00 43.42 41.49 1we9 n LEU 27 CO 0.07 -0.42 0.62 0.00 -1.33 0.00 0.00 177.39 176.33 1we9 n GLU 29 N -4.42 -7.18 -2.09 0.00 -0.58 -1.23 -5.01 120.64 100.13 1we9 n GLU 29 Ca -0.04 0.82 -0.10 0.00 -0.42 0.00 0.00 57.16 57.41 1we9 n GLU 29 Cb 0.39 -5.79 0.03 0.00 -0.57 0.00 0.00 31.44 25.50 1we9 n GLU 29 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 1we9 n MET 30 N -4.51 0.83 -3.43 3.49 2.81 -1.26 -4.85 117.12 110.19 1we9 n MET 30 Ca -0.13 -1.62 -0.43 0.00 -1.81 0.00 0.00 57.70 53.71 1we9 n MET 30 Cb 0.61 -0.09 -0.03 0.00 -0.71 0.00 0.00 33.22 33.00 1we9 n MET 30 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 1we9 s TRP 31 N -0.91 3.95 0.73 2.03 0.51 -1.26 -4.36 118.94 119.63 1we9 s TRP 31 Ca 0.30 -2.54 0.00 0.00 -2.12 0.00 0.00 56.10 51.74 1we9 s TRP 31 Cb -0.02 -3.65 0.14 0.00 -0.81 0.00 0.00 33.47 29.12 1we9 s TRP 31 CO 0.19 -0.91 1.01 -0.06 -0.51 0.00 0.00 176.95 176.66 1we9 s PHE 32 N -0.70 1.31 -0.10 -1.98 0.08 -1.25 -3.84 117.98 111.49 1we9 s PHE 32 Ca 0.25 -0.39 -0.01 0.00 0.12 0.00 0.00 56.93 56.90 1we9 s PHE 32 Cb -0.11 -2.93 -0.03 0.00 -0.57 0.00 0.00 43.02 39.38 1we9 s PHE 32 CO -0.09 -1.80 -0.07 -1.01 -0.10 0.00 0.00 175.22 172.16 1we9 s HIS 33 N -3.15 2.95 0.20 0.36 3.76 -1.26 -2.72 115.29 115.44 1we9 s HIS 33 Ca 0.67 -0.16 -0.14 0.00 -0.15 0.00 0.00 55.06 55.29 1we9 s HIS 33 Cb -0.04 -1.81 0.22 0.00 1.11 0.00 0.00 32.58 32.06 1we9 s HIS 33 CO 0.45 0.15 1.64 0.78 -0.85 0.00 0.00 174.74 176.90 1we9 h GLY 34 N 5.90 0.46 2.00 -2.22 0.00 -0.77 0.44 103.07 108.87 1we9 h GLY 34 Ca -0.40 0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.08 1we9 h GLY 34 CO 0.56 -0.22 -0.12 0.07 0.00 0.00 0.00 176.54 176.83 1we9 h LYS 35 N 0.02 0.00 -0.02 4.80 2.10 -1.79 0.41 116.57 122.09 1we9 h LYS 35 Ca 0.29 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.81 1we9 h LYS 35 Cb 0.44 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.78 1we9 h LYS 35 CO -0.59 0.12 -0.50 0.00 -2.00 0.00 0.00 179.45 176.47 1we9 n VAL 37 N -4.29 0.21 -3.48 0.00 0.24 0.07 -4.86 118.33 106.22 1we9 n VAL 37 Ca -0.10 -0.13 -0.18 0.00 -2.04 0.00 0.00 64.34 61.88 1we9 n VAL 37 Cb 0.62 -0.23 0.07 0.00 -1.47 0.00 0.00 33.84 32.83 1we9 n VAL 37 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1we9 n LYS 38 N -0.08 -5.29 -3.78 7.34 4.76 -0.98 -4.74 118.16 115.39 1we9 n LYS 38 Ca 0.03 0.78 -0.14 0.00 -2.87 0.00 0.00 58.31 56.11 1we9 n LYS 38 Cb 0.22 -5.62 -0.14 0.00 -1.84 0.00 0.00 35.03 27.65 1we9 n LYS 38 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1we9 s ILE 39 N -3.45 -0.04 0.37 -0.18 1.01 0.14 -5.01 121.20 114.04 1we9 s ILE 39 Ca 0.09 0.14 -0.05 0.00 0.00 0.00 0.00 60.65 60.83 1we9 s ILE 39 Cb -0.02 -0.16 -0.05 0.00 0.01 0.00 0.00 42.46 42.24 1we9 s ILE 39 CO 0.76 0.06 0.66 0.42 0.00 0.00 0.00 174.94 176.83 1we9 s THR 40 N 0.81 4.96 -0.65 2.92 -4.23 -1.26 -3.27 115.64 114.93 1we9 s THR 40 Ca -0.06 0.11 0.20 0.00 -1.18 0.00 0.00 61.69 60.76 1we9 s THR 40 