#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqy s SER 2 N 0.00 -0.22 0.02 1.61 0.01 -1.26 -5.19 113.70 108.67 2cqy s SER 2 Ca 0.00 -0.23 -0.29 0.00 1.31 0.00 0.00 55.95 56.74 2cqy s SER 2 Cb 0.00 0.41 0.11 0.00 0.21 0.00 0.00 66.02 66.74 2cqy s SER 2 CO 0.00 -0.72 1.22 -0.94 0.41 0.00 0.00 173.24 173.20 2cqy s SER 3 N -2.77 -0.07 0.08 2.44 1.04 -1.26 -5.20 113.70 107.97 2cqy s SER 3 Ca 0.10 -0.21 -0.27 0.00 0.48 0.00 0.00 55.95 56.05 2cqy s SER 3 Cb -0.01 0.23 0.09 0.00 0.10 0.00 0.00 66.02 66.44 2cqy s SER 3 CO -0.02 -0.44 1.13 -0.83 0.98 0.00 0.00 173.24 174.06 2cqy s GLY 4 N -3.07 -0.20 -0.17 7.32 0.00 -1.26 -5.18 107.32 104.77 2cqy s GLY 4 Ca 0.15 0.19 -0.15 0.00 0.00 0.00 0.00 44.72 44.92 2cqy s GLY 4 CO -0.02 1.34 0.45 -0.56 0.00 0.00 0.00 173.10 174.31 2cqy s SER 5 N -3.18 -0.49 -0.26 1.64 0.01 -1.26 -5.16 113.70 105.01 2cqy s SER 5 Ca 0.17 0.92 -0.28 0.00 1.31 0.00 0.00 55.95 58.07 2cqy s SER 5 Cb 0.01 0.90 0.16 0.00 0.21 0.00 0.00 66.02 67.30 2cqy s SER 5 CO 0.01 -0.16 1.24 -0.94 0.41 0.00 0.00 173.24 173.79 2cqy s SER 6 N 0.45 -0.19 -0.12 2.44 1.04 -1.26 -5.18 113.70 110.87 2cqy s SER 6 Ca -0.02 0.28 -0.29 0.00 0.48 0.00 0.00 55.95 56.40 2cqy s SER 6 Cb -0.04 0.26 0.08 0.00 0.10 0.00 0.00 66.02 66.41 2cqy s SER 6 CO -0.02 -0.12 0.73 -0.83 0.98 0.00 0.00 173.24 173.97 2cqy s GLY 7 N -0.56 -0.53 -0.11 7.32 0.00 -1.26 -5.17 107.32 107.00 2cqy s GLY 7 Ca 0.05 1.60 -0.30 0.00 0.00 0.00 0.00 44.72 46.07 2cqy s GLY 7 CO -0.07 1.20 0.80 0.51 0.00 0.00 0.00 173.10 175.54 2cqy s ASP 8 N -0.73 -0.56 -0.30 1.64 -4.77 -1.26 -5.16 116.67 105.53 2cqy s ASP 8 Ca -0.07 0.66 -0.04 0.00 -3.30 0.00 0.00 52.55 49.80 2cqy s ASP 8 Cb -0.01 0.53 0.18 0.00 -1.09 0.00 0.00 42.92 42.52 2cqy s ASP 8 CO 0.06 -0.48 0.66 -1.59 0.70 0.00 0.00 175.17 174.53 2cqy s LYS 9 N -1.02 0.53 -0.18 2.11 -2.85 -1.26 -5.15 119.74 111.92 2cqy s LYS 9 Ca -0.07 1.04 -0.07 0.00 -1.00 0.00 0.00 55.97 55.87 2cqy s LYS 9 Cb -0.01 0.59 0.08 0.00 -2.06 0.00 0.00 37.83 36.43 2cqy s LYS 9 CO 0.06 -0.48 0.39 -1.50 0.10 0.00 0.00 175.35 173.92 2cqy s ILE 10 N 2.86 -0.44 -0.27 3.79 1.10 -1.26 -5.15 121.20 121.82 2cqy s ILE 10 Ca 0.12 0.17 -0.24 0.00 -0.51 0.00 0.00 60.65 60.19 2cqy s ILE 10 Cb -0.14 -0.61 0.09 0.00 0.15 0.00 0.00 42.46 41.95 2cqy s ILE 10 CO -0.20 0.07 0.81 -1.61 -2.11 0.00 0.00 174.94 171.90 2cqy s GLU 11 N 2.25 0.72 -0.24 3.50 0.41 -1.26 -5.15 118.70 118.93 2cqy s GLU 11 Ca -0.03 0.90 -0.02 0.00 -0.41 0.00 0.00 54.97 55.40 2cqy s GLU 11 Cb -0.11 0.33 0.13 0.00 -1.78 0.00 0.00 34.13 32.70 2cqy s GLU 11 CO -0.12 -0.09 0.36 0.45 -0.49 0.00 0.00 175.26 175.36 2cqy s SER 12 N 0.47 0.45 -0.16 -0.19 0.15 -1.26 -5.14 113.70 108.02 2cqy s SER 12 Ca -0.00 0.08 0.01 0.00 0.70 0.00 0.00 55.95 56.74 2cqy s SER 12 Cb -0.05 1.00 0.01 0.00 -1.71 0.00 0.00 66.02 65.27 2cqy s SER 12 CO -0.03 -0.31 -0.17 -1.59 1.20 0.00 0.00 173.24 172.34 2cqy s LYS 13 N 2.51 3.14 -0.81 5.44 -2.85 -1.26 -5.06 119.74 120.85 2cqy s LYS 13 Ca 0.12 -0.78 0.01 0.00 -1.00 0.00 0.00 55.97 54.31 2cqy s LYS 13 Cb -0.15 -2.61 0.20 0.00 -2.06 0.00 0.00 37.83 33.21 2cqy s LYS 13 CO -0.17 -0.06 0.65 -0.51 0.10 0.00 0.00 175.35 175.36 2cqy s LEU 14 N 0.99 5.26 0.15 2.77 1.43 -1.26 -5.03 118.68 122.99 2cqy s LEU 14 Ca -0.02 -3.72 -0.17 0.00 -1.03 0.00 0.00 54.13 49.19 2cqy s LEU 14 Cb -0.15 -1.81 