#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1we9 n SER 2 N 0.00 -3.46 -0.04 1.61 7.64 -1.26 -4.85 113.62 113.27 1we9 n SER 2 Ca 0.00 -0.88 -0.07 0.00 1.01 0.00 0.00 58.87 58.93 1we9 n SER 2 Cb 0.00 -3.46 -0.03 0.00 -1.01 0.00 0.00 64.21 59.71 1we9 n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1we9 n SER 3 N -2.82 0.89 0.00 6.43 2.88 -1.26 -5.13 113.62 114.61 1we9 n SER 3 Ca -0.02 0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 1we9 n SER 3 Cb 0.55 -0.20 0.00 0.00 -0.75 0.00 0.00 64.21 63.81 1we9 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1we9 n GLY 4 N 2.64 0.50 3.08 0.46 0.00 -1.26 -4.76 105.19 105.85 1we9 n GLY 4 Ca -0.14 -1.51 -0.34 0.00 0.00 0.00 0.00 46.02 44.03 1we9 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1we9 s SER 5 N -4.00 5.06 0.01 1.61 0.15 -1.26 -5.08 113.70 110.18 1we9 s SER 5 Ca 0.00 -2.05 -0.30 0.00 0.70 0.00 0.00 55.95 54.30 1we9 s SER 5 Cb 0.00 -1.75 -0.04 0.00 -1.71 0.00 0.00 66.02 62.52 1we9 s SER 5 CO 0.00 -0.47 1.20 -0.55 1.20 0.00 0.00 173.24 174.61 1we9 s SER 6 N 1.46 7.07 0.00 5.45 0.15 -1.26 -4.51 113.70 122.07 1we9 s SER 6 Ca 0.09 1.91 0.00 0.00 0.70 0.00 0.00 55.95 58.65 1we9 s SER 6 Cb -0.21 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.53 1we9 s SER 6 CO -0.06 -0.52 0.00 0.61 1.20 0.00 0.00 173.24 174.48 1we9 n GLY 7 N 3.28 0.27 3.78 9.45 0.00 -1.26 -5.12 105.19 115.59 1we9 n GLY 7 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 1we9 n GLY 7 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1we9 s GLN 8 N 0.00 4.12 -0.14 1.61 0.74 -1.26 -4.72 119.66 120.01 1we9 s GLN 8 Ca 0.00 1.54 -0.25 0.00 0.05 0.00 0.00 55.36 56.70 1we9 s GLN 8 Cb 0.00 -2.53 -0.02 0.00 1.10 0.00 0.00 33.01 31.56 1we9 s GLN 8 CO 0.00 -0.18 0.79 0.00 -0.55 0.00 0.00 175.29 175.35 1we9 h GLY 10 N 7.92 0.64 0.56 0.00 0.00 -1.95 1.09 103.07 111.32 1we9 h GLY 10 Ca -0.32 -0.42 0.05 0.00 0.00 0.00 0.00 47.33 46.63 1we9 h GLY 10 CO 0.81 0.39 -0.02 0.00 0.00 0.00 0.00 176.54 177.73 1we9 h ALA 11 N 1.38 0.22 0.00 3.60 0.00 -1.92 -3.41 119.26 119.13 1we9 h ALA 11 Ca 0.11 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1we9 h ALA 11 Cb 0.45 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1we9 h ALA 11 CO 0.02 -0.43 -0.32 0.00 0.00 0.00 0.00 179.25 178.52 1we9 n GLY 13 N 2.03 0.35 2.20 0.00 0.00 0.38 -4.91 105.19 105.23 1we9 n GLY 13 Ca 0.00 -0.40 -0.19 0.00 0.00 0.00 