Cb -0.09 -3.79 0.21 0.00 1.34 0.00 0.00 72.50 70.17 1we9 s THR 40 CO -0.03 -0.54 1.63 -0.81 -0.54 0.00 0.00 174.62 174.32 1we9 n PRO 41 N -1.51 0.13 -0.02 3.99 -0.04 -1.26 -0.61 135.00 135.67 1we9 n PRO 41 Ca -0.01 0.37 -0.09 0.00 -0.04 0.00 0.00 63.50 63.73 1we9 n PRO 41 Cb 0.55 -1.75 -0.14 0.00 -0.04 0.00 0.00 33.50 32.11 1we9 n PRO 41 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1we9 n ALA 42 N -1.68 1.47 -0.03 0.55 0.00 -1.26 -3.80 120.51 115.76 1we9 n ALA 42 Ca 0.02 -0.78 -0.14 0.00 0.00 0.00 0.00 53.44 52.55 1we9 n ALA 42 Cb 0.21 -0.82 -0.14 0.00 0.00 0.00 0.00 19.45 18.70 1we9 n ALA 42 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1we9 n ARG 43 N -3.05 0.68 -0.26 0.00 0.63 -1.05 -4.24 116.66 109.37 1we9 n ARG 43 Ca -0.18 0.24 -0.05 0.00 -0.92 0.00 0.00 57.85 56.94 1we9 n ARG 43 Cb 1.06 -1.72 0.06 0.00 0.45 0.00 0.00 32.46 32.31 1we9 n ARG 43 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1we9 h ALA 44 N 0.61 0.91 -0.14 5.13 0.00 -1.05 -1.74 119.26 122.98 1we9 h ALA 44 Ca -0.38 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.51 1we9 h ALA 44 Cb 2.04 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 1we9 h ALA 44 CO 0.07 0.35 0.71 1.05 0.00 0.00 0.00 179.25 181.43 1we9 h GLU 45 N 0.98 0.00 0.03 0.00 4.11 -1.74 0.89 114.58 118.85 1we9 h GLU 45 Ca 0.26 0.00 -0.35 0.00 0.07 0.00 0.00 59.36 59.34 1we9 h GLU 45 Cb -0.08 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.11 1we9 h GLU 45 CO -0.05 0.00 -2.12 0.72 0.07 0.00 0.00 179.01 177.63 1we9 n HIS 46 N -2.83 0.56 -2.14 2.06 8.25 -0.67 -4.89 115.22 115.56 1we9 n HIS 46 Ca 0.02 0.17 -0.42 0.00 -0.26 0.00 0.00 57.72 57.22 1we9 n HIS 46 Cb 0.78 -1.09 -0.03 0.00 1.12 0.00 0.00 29.99 30.77 1we9 n HIS 46 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1we9 s ILE 47 N -2.54 3.67 -0.05 1.59 1.01 0.31 -4.94 121.20 120.26 1we9 s ILE 47 Ca -0.16 0.95 -0.01 0.00 0.00 0.00 0.00 60.65 61.43 1we9 s ILE 47 Cb 0.07 -3.61 -0.00 0.00 0.01 0.00 0.00 42.46 38.93 1we9 s ILE 47 CO 0.77 -0.05 -0.02 0.11 0.00 0.00 0.00 174.94 175.76 1we9 h LYS 48 N 8.59 0.00 -4.05 2.79 1.57 -1.90 -3.46 116.57 120.11 1we9 h LYS 48 Ca -0.37 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 57.80 1we9 h LYS 48 Cb 1.17 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 33.08 1we9 h LYS 48 CO 0.94 0.00 -0.75 -0.65 -0.57 0.00 0.00 179.45 178.41 1we9 s GLN 49 N -1.29 1.12 0.08 3.15 1.11 -1.26 -4.97 119.66 117.60 1we9 s GLN 49 Ca -0.01 -1.27 0.04 0.00 0.01 0.00 0.00 55.36 54.13 1we9 s GLN 49 Cb 0.00 -2.48 -0.04 0.00 -1.01 0.00 0.00 33.01 29.49 1we9 s GLN 49 CO 0.02 -0.88 0.02 -0.47 0.01 0.00 0.00 175.29 173.99 1we9 s TYR 50 N 1.37 3.05 -0.43 0.91 5.04 -1.25 -5.01 117.35 121.03 1we9 s TYR 50 Ca 0.07 0.01 -0.13 0.00 -2.44 0.00 0.00 57.07 54.58 1we9 s TYR 50 Cb -0.18 -1.57 0.06 0.00 0.35 0.00 0.00 41.96 40.62 1we9 s TYR 50 CO -0.16 0.49 0.32 0.21 -1.34 0.00 0.00 175.55 175.07 1we9 s LYS 51 N -2.28 2.84 0.67 