0.04 0.00 0.03 0.00 0.00 46.19 44.30 2cqy s LEU 14 CO -0.04 -0.16 0.47 -1.48 0.23 0.00 0.00 176.35 175.37 2cqy s LEU 15 N -1.31 0.16 -0.39 1.79 0.05 -1.26 -5.13 118.68 112.59 2cqy s LEU 15 Ca 0.26 -0.33 0.03 0.00 0.05 0.00 0.00 54.13 54.14 2cqy s LEU 15 Cb -0.07 2.04 0.11 0.00 -2.05 0.00 0.00 46.19 46.22 2cqy s LEU 15 CO -0.13 -0.93 0.13 0.00 -0.55 0.00 0.00 176.35 174.86 2cqy s ALA 16 N -3.82 2.65 -0.29 1.48 0.00 -1.26 -5.06 121.76 115.46 2cqy s ALA 16 Ca 0.05 -2.55 -0.16 0.00 0.00 0.00 0.00 51.96 49.30 2cqy s ALA 16 Cb 0.01 -1.94 0.14 0.00 0.00 0.00 0.00 23.12 21.33 2cqy s ALA 16 CO -0.09 -1.80 0.94 0.21 0.00 0.00 0.00 175.76 175.02 2cqy s LYS 17 N 0.70 0.39 0.16 0.00 2.20 -1.26 -5.18 119.74 116.76 2cqy s LYS 17 Ca 0.13 0.75 -0.01 0.00 -0.36 0.00 0.00 55.97 56.48 2cqy s LYS 17 Cb -0.21 0.19 -0.04 0.00 -1.51 0.00 0.00 37.83 36.27 2cqy s LYS 17 CO -0.08 -0.09 0.10 -1.59 -0.36 0.00 0.00 175.35 173.32 2cqy s LYS 18 N 1.68 1.06 0.22 4.03 -2.85 -1.26 -5.17 119.74 117.44 2cqy s LYS 18 Ca -0.08 -1.51 0.09 0.00 -1.00 0.00 0.00 55.97 53.48 2cqy s LYS 18 Cb -0.05 0.26 -0.04 0.00 -2.06 0.00 0.00 37.83 35.94 2cqy s LYS 18 CO -0.16 -0.32 -0.05 0.00 0.10 0.00 0.00 175.35 174.91 2cqy s ALA 19 N -4.09 3.05 0.47 0.59 0.00 -1.26 -5.10 121.76 115.41 2cqy s ALA 19 Ca 0.30 -1.55 -0.24 0.00 0.00 0.00 0.00 51.96 50.47 2cqy s ALA 19 Cb 0.07 -0.75 -0.07 0.00 0.00 0.00 0.00 23.12 22.37 2cqy s ALA 19 CO 0.06 0.38 1.32 -1.21 0.00 0.00 0.00 175.76 176.31 2cqy s GLU 20 N -3.21 3.59 0.20 0.00 0.41 -1.26 -5.03 118.70 113.40 2cqy s GLU 20 Ca 0.28 2.16 0.09 0.00 -0.41 0.00 0.00 54.97 57.09 2cqy s GLU 20 Cb -0.08 -2.50 -0.04 0.00 -1.78 0.00 0.00 34.13 29.73 2cqy s GLU 20 CO 0.17 -0.80 -0.08 0.14 -0.49 0.00 0.00 175.26 174.20 2cqy s VAL 21 N -1.32 3.22 -0.48 2.63 -7.23 -1.26 -5.04 120.40 110.92 2cqy s VAL 21 Ca 0.64 -1.74 0.03 0.00 -1.81 0.00 0.00 61.98 59.10 2cqy s VAL 21 Cb -0.38 -2.62 0.47 0.00 0.56 0.00 0.00 36.38 34.40 2cqy s VAL 21 CO 0.47 -0.17 1.65 -0.46 -0.31 0.00 0.00 175.10 176.28 2cqy n ASN 22 N -0.17 6.08 -3.46 4.85 6.94 -1.26 -4.99 115.26 123.24 2cqy n ASN 22 Ca -0.10 -3.77 -0.16 0.00 -0.02 0.00 0.00 54.58 50.54 2cqy n ASN 22 Cb 0.56 -0.69 -0.02 0.00 -2.36 0.00 0.00 39.78 37.27 2cqy n ASN 22 CO 0.00 0.00 0.00 1.07 -1.03 0.00 0.00 177.26 177.30 2cqy n THR 23 N -0.86 0.00 -2.42 5.53 5.66 -1.26 -5.10 114.28 115.83 2cqy n THR 23 Ca 0.53 -1.22 -0.42 0.00 -3.05 0.00 0.00 64.05 59.89 2cqy n THR 23 Cb 0.85 0.02 -0.03 0.00 -1.55 0.00 0.00 70.33 69.61 2cqy n THR 23 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 2cqy s ILE 24 N -1.73 3.97 -2.00 1.09 1.01 -1.26 -4.90 121.20 117.38 2cqy s ILE 24 Ca 0.08 1.45 0.07 0.00 0.00 0.00 0.00 60.65 62.25 2cqy s ILE 24 Cb -0.01 -3.93 0.20 0.00 0.01 0.00 0.00 42.46 38.74 2cqy s ILE 24 CO 0.05 0.13 0.88 -0.81 0.00 0.00 0.00 174.94 175.19 2cqy n PRO 25 N 3.70 0.49 -0.37 2.79 -0.04 -1.26 -4.81 135.00 135.50 2cqy n PRO 25 Ca 0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 2cqy n PRO 25 Cb 0.46 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 32.69 2cqy n PRO 25 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2cqy n GLY 26 N -0.02 2.17 3.65 0.55 0.00 -1.26 -4.57 105.19 105.71 2cqy n GLY 26 Ca 0.05 -0.79 -0.01 0.00 0.00 0.00 0.00 46.02 45.27 2cqy n GLY 26 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2cqy