0.00 46.02 45.43 1we9 n GLY 13 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1we9 n GLU 14 N -1.45 -2.38 -2.26 1.61 -0.58 -1.26 -4.76 120.64 109.55 1we9 n GLU 14 Ca -0.04 -1.10 -0.33 0.00 -0.42 0.00 0.00 57.16 55.28 1we9 n GLU 14 Cb 0.52 -1.03 -0.01 0.00 -0.57 0.00 0.00 31.44 30.35 1we9 n GLU 14 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1we9 s SER 15 N -3.35 6.20 0.06 1.62 0.01 -1.26 -4.77 113.70 112.21 1we9 s SER 15 Ca 0.45 1.73 -0.36 0.00 1.31 0.00 0.00 55.95 59.08 1we9 s SER 15 Cb -0.04 -2.53 -0.16 0.00 0.21 0.00 0.00 66.02 63.50 1we9 s SER 15 CO 0.34 -0.88 1.47 0.00 0.41 0.00 0.00 173.24 174.58 1we9 n TYR 16 N -1.69 1.81 -4.02 2.43 9.36 -1.26 -4.97 117.16 118.81 1we9 n TYR 16 Ca 0.08 0.50 -0.13 0.00 3.32 0.00 0.00 57.90 61.67 1we9 n TYR 16 Cb 0.53 -2.42 -0.13 0.00 -0.63 0.00 0.00 39.34 36.69 1we9 n TYR 16 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1we9 s ALA 17 N 1.07 0.27 -0.20 2.98 0.00 -1.26 -5.07 121.76 119.55 1we9 s ALA 17 Ca 0.85 -0.29 -0.19 0.00 0.00 0.00 0.00 51.96 52.33 1we9 s ALA 17 Cb -0.88 -0.01 -0.15 0.00 0.00 0.00 0.00 23.12 22.07 1we9 s ALA 17 CO 0.46 0.01 0.08 0.00 0.00 0.00 0.00 175.76 176.32 1we9 n ALA 18 N 2.56 0.77 0.02 0.00 0.00 -1.26 -4.47 120.51 118.14 1we9 n ALA 18 Ca -0.16 -0.54 -0.12 0.00 0.00 0.00 0.00 53.44 52.63 1we9 n ALA 18 Cb 0.58 -0.39 -0.07 0.00 0.00 0.00 0.00 19.45 19.57 1we9 n ALA 18 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1we9 h ASP 19 N -1.00 0.03 -0.88 0.00 2.03 -2.03 -3.44 116.42 111.14 1we9 h ASP 19 Ca -0.32 -0.05 -0.67 0.00 -0.73 0.00 0.00 57.03 55.27 1we9 h ASP 19 Cb 1.19 -0.01 0.06 0.00 -0.83 0.00 0.00 39.33 39.74 1we9 h ASP 19 CO -0.19 0.07 -0.09 -0.62 -1.03 0.00 0.00 179.24 177.37 1we9 n GLU 20 N -5.05 0.00 -3.06 4.15 -0.58 -1.26 -4.86 120.64 109.98 1we9 n GLU 20 Ca -0.07 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.27 1we9 n GLU 20 Cb 0.05 -1.20 -0.06 0.00 -0.57 0.00 0.00 31.44 29.66 1we9 n GLU 20 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 1we9 s PHE 21 N -0.25 3.30 0.25 -0.32 5.36 -1.26 -5.00 117.98 120.05 1we9 s PHE 21 Ca 0.74 0.90 0.02 0.00 -0.96 0.00 0.00 56.93 57.62 1we9 s PHE 21 Cb -1.04 -2.88 -0.03 0.00 -0.34 0.00 0.00 43.02 38.73 1we9 s PHE 21 CO 0.50 -0.32 0.41 -1.58 -1.46 0.00 0.00 175.22 172.77 1we9 s TRP 22 N 2.50 3.48 0.30 10.12 0.52 -1.26 -0.46 118.94 134.14 1we9 s TRP 22 Ca 0.28 0.20 0.07 0.00 0.02 0.00 0.00 