4.97 2.20 -1.26 -3.83 119.74 123.06 1we9 s LYS 51 Ca 0.26 -1.31 -0.14 0.00 -0.36 0.00 0.00 55.97 54.42 1we9 s LYS 51 Cb -0.12 -3.95 -0.12 0.00 -1.51 0.00 0.00 37.83 32.13 1we9 s LYS 51 CO 0.19 -0.93 -0.46 0.00 -0.36 0.00 0.00 175.35 173.79 1we9 n PRO 53 N 1.76 0.15 0.27 0.00 -0.04 -1.26 -1.61 135.00 134.27 1we9 n PRO 53 Ca 0.01 0.39 -0.13 0.00 -0.04 0.00 0.00 63.50 63.73 1we9 n PRO 53 Cb 0.43 -1.79 -0.07 0.00 -0.04 0.00 0.00 33.50 32.03 1we9 n PRO 53 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1we9 h SER 54 N 0.00 -0.62 0.00 3.54 0.87 -1.97 -3.24 113.55 112.14 1we9 h SER 54 Ca 0.00 -0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.47 1we9 h SER 54 Cb 0.33 0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.44 1we9 h SER 54 CO 0.00 -0.23 -0.38 0.00 -0.53 0.00 0.00 176.83 175.69 1we9 n SER 56 N -4.60 0.06 -1.98 0.00 3.41 -0.63 0.87 113.62 110.74 1we9 n SER 56 Ca -0.13 0.86 -0.15 0.00 -0.26 0.00 0.00 58.87 59.19 1we9 n SER 56 Cb 0.40 -0.43 -0.04 0.00 -0.26 0.00 0.00 64.21 63.88 1we9 n SER 56 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1we9 n ASN 57 N -3.72 5.97 -4.67 4.04 2.85 -1.22 -4.88 115.26 113.63 1we9 n ASN 57 Ca 0.33 -2.84 -0.24 0.00 -0.11 0.00 0.00 54.58 51.72 1we9 n ASN 57 Cb 1.41 -1.19 -0.08 0.00 1.24 0.00 0.00 39.78 41.16 1we9 n ASN 57 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1we9 s LYS 58 N -0.81 2.16 0.33 1.20 1.02 0.25 -5.05 119.74 118.85 1we9 s LYS 58 Ca 0.39 -1.74 -0.19 0.00 0.02 0.00 0.00 55.97 54.44 1we9 s LYS 58 Cb 0.24 -1.98 -0.14 0.00 -0.52 0.00 0.00 37.83 35.44 1we9 s LYS 58 CO -0.06 0.07 0.11 -1.13 -0.92 0.00 0.00 175.35 173.43 1we9 n SER 59 N -1.05 -2.34 0.00 2.83 3.41 -1.26 -4.25 113.62 110.96 1we9 n SER 59 Ca -0.03 0.73 0.00 0.00 -0.26 0.00 0.00 58.87 59.31 1we9 n SER 59 Cb 0.63 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 1we9 n SER 59 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1we9 n GLY 60 N 1.99 1.80 0.00 5.00 0.00 -1.26 -4.88 105.19 107.83 1we9 n GLY 60 Ca 0.10 -0.37 0.07 0.00 0.00 0.00 0.00 46.02 45.83 1we9 n GLY 60 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1we9 n PRO 61 N 0.00 0.13 -3.71 1.61 -0.04 -1.26 -4.75 135.00 126.98 1we9 n PRO 61 Ca 0.00 0.19 -0.13 0.00 -0.04 0.00 0.00 63.50 63.52 1we9 n PRO 61 Cb 0.00 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 31.89 1we9 n PRO 61 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1we9 s SER 62 N -2.74 -0.23 0.32 3.54 0.01 -1.26 -5.18 113.70 108.15 1we9 s SER 62 Ca 0.11 -0.02 0.03 0.00 1.31 0.00 0.00 55.95 57.39 1we9 s SER 62 Cb 0.10 0.38 -0.04 0.00 0.21 0.00 0.00 66.02 66.67 1we9 s SER 62 CO 0.24 -0.60 0.15 -0.55 0.41 0.00 0.00 173.24 172.89 1we9 s SER 63 N -1.85 1.73 0.00 2.44 0.15 -1.26 -4.81 113.70 110.09 1we9 s SER 63 Ca -0.07 -1.55 0.00 0.00 0.70 0.00 0.00 55.95 55.03 1we9 s SER 63 Cb -0.02 0.36 0.00 0.00 -1.71 0.00 0.00 66.02 64.65 1we9 s SER 63 CO -0.01 -0.86 0.00 0.61 1.20 0.00 0.00 173.24 174.18