s PHE 27 N -4.03 -0.31 -0.05 1.61 5.36 -1.25 -4.92 117.98 114.39 2cqy s PHE 27 Ca 0.00 0.65 0.03 0.00 -0.96 0.00 0.00 56.93 56.64 2cqy s PHE 27 Cb 0.00 0.25 -0.05 0.00 -0.34 0.00 0.00 43.02 42.88 2cqy s PHE 27 CO 0.00 -0.15 -0.01 -0.25 -1.46 0.00 0.00 175.22 173.35 2cqy n ASP 28 N 3.04 3.78 -3.38 6.13 8.00 -1.26 -4.34 116.55 128.52 2cqy n ASP 28 Ca -0.16 -0.01 -0.35 0.00 0.71 0.00 0.00 54.79 54.98 2cqy n ASP 28 Cb 0.57 0.37 -0.11 0.00 -0.02 0.00 0.00 41.12 41.93 2cqy n ASP 28 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2cqy n GLY 29 N 2.90 -0.31 3.67 0.44 0.00 -1.26 -4.75 105.19 105.89 2cqy n GLY 29 Ca -0.08 0.88 -0.46 0.00 0.00 0.00 0.00 46.02 46.36 2cqy n GLY 29 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2cqy n VAL 30 N 5.52 0.01 -1.59 1.61 3.14 -1.26 -4.80 118.33 120.96 2cqy n VAL 30 Ca 0.48 -0.00 -0.32 0.00 -2.96 0.00 0.00 64.34 61.54 2cqy n VAL 30 Cb 0.01 -1.58 0.06 0.00 -1.06 0.00 0.00 33.84 31.27 2cqy n VAL 30 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 2cqy s VAL 31 N 1.01 3.39 0.00 1.55 1.01 -0.50 -4.90 120.40 121.96 2cqy s VAL 31 Ca 0.79 0.56 0.00 0.00 0.00 0.00 0.00 61.98 63.33 2cqy s VAL 31 Cb -0.66 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 32.63 2cqy s VAL 31 CO 0.38 -0.49 0.00 0.29 0.00 0.00 0.00 175.10 175.28 2cqy n LYS 32 N -2.85 0.97 -3.92 2.72 5.02 -1.26 -4.06 118.16 114.79 2cqy n LYS 32 Ca 0.09 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.28 2cqy n LYS 32 Cb 0.53 -0.78 -0.12 0.00 -0.02 0.00 0.00 35.03 34.64 2cqy n LYS 32 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2cqy s ASP 33 N -2.92 0.10 0.33 4.39 1.01 -1.26 -5.03 116.67 113.29 2cqy s ASP 33 Ca 0.00 -0.21 0.12 0.00 0.71 0.00 0.00 52.55 53.16 2cqy s ASP 33 Cb 0.00 0.07 1.01 0.00 1.01 0.00 0.00 42.92 45.02 2cqy s ASP 33 CO 0.00 -0.16 1.64 0.00 0.21 0.00 0.00 175.17 176.86 2cqy h ALA 34 N 5.37 1.76 -0.96 5.23 0.00 -1.93 0.80 119.26 129.53 2cqy h ALA 34 Ca -0.28 0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.90 2cqy h ALA 34 Cb 1.21 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 19.20 2cqy h ALA 34 CO 0.45 -0.61 0.63 0.93 0.00 0.00 0.00 179.25 180.65 2cqy h GLU 35 N 0.22 1.14 -0.07 0.00 5.08 -1.99 -1.49 114.58 117.47 2cqy h GLU 35 Ca 0.70 -0.07 -0.15 0.00 -1.00 0.00 0.00 59.36 58.84 2cqy h GLU 35 Cb 1.60 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 2cqy h GLU 35 CO -0.67 0.76 -0.64 1.49 -1.00 0.00 0.00 179.01 178.95 2cqy h GLU 36 N 1.18 0.25 -0.51 2.33 4.57 0.16 -2.93 114.58 119.62 2cqy h GLU 36 Ca 0.39 -0.18 -0.08 0.00 -1.18 0.00 0.00 59.36 58.31 2cqy h GLU 36 Cb 0.07 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.67 2cqy h GLU 36 CO -0.13 0.80 0.01 0.00 -1.18 0.00 0.00 179.01 178.51 2cqy h ALA 37 N 1.15 1.05 0.07 2.92 0.00 -0.28 -2.36 119.26 121.80 2cqy h ALA 37 Ca -0.01 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 2cqy h ALA 37 Cb 1.16 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2cqy h ALA 37 CO 0.10 0.60 -0.03 0.28 0.00 0.00 0.00 179.25 180.19 2cqy h VAL 38 N 0.80 1.16 -0.05 0.00 2.07 -1.28 -1.60 116.25 117.36 2cqy h VAL 38 Ca 0.15 -0.81 0.04 0.00 0.82 0.00 0.00 66.70 66.90 2cqy h VAL 38 Cb 0.47 1.69 -0.05 0.00 -1.52 0.00 0.00 31.29 31.88 2cqy h VAL 38 CO 0.02 0.20 -0.26 0.03 0.02 0.00 0.00 177.57 177.58 2cqy h ARG 39 N -0.46 -0.37 -0.43 1.57 3.08 -1.47 0.86 114.38 117.16 2cqy h ARG 39 Ca -0.01 0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.11 2cqy h ARG 39 Cb 0.40 0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.49 2cqy h ARG 39 CO 0.02 -0.24 0.19 0.82 -1.07 0.00 0.00 179.97 179.69 2cqy h ILE 40 N -0.38 0.93 0.70 2.04 2.04 -1.47 -2.68 117.51 118.69 2cqy h ILE 40 Ca 0.08 -0.14 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 2cqy h ILE 40 Cb 0.49 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 2cqy h ILE 40 CO -0.26 0.07 -0.46 0.00 0.00 0.00 0.00 178.15 177.49 2cqy h ALA 41 N 1.25 -1.23 -1.28 1.87 0.00 -0.74 -1.94 119.26 117.19 2cqy h ALA 41 Ca 0.19 -0.23 0.42 0.00 0.00 0.00 0.00 54.91 55.30 2cqy h ALA 41 Cb 0.13 0.60 -0.13 0.00 0.00 0.00 0.00 17.79 18.39 2cqy h ALA 41 CO -0.16 -1.20 0.82 0.00 0.00 0.00 0.00 179.25 178.71 2cqy h ARG 42 N -1.10 0.10 0.07 0.00 3.08 -0.74 0.40 114.38 116.20 2cqy h ARG 42 Ca -0.09 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 2cqy h ARG 42 Cb 0.89 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.92 2cqy h ARG 42 CO 0.07 0.07 -0.03 0.93 -1.07 0.00 0.00 179.97 179.93 2cqy h GLU 43 N 0.10 -0.09 -0.92 0.04 4.39 -1.07 -3.19 114.58 113.84 2cqy h GLU 43 Ca 0.81 0.01 0.03 0.00 0.34 0.00 0.00 59.36 60.55 2cqy h GLU 43 Cb 2.47 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 31.09 2cqy h GLU 43 CO -0.44 0.33 0.60 0.82 -1.16 0.00 0.00 179.01 179.17 2cqy h ILE 44 N -0.54 1.17 0.00 3.13 2.04 0.43 -3.47 117.51 120.27 2cqy h ILE 44 Ca -0.01 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.45 2cqy h ILE 44 Cb 0.46 -0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.44 2cqy h ILE 44 CO 0.02 0.21 0.00 0.61 0.00 0.00 0.00 178.15 178.99 2cqy n GLY 45 N -1.39 1.19 3.75 5.37 0.00 0.12 -4.93 105.19 109.30 2cqy n GLY 45 Ca 0.12 -1.06 -0.34 0.00 0.00 0.00 0.00 46.02 44.74 2cqy n GLY 45 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2cqy s TYR 46 N 0.00 2.36 0.66 1.61 2.02 -1.26 -4.37 117.35 118.36 2cqy s TYR 46 Ca 0.00 1.57 -0.15 0.00 -0.37 0.00 0.00 57.07 58.12 2cqy s TYR 46 Cb 0.00 -3.34 0.00 0.00 -0.40 0.00 0.00 41.96 38.22 2cqy s TYR 46 CO 0.00 -2.13 1.11 -1.25 -1.57 0.00 0.00 175.55 171.71 2cqy s PRO 47 N -3.85 2.79 -0.08 -1.71 0.04 -1.26 -5.01 135.00 125.92 2cqy s PRO 47 Ca 0.72 1.38 0.01 0.00 0.04 0.00 0.00 61.00 63.15 2cqy s PRO 47 Cb -0.26 -1.95 0.02 0.00 0.04 0.00 0.00 34.50 32.35 2cqy s PRO 47 CO 0.41 -1.26 -0.09 0.14 0.04 0.00 0.00 177.00 176.24 2cqy s VAL 48 N -2.35 0.98 0.28 -0.36 -7.23 -0.20 -2.50 120.40 109.01 2cqy s VAL 48 Ca 0.67 -0.34 -0.20 0.00 -1.81 0.00 0.00 61.98 60.29 2cqy s VAL 48 Cb -0.20 -0.95 -0.09 0.00 0.56 0.00 0.00 36.38 35.70 2cqy s VAL 48 CO 0.42 0.34 0.79 -0.32 -0.31 0.00 0.00 175.10 176.02 2cqy s MET 49 N 1.07 4.27 -0.12 4.82 1.75 -0.35 -1.34 119.30 129.40 2cqy s MET 49 Ca -0.07 0.95 0.00 0.00 -1.25 0.00 0.00 55.69 55.32 2cqy s MET 49 Cb -0.14 -2.72 0.02 0.00 2.84 0.00 0.00 34.83 34.83 2cqy s MET 49 CO -0.01 0.29 -0.11 0.42 -0.65 0.00 0.00 175.02 174.96 2cqy s ILE 50 N -1.69 1.26 0.49 10.11 1.01 -0.20 -1.63 121.20 130.56 2cqy s ILE 50 Ca 0.48 -0.44 0.05 0.00 0.00 0.00 0.00 60.65 60.74 2cqy s ILE 50 Cb -0.15 -1.23 -0.01 0.00 0.01 0.00 0.00 42.46 41.09 2cqy s ILE 50 CO 0.20 0.41 0.20 -0.54 0.00 0.00 0.00 174.94 175.21 2cqy s LYS 51 N 1.55 2.22 -0.56 2.79 