56.10 56.67 1we9 s TRP 22 Cb -0.15 -1.75 -0.02 0.00 -1.15 0.00 0.00 33.47 30.39 1we9 s TRP 22 CO 0.08 0.35 0.34 0.96 0.02 0.00 0.00 176.95 178.70 1we9 s ILE 23 N -2.01 4.18 -0.07 2.03 -5.25 -0.65 -4.66 121.20 114.77 1we9 s ILE 23 Ca 0.37 -1.19 0.05 0.00 -0.99 0.00 0.00 60.65 58.89 1we9 s ILE 23 Cb -0.10 -3.42 -0.01 0.00 2.95 0.00 0.00 42.46 41.89 1we9 s ILE 23 CO 0.31 -0.23 -0.23 0.00 -1.79 0.00 0.00 174.94 173.00 1we9 n ASP 26 N -0.40 1.67 0.08 0.00 -0.08 -1.26 -3.24 116.55 113.32 1we9 n ASP 26 Ca -0.07 0.28 -0.16 0.00 -1.51 0.00 0.00 54.79 53.34 1we9 n ASP 26 Cb 0.59 -0.67 -0.10 0.00 2.34 0.00 0.00 41.12 43.28 1we9 n ASP 26 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1we9 h LEU 27 N -0.82 -1.58 0.00 -2.67 3.38 -1.98 -3.33 115.31 108.32 1we9 h LEU 27 Ca -0.38 0.17 -0.40 0.00 0.09 0.00 0.00 57.88 57.36 1we9 h LEU 27 Cb 1.27 0.59 -0.07 0.00 0.09 0.00 0.00 40.66 42.54 1we9 h LEU 27 CO -0.23 -0.52 -2.49 0.00 0.09 0.00 0.00 178.44 175.29 1we9 n GLU 29 N -3.45 -3.79 -1.74 0.00 0.00 -1.20 -5.01 120.64 105.45 1we9 n GLU 29 Ca -0.47 0.48 -0.14 0.00 0.00 0.00 0.00 57.16 57.02 1we9 n GLU 29 Cb 0.97 -4.41 0.08 0.00 0.00 0.00 0.00 31.44 28.08 1we9 n GLU 29 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1we9 n MET 30 N -2.78 0.08 -3.85 5.31 2.81 -1.26 -4.80 117.12 112.62 1we9 n MET 30 Ca -0.16 -1.62 -0.35 0.00 -1.81 0.00 0.00 57.70 53.77 1we9 n MET 30 Cb 0.59 -0.45 -0.13 0.00 -0.71 0.00 0.00 33.22 32.53 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 -1.89 3.53 0.39 2.03 0.52 -1.26 -4.37 118.94 117.89 1we9 s TRP 31 Ca 0.41 -2.37 0.01 0.00 0.02 0.00 0.00 56.10 54.17 1we9 s TRP 31 Cb -0.02 -2.87 0.01 0.00 -1.15 0.00 0.00 33.47 29.43 1we9 s TRP 31 CO 0.27 -0.92 0.04 1.19 0.02 0.00 0.00 176.95 177.55 1we9 n PHE 32 N 4.54 0.65 -4.36 -1.98 3.72 -1.26 -2.97 117.46 115.80 1we9 n PHE 32 Ca -0.04 -1.87 -0.34 0.00 -0.05 0.00 0.00 57.45 55.15 1we9 n PHE 32 Cb 0.42 -0.27 -0.11 0.00 -0.94 0.00 0.00 39.48 38.58 1we9 n PHE 32 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 1we9 s HIS 33 N -2.33 3.08 0.27 1.38 3.76 -1.26 -1.64 115.29 118.54 1we9 s HIS 33 Ca 0.03 -0.10 -0.04 0.00 -0.15 0.00 0.00 55.06 54.80 1we9 s HIS 33 Cb -0.00 -1.91 0.54 0.00 1.11 0.00 0.00 32.58 32.31 1we9 s HIS 33 CO 0.02 0.14 1.62 0.78 -0.85 0.00 0.00 174.74 176.45 1we9 h GLY 34 N 6.21 0.99 1.06 -2.22 0.00 -1.01 0.35 103.07 108.45 1we9 h GLY 34 Ca -0.38 