3.01 -0.64 -2.65 119.74 125.46 2cqy s LYS 51 Ca 0.04 -2.10 -0.13 0.00 -1.01 0.00 0.00 55.97 52.77 2cqy s LYS 51 Cb -0.13 -1.87 0.14 0.00 -1.01 0.00 0.00 37.83 34.96 2cqy s LYS 51 CO -0.08 -0.39 0.49 0.00 0.51 0.00 0.00 175.35 175.88 2cqy s ALA 52 N -2.76 3.63 0.48 5.17 0.00 -1.26 -0.74 121.76 126.28 2cqy s ALA 52 Ca 0.27 -2.68 0.41 0.00 0.00 0.00 0.00 51.96 49.96 2cqy s ALA 52 Cb 0.01 -3.15 1.41 0.00 0.00 0.00 0.00 23.12 21.38 2cqy s ALA 52 CO 0.16 -2.03 1.31 0.45 0.00 0.00 0.00 175.76 175.65 2cqy n SER 53 N 4.90 0.00 -2.06 0.00 2.88 0.22 0.13 113.62 119.70 2cqy n SER 53 Ca -0.07 0.83 -0.20 0.00 -1.33 0.00 0.00 58.87 58.09 2cqy n SER 53 Cb 0.41 -0.40 0.02 0.00 -0.75 0.00 0.00 64.21 63.49 2cqy n SER 53 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2cqy n ALA 54 N -2.71 5.51 0.00 -1.46 0.00 -1.20 -4.38 120.51 116.28 2cqy n ALA 54 Ca 0.36 -2.12 0.00 0.00 0.00 0.00 0.00 53.44 51.69 2cqy n ALA 54 Cb 1.69 -1.57 0.00 0.00 0.00 0.00 0.00 19.45 19.56 2cqy n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cqy n GLY 55 N 0.35 0.49 0.00 0.00 0.00 0.35 -4.72 105.19 101.66 2cqy n GLY 55 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.39 2cqy n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cqy n GLY 56 N 0.00 -1.77 2.93 -0.02 0.00 0.13 -4.61 105.19 101.84 2cqy n GLY 56 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2cqy n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cqy n GLY 57 N 0.00 1.58 1.24 -0.02 0.00 -1.26 -4.34 105.19 102.38 2cqy n GLY 57 Ca 0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 46.02 45.77 2cqy n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cqy n GLY 58 N 0.00 0.45 0.28 -0.02 0.00 -1.26 -5.01 105.19 99.64 2cqy n GLY 58 Ca 0.00 -0.46 -0.12 0.00 0.00 0.00 0.00 46.02 45.43 2cqy n GLY 58 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2cqy n LYS 59 N -1.16 0.33 -0.35 1.61 4.76 -1.26 -4.80 118.16 117.29 2cqy n LYS 59 Ca -0.02 0.10 0.03 0.00 -2.87 0.00 0.00 58.31 55.56 2cqy n LYS 59 Cb 0.51 -1.16 0.05 0.00 -1.84 0.00 0.00 35.03 32.59 2cqy n LYS 59 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2cqy n GLY 60 N 2.51 2.01 2.12 0.72 0.00 -1.26 -5.09 105.19 106.19 2cqy n GLY 60 Ca -0.26 -0.39 -0.18 0.00 0.00 0.00 0.00 46.02 45.18 2cqy n GLY 60 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2cqy n MET 61 N -0.50 -2.36 -4.41 1.61 0.00 -1.26 -5.07 117.12 105.12 2cqy n MET 61 Ca 0.06 -1.06 -0.27 0.00 0.00 0.00 0.00 57.70 56.43 2cqy n MET 61 Cb 0.68 -1.00 -0.11 0.00 0.00 0.00 0.00 33.22 32.78 2cqy n MET 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 175.97 176.47 2cqy s ARG 62 N -4.50 1.57 0.01 3.17 3.52 -1.08 -5.04 118.95 116.60 2cqy s ARG 62 Ca 0.43 -1.51 0.06 0.00 -0.13 0.00 0.00 55.73 54.58 2cqy s ARG 62 Cb -0.04 -1.87 -0.02 0.00 -1.56 0.00 0.00 34.95 31.46 2cqy s ARG 62 CO 0.33 0.40 -0.18 0.42 -0.81 0.00 0.00 175.30 175.47 2cqy s ILE 63 N -1.69 1.39 0.22 4.11 1.01 -1.26 -1.03 121.20 123.95 2cqy s ILE 63 Ca 0.21 -0.88 0.10 0.00 0.00 0.00 0.00 60.65 60.08 2cqy s ILE 63 Cb -0.08 -1.19 -0.04 0.00 0.01 0.00 0.00 42.46 41.16 2cqy s ILE 63 CO 0.10 0.29 -0.13 0.00 0.00 0.00 0.00 174.94 175.20 2cqy s ALA 64 N -0.56 2.86 0.00 9.38 0.00 -0.45 -4.97 121.76 128.02 2cqy s ALA 64 Ca 0.06 -1.63 0.00 0.00 0.00 0.00 0.00 51.96 50.39 2cqy s ALA 64 Cb -0.07 -0.55 0.00 0.00 0.00 