0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.03 1we9 h GLY 34 CO 0.61 -0.35 0.39 1.70 0.00 0.00 0.00 176.54 178.90 1we9 h LYS 35 N 0.10 1.21 -0.31 4.80 1.63 -1.80 0.45 116.57 122.63 1we9 h LYS 35 Ca 0.47 -0.18 0.00 0.00 -0.85 0.00 0.00 60.65 60.09 1we9 h LYS 35 Cb 0.88 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 32.28 1we9 h LYS 35 CO -0.73 0.93 0.20 0.00 -3.45 0.00 0.00 179.45 176.40 1we9 n VAL 37 N -4.86 0.00 -3.27 0.00 3.14 -0.47 -4.85 118.33 108.02 1we9 n VAL 37 Ca -0.01 0.00 -0.15 0.00 -2.96 0.00 0.00 64.34 61.21 1we9 n VAL 37 Cb 0.03 -0.14 0.08 0.00 -1.06 0.00 0.00 33.84 32.75 1we9 n VAL 37 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 1we9 n LYS 38 N -0.57 -5.89 -3.74 1.45 5.02 -0.37 -4.94 118.16 109.12 1we9 n LYS 38 Ca 0.03 0.74 -0.17 0.00 -2.02 0.00 0.00 58.31 56.89 1we9 n LYS 38 Cb 0.01 -5.43 -0.17 0.00 -0.02 0.00 0.00 35.03 29.42 1we9 n LYS 38 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1we9 s ILE 39 N -3.31 -0.06 0.62 -0.18 1.01 0.15 -5.00 121.20 114.43 1we9 s ILE 39 Ca 0.05 0.28 -0.15 0.00 0.00 0.00 0.00 60.65 60.83 1we9 s ILE 39 Cb -0.02 -0.11 -0.02 0.00 0.01 0.00 0.00 42.46 42.32 1we9 s ILE 39 CO 0.64 0.12 1.08 0.42 0.00 0.00 0.00 174.94 177.20 1we9 s THR 40 N 1.43 3.56 -0.81 2.92 -4.23 -1.26 -3.29 115.64 113.96 1we9 s THR 40 Ca -0.04 0.73 0.18 0.00 -1.18 0.00 0.00 61.69 61.37 1we9 s THR 40 Cb -0.13 -3.26 0.16 0.00 1.34 0.00 0.00 72.50 70.62 1we9 s THR 40 CO -0.03 -0.44 1.55 -0.81 -0.54 0.00 0.00 174.62 174.34 1we9 n PRO 41 N -2.21 0.07 -0.08 3.99 -0.04 -1.26 -1.81 135.00 133.66 1we9 n PRO 41 Ca 0.09 0.32 -0.23 0.00 -0.04 0.00 0.00 63.50 63.65 1we9 n PRO 41 Cb 0.52 -1.64 -0.12 0.00 -0.04 0.00 0.00 33.50 32.23 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 -1.60 0.94 -0.14 0.55 0.00 -1.26 -4.39 120.51 114.62 1we9 n ALA 42 Ca 0.03 -0.68 -0.11 0.00 0.00 0.00 0.00 53.44 52.68 1we9 n ALA 42 Cb 0.19 -0.44 0.01 0.00 0.00 0.00 0.00 19.45 19.20 1we9 n ALA 42 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1we9 h ARG 43 N -0.57 0.95 -1.18 0.00 2.43 -1.93 -3.08 114.38 110.99 1we9 h ARG 43 Ca -0.45 -0.43 0.45 0.00 -0.81 0.00 0.00 59.98 58.73 1we9 h ARG 43 Cb 1.64 -0.02 -0.16 0.00 -0.42 0.00 0.00 29.97 31.01 1we9 h ARG 43 CO -0.14 1.10 0.71 0.00 -1.51 0.00 0.00 179.97 180.12 1we9 h ALA 44 N 0.87 2.48 -0.83 2.80 0.00 -1.56 0.66 119.26 123.69 1we9 h ALA 44 Ca 0.09 0.20 0.20 0.00 0.00 