0.00 0.00 23.12 22.50 2cqy s ALA 64 CO 0.00 0.38 0.00 0.91 0.00 0.00 0.00 175.76 177.05 2cqy n TRP 65 N -0.24 0.00 -4.00 0.00 7.02 -1.26 -1.03 117.44 117.92 2cqy n TRP 65 Ca -0.09 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.30 2cqy n TRP 65 Cb 0.57 0.00 -0.09 0.00 -2.42 0.00 0.00 31.31 29.38 2cqy n TRP 65 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2cqy s ASP 66 N -1.76 0.25 0.24 -0.99 1.01 -1.26 -4.69 116.67 109.47 2cqy s ASP 66 Ca 0.00 -0.90 -0.12 0.00 0.71 0.00 0.00 52.55 52.24 2cqy s ASP 66 Cb 0.00 0.31 0.33 0.00 1.01 0.00 0.00 42.92 44.57 2cqy s ASP 66 CO 0.00 -0.72 1.59 -2.24 0.21 0.00 0.00 175.17 174.00 2cqy h ASP 67 N 2.85 -0.86 -0.60 0.27 2.03 -1.98 0.36 116.42 118.50 2cqy h ASP 67 Ca -0.34 0.25 0.11 0.00 -0.73 0.00 0.00 57.03 56.32 2cqy h ASP 67 Cb 1.19 0.54 -0.08 0.00 -0.83 0.00 0.00 39.33 40.14 2cqy h ASP 67 CO 0.58 -0.28 0.15 1.05 -1.03 0.00 0.00 179.24 179.72 2cqy h GLU 68 N -0.02 0.28 -0.53 4.15 4.11 -2.00 -1.19 114.58 119.38 2cqy h GLU 68 Ca 0.38 -0.02 -0.08 0.00 0.07 0.00 0.00 59.36 59.71 2cqy h GLU 68 Cb 0.60 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 2cqy h GLU 68 CO -0.85 0.19 0.00 0.93 0.07 0.00 0.00 179.01 179.35 2cqy h GLU 69 N 0.29 0.94 -0.18 1.06 5.08 -0.82 -2.34 114.58 118.60 2cqy h GLU 69 Ca 0.32 -0.30 0.05 0.00 -1.00 0.00 0.00 59.36 58.43 2cqy h GLU 69 Cb 0.45 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.55 2cqy h GLU 69 CO -0.38 0.95 -0.28 1.15 -1.00 0.00 0.00 179.01 179.46 2cqy h THR 70 N 0.82 0.35 0.79 1.13 2.02 0.42 0.87 112.91 119.29 2cqy h THR 70 Ca 0.15 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.29 2cqy h THR 70 Cb 0.53 0.35 0.01 0.00 -1.74 0.00 0.00 68.15 67.29 2cqy h THR 70 CO 0.03 0.00 -0.38 0.03 0.37 0.00 0.00 175.52 175.57 2cqy h ARG 71 N -0.32 -1.02 -0.99 6.66 3.08 -1.36 0.26 114.38 120.69 2cqy h ARG 71 Ca 0.12 0.07 0.31 0.00 0.07 0.00 0.00 59.98 60.54 2cqy h ARG 71 Cb 0.50 0.23 -0.15 0.00 0.08 0.00 0.00 29.97 30.63 2cqy h ARG 71 CO -0.37 -0.66 0.55 -0.44 -1.07 0.00 0.00 179.97 177.98 2cqy h ASP 72 N -1.16 0.50 0.30 7.04 5.19 -1.24 0.23 116.42 127.27 2cqy h ASP 72 Ca -0.11 0.19 -0.29 0.00 -0.62 0.00 0.00 57.03 56.20 2cqy h ASP 72 Cb 0.82 0.14 0.02 0.00 0.18 0.00 0.00 39.33 40.49 2cqy h ASP 72 CO 0.18 -0.11 -1.22 1.23 -3.12 0.00 0.00 179.24 176.20 2cqy h GLY 73 N 0.34 0.56 1.89 2.75 0.00 -0.61 -3.14 103.07 104.87 2cqy h GLY 73 Ca 0.71 -1.21 -0.00 0.00 0.00 0.00 0.00 47.33 46.83 2cqy h GLY 73 CO -0.60 1.07 0.06 -2.75 0.00 0.00 0.00 176.54 174.32 2cqy h PHE 74 N 0.21 0.14 -0.08 5.60 3.57 0.27 0.94 116.94 127.59 2cqy h PHE 74 Ca -0.16 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.22 2cqy h PHE 74 Cb 1.90 -0.05 0.01 0.00 2.79 0.00 0.00 35.95 40.60 2cqy h PHE 74 CO 0.09 0.10 -0.40 0.00 -2.23 0.00 0.00 178.31 175.87 2cqy h ARG 75 N 0.15 0.42 0.25 1.11 3.08 -1.15 -2.84 114.38 115.40 2cqy h ARG 75 Ca 0.04 -0.34 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 2cqy h ARG 75 Cb 0.01 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.13 2cqy h ARG 75 CO -0.01 0.98 -0.12 -0.07 -1.07 0.00 0.00 179.97 179.68 2cqy h LEU 76 N -0.04 -0.29 -1.36 3.04 3.38 -1.39 -2.52 115.31 116.13 2cqy h LEU 76 Ca -0.03 0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.07 2cqy h LEU 76 Cb 1.05 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 2cqy h LEU 76 CO 0.08 -0.07 0.73 0.28 0.09 0.00 0.00 178.44 179.55 2cqy h SER 77 N -0.60 0.00 0.02 -0.43 0.02 -1.00 0.31 113.55 111.87 2cqy h SER 77 Ca -0.03 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.86 2cqy h SER 77 Cb 0.26 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.80 2cqy h SER 77 CO 0.06 0.00 -0.24 -1.28 -1.14 0.00 0.00 176.83 174.23 2cqy h SER 78 N 0.00 0.18 -0.09 3.07 0.87 -1.46 -2.96 113.55 113.16 2cqy h SER 78 Ca 0.19 -0.87 -0.00 0.00 -1.23 0.00 0.00 61.79 59.88 2cqy h SER 78 Cb 1.64 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 63.54 2cqy h SER 78 CO -0.00 1.02 0.06 1.56 -0.53 0.00 0.00 176.83 178.94 2cqy h GLN 79 N -0.65 0.13 0.27 2.24 4.20 0.04 -0.53 115.11 120.82 2cqy h GLN 79 Ca -0.04 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 2cqy h GLN 79 Cb 1.08 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.83 2cqy h GLN 79 CO 0.05 0.10 -0.13 0.93 -0.67 0.00 0.00 178.83 179.11 2cqy h GLU 80 N 0.14 -0.35 -0.93 1.46 4.39 -1.44 -2.95 114.58 114.90 2cqy h GLU 80 Ca 0.04 0.02 0.17 0.00 0.34 0.00 0.00 59.36 59.93 2cqy h GLU 80 Cb 0.00 0.08 -0.08 0.00 -0.10 0.00 0.00 28.75 28.65 2cqy h GLU 80 CO -0.01 -0.23 0.59 0.00 -1.16 0.00 0.00 179.01 178.21 2cqy h ALA 81 N -1.60 1.86 0.00 3.43 0.00 -1.46 0.93 119.26 122.43 2cqy h ALA 81 Ca -0.04 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2cqy h ALA 81 Cb 0.28 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2cqy h ALA 81 CO 0.06 -0.14 -0.03 0.00 0.00 0.00 0.00 179.25 179.14 2cqy h ALA 82 N 1.61 1.19 0.00 0.00 0.00 0.11 0.11 119.26 122.27 2cqy h ALA 82 Ca 0.49 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.37 2cqy h ALA 82 Cb 0.85 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2cqy h ALA 82 CO -0.24 0.03 -0.20 0.45 0.00 0.00 0.00 179.25 179.29 2cqy n SER 83 N -3.38 0.58 -0.23 0.00 2.88 0.13 -3.03 113.62 110.56 2cqy n SER 83 Ca -0.02 0.09 0.23 0.00 -1.33 0.00 0.00 58.87 57.84 2cqy n SER 83 Cb 0.14 -0.37 0.43 0.00 -0.75 0.00 0.00 64.21 63.65 2cqy n SER 83 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2cqy n SER 84 N -3.07 0.25 0.01 -3.46 3.41 0.28 -3.07 113.62 107.97 2cqy n SER 84 Ca -0.03 1.22 0.00 0.00 -0.26 0.00 0.00 58.87 59.80 2cqy n SER 84 Cb 0.10 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.46 2cqy n SER 84 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2cqy n PHE 85 N -4.66 -0.02 0.00 7.33 3.01 -1.06 -5.06 117.46 117.00 2cqy n PHE 85 Ca 0.28 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.74 2cqy n PHE 85 Cb 0.94 0.05 0.00 0.00 -0.01 0.00 0.00 39.48 40.46 2cqy n PHE 85 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2cqy n GLY 86 N 2.91 4.13 3.84 1.37 0.00 0.36 -5.02 105.19 112.78 2cqy n GLY 86 Ca 0.00 -0.64 -0.35 0.00 0.00 0.00 0.00 46.02 45.03 2cqy n GLY 86 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2cqy s ASP 87 N 0.00 6.85 0.00 1.61 1.01 -1.13 -4.39 116.67 120.62 2cqy s ASP 87 Ca 0.00 1.13 0.21 0.00 0.71 0.00 0.00 52.55 54.59 2cqy s ASP 87 Cb 0.00 -2.31 0.55 0.00 1.01 0.00 0.00 42.92 42.17 2cqy s ASP 87 CO 0.00 0.06 1.46 -0.90 0.21 0.00 0.00 175.17 176.01 2cqy n ASP 88 N 0.67 3.31 -4.63 0.27 5.75 -1.26 -1.43 116.55 119.24 2cqy n ASP 88 Ca -0.04 -1.98 -0.50 0.00 -0.01 0.00 0.00 54.79 52.26 2cqy n ASP 88 Cb 0.52 -0.37 -0.05 0.00 -1.03 0.00 0.00 41.12 40.19 2cqy n ASP 88 