0.00 0.00 54.91 55.40 1we9 h ALA 44 Cb 0.85 0.29 -0.12 0.00 0.00 0.00 0.00 17.79 18.81 1we9 h ALA 44 CO 0.07 -1.22 0.27 0.93 0.00 0.00 0.00 179.25 179.30 1we9 h GLU 45 N 0.01 0.30 -0.39 0.00 4.39 -1.76 0.11 114.58 117.25 1we9 h GLU 45 Ca 0.86 -0.02 -0.15 0.00 0.34 0.00 0.00 59.36 60.39 1we9 h GLU 45 Cb 2.51 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 31.09 1we9 h GLU 45 CO -0.62 0.20 -0.36 0.45 -1.16 0.00 0.00 179.01 177.51 1we9 h HIS 46 N 0.31 1.09 -3.46 4.33 3.86 0.13 -3.43 115.15 117.97 1we9 h HIS 46 Ca 0.50 -0.32 -0.53 0.00 -1.16 0.00 0.00 60.37 58.87 1we9 h HIS 46 Cb 0.92 -0.23 0.05 0.00 1.06 0.00 0.00 27.41 29.21 1we9 h HIS 46 CO -0.22 1.13 0.72 0.42 0.86 0.00 0.00 177.93 180.85 1we9 s ILE 47 N -4.43 2.76 -0.09 2.45 1.01 0.38 -4.94 121.20 118.34 1we9 s ILE 47 Ca -0.11 0.65 -0.06 0.00 0.00 0.00 0.00 60.65 61.14 1we9 s ILE 47 Cb 0.11 -3.41 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 1we9 s ILE 47 CO 0.88 0.11 -0.14 0.29 0.00 0.00 0.00 174.94 176.08 1we9 n LYS 48 N 2.15 0.22 -3.63 2.79 4.76 -1.26 -4.92 118.16 118.26 1we9 n LYS 48 Ca 0.06 0.10 -0.29 0.00 -2.87 0.00 0.00 58.31 55.30 1we9 n LYS 48 Cb 0.41 -0.87 -0.12 0.00 -1.84 0.00 0.00 35.03 32.61 1we9 n LYS 48 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 1we9 s GLN 49 N -2.22 1.23 0.25 1.97 -2.07 -1.26 -4.96 119.66 112.60 1we9 s GLN 49 Ca -0.14 -2.07 -0.12 0.00 -1.82 0.00 0.00 55.36 51.21 1we9 s GLN 49 Cb 0.05 -2.11 -0.08 0.00 -1.09 0.00 0.00 33.01 29.79 1we9 s GLN 49 CO 0.18 -1.23 0.60 -0.47 -1.32 0.00 0.00 175.29 173.05 1we9 s TYR 50 N 0.20 3.42 -0.79 9.60 6.14 -1.25 -4.97 117.35 129.70 1we9 s TYR 50 Ca 0.22 0.99 -0.18 0.00 0.64 0.00 0.00 57.07 58.73 1we9 s TYR 50 Cb -0.16 -2.35 0.13 0.00 0.42 0.00 0.00 41.96 40.00 1we9 s TYR 50 CO -0.06 0.23 0.93 0.21 0.64 0.00 0.00 175.55 177.51 1we9 s LYS 51 N -2.80 3.39 0.71 4.97 2.20 -1.26 -4.36 119.74 122.59 1we9 s LYS 51 Ca 0.49 -1.65 -0.17 0.00 -0.36 0.00 0.00 55.97 54.28 1we9 s LYS 51 Cb -0.11 -4.57 -0.14 0.00 -1.51 0.00 0.00 37.83 31.49 1we9 s LYS 51 CO 0.20 -1.64 -0.44 0.00 -0.36 0.00 0.00 175.35 173.11 1we9 n PRO 53 N 1.89 0.02 0.08 0.00 -0.04 -1.26 -2.21 135.00 133.48 1we9 n PRO 53 Ca 0.03 0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.73 1we9 n PRO 53 Cb 0.49 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.41 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 0.00 0.00 3.54 0.87 -2.01 -3.26 113.55 112.68 1we9 h SER 54 Ca 0.00 0.00 -0.21 0.00 -1.23 0.00 0.00 61.79 60.35 1we9 h SER 54 Cb 0.23 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.16 1we9 h SER 54 CO 0.00 0.61 -1.35 0.00 -0.53 0.00 0.00 176.83 175.55 1we9 h SER 56 N -1.00 0.00 0.65 0.00 4.64 -1.63 -1.28 113.55 114.93 1we9 h SER 56 Ca -0.31 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.98 1we9 h SER 56 Cb 1.16 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.26 1we9 h SER 56 CO -0.19 0.00 -0.31 -1.13 -0.87 0.00 0.00 176.83 174.33 1we9 h ASN 57 N 0.00 -0.74 -4.12 4.97 -0.73 -1.73 -3.44 115.58 109.79 1we9 h ASN 57 Ca 0.20 0.00 -0.51 0.00 1.87 0.00 0.00 56.30 57.87 1we9 h ASN 57 Cb 1.30 0.19 0.19 0.00 0.27 0.00 0.00 38.32 40.26 1we9 h ASN 57 CO -0.00 -0.49 0.21 -1.59 -0.37 0.00 0.00 177.43 175.19 1we9 s LYS 58 N -5.78 0.91 -0.07 6.67 -2.85 -0.48 -5.01 119.74 113.13 1we9 s LYS 58 Ca -0.17 1.37 -0.10 0.00 -1.00 0.00 0.00 55.97 56.07 1we9 s LYS 58 Cb 0.03 -1.73 -0.03 0.00 -2.06 0.00 0.00 37.83 34.04 1we9 s LYS 58 CO 0.59 -2.64 -0.19 0.45 0.10 0.00 0.00 175.35 173.66 1we9 n SER 59 N -4.23 1.41 0.00 0.03 2.88 -1.26 -5.01 113.62 107.44 1we9 n SER 59 Ca 0.10 0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.87 1we9 n SER 59 Cb 0.53 -0.56 0.00 0.00 -0.75 0.00 0.00 64.21 63.43 1we9 n SER 59 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1we9 n GLY 60 N 2.18 -1.47 3.57 0.46 0.00 -1.26 -5.06 105.19 103.60 1we9 n GLY 60 Ca -0.08 0.73 -0.27 0.00 0.00 0.00 0.00 46.02 46.40 1we9 n GLY 60 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1we9 s PRO 61 N 0.00 2.52 -0.21 1.61 0.04 -1.26 -4.70 135.00 133.01 1we9 s PRO 61 Ca 0.00 -0.70 -0.18 0.00 0.04 0.00 0.00 61.00 60.16 1we9 s PRO 61 Cb 0.00 -5.15 -0.15 0.00 0.04 0.00 0.00 34.50 29.24 1we9 s PRO 61 CO 0.00 -3.67 0.04 0.43 0.04 0.00 0.00 177.00 173.84 1we9 n SER 62 N 14.19 1.87 -4.67 6.66 7.64 -1.26 -4.90 113.62 133.14 1we9 n SER 62 Ca 0.42 0.44 -0.47 0.00 1.01 0.00 0.00 58.87 60.27 1we9 n SER 62 Cb 0.47 -0.92 -0.05 0.00 -1.01 0.00 0.00 64.21 62.70 1we9 n SER 62 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1we9 n SER 63 N -4.44 3.21 0.00 6.43 2.88 -1.26 -5.23 113.62 115.20 1we9 n SER 63 Ca -0.30 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.27 1we9 n SER 63 Cb 0.63 -1.39 0.00 0.00 -0.75 0.00 0.00 64.21 62.71 1we9 n SER 63 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42