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2cqy n ARG 89 N 1.33 1.78 -4.15 0.11 1.74 -1.26 -4.77 116.66 111.44 2cqy n ARG 89 Ca 0.21 0.61 -0.22 0.00 -0.77 0.00 0.00 57.85 57.67 2cqy n ARG 89 Cb 0.54 -2.59 -0.06 0.00 -1.02 0.00 0.00 32.46 29.33 2cqy n ARG 89 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2cqy s LEU 90 N 5.15 3.49 0.17 0.55 1.43 -1.26 0.73 118.68 128.94 2cqy s LEU 90 Ca 0.98 -0.50 0.04 0.00 -1.03 0.00 0.00 54.13 53.63 2cqy s LEU 90 Cb -0.74 -2.01 -0.05 0.00 0.03 0.00 0.00 46.19 43.41 2cqy s LEU 90 CO 0.51 -0.09 -0.08 -0.76 0.23 0.00 0.00 176.35 176.16 2cqy s LEU 91 N -3.80 2.44 -0.06 1.79 1.43 0.08 -1.41 118.68 119.16 2cqy s LEU 91 Ca 0.34 -1.07 -0.03 0.00 -1.03 0.00 0.00 54.13 52.34 2cqy s LEU 91 Cb -0.06 -0.35 0.04 0.00 0.03 0.00 0.00 46.19 45.84 2cqy s LEU 91 CO 0.23 -0.37 0.13 -0.63 0.23 0.00 0.00 176.35 175.95 2cqy s ILE 92 N -3.32 -0.05 0.07 -0.59 1.01 -1.26 -1.63 121.20 115.43 2cqy s ILE 92 Ca 0.20 0.18 0.01 0.00 0.00 0.00 0.00 60.65 61.04 2cqy s ILE 92 Cb 0.03 -0.22 -0.04 0.00 0.01 0.00 0.00 42.46 42.24 2cqy s ILE 92 CO 0.03 0.07 -0.06 -1.61 0.00 0.00 0.00 174.94 173.38 2cqy s GLU 93 N 1.14 0.66 0.24 2.79 0.41 -0.65 -3.88 118.70 119.42 2cqy s GLU 93 Ca -0.09 -1.10 -0.30 0.00 -0.41 0.00 0.00 54.97 53.07 2cqy s GLU 93 Cb -0.11 -0.10 -0.10 0.00 -1.78 0.00 0.00 34.13 32.03 2cqy s GLU 93 CO -0.06 -0.03 1.50 0.21 -0.49 0.00 0.00 175.26 176.40 2cqy s LYS 94 N -3.07 4.23 -0.25 1.61 2.47 -1.26 -1.21 119.74 122.26 2cqy s LYS 94 Ca 0.03 2.37 -0.06 0.00 -1.56 0.00 0.00 55.97 56.75 2cqy s LYS 94 Cb 0.01 -3.10 -0.01 0.00 -1.46 0.00 0.00 37.83 33.27 2cqy s LYS 94 CO -0.04 -0.50 0.02 0.12 0.16 0.00 0.00 175.35 175.11 2cqy s PHE 95 N 0.21 3.05 -0.10 4.03 2.19 -1.04 -4.77 117.98 121.54 2cqy s PHE 95 Ca 0.62 -0.80 -0.00 0.00 0.33 0.00 0.00 56.93 57.07 2cqy s PHE 95 Cb -0.43 -2.18 0.02 0.00 -1.31 0.00 0.00 43.02 39.12 2cqy s PHE 95 CO 0.42 -0.50 -0.06 0.42 1.83 0.00 0.00 175.22 177.32 2cqy s ILE 96 N 1.52 0.91 -0.21 3.12 1.01 -1.26 -4.39 121.20 121.89 2cqy s ILE 96 Ca 0.05 -0.22 0.03 0.00 0.00 0.00 0.00 60.65 60.51 2cqy s ILE 96 Cb -0.15 -0.94 -0.15 0.00 0.01 0.00 0.00 42.46 41.22 2cqy s ILE 96 CO 0.00 0.34 -0.16 -0.67 0.00 0.00 0.00 174.94 174.45 2cqy n ASP 97 N 4.88 2.13 -4.82 3.58 2.03 -1.26 -4.97 116.55 118.12 2cqy n ASP 97 Ca -0.13 -0.10 -0.38 0.00 0.52 0.00 0.00 54.79 54.70 2cqy n ASP 97 Cb 0.50 -0.20 -0.06 0.00 -0.72 0.00 0.00 41.12 40.64 2cqy n ASP 97 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2cqy s ASN 98 N -6.00 6.97 1.13 1.67 3.84 -1.26 -5.08 114.94 116.21 2cqy s ASN 98 Ca -0.27 1.15 -0.17 0.00 0.21 0.00 0.00 52.86 53.78 2cqy s ASN 98 Cb 0.07 -2.32 0.25 0.00 -0.55 0.00 0.00 41.25 38.71 2cqy s ASN 98 CO 0.53 0.29 1.10 -2.16 -2.79 0.00 0.00 177.10 174.07 2cqy s PRO 99 N -1.13 -0.66 0.28 0.43 0.04 -1.26 -5.09 135.00 127.61 2cqy s PRO 99 Ca 0.27 0.14 -0.16 0.00 0.04 0.00 0.00 61.00 61.29 2cqy s PRO 99 Cb -0.18 -1.64 0.01 0.00 0.04 0.00 0.00 34.50 32.72 2cqy s PRO 99 CO 0.17 -3.38 0.60 -0.98 0.04 0.00 0.00 177.00 173.45 2cqy s ARG 100 N -5.24 1.72 0.06 4.56 1.04 -1.26 -5.18 118.95 114.65 2cqy s ARG 100 Ca 0.69 -1.20 0.09 0.00 -1.04 0.00 0.00 55.73 54.28 2cqy s ARG 100 Cb -0.13 0.54 -0.03 0.00 -2.04 0.00 0.00 34.95 33.29 2cqy s ARG 100 CO 0.57 -0.75 -0.26 -3.38 -0.04 0.00 0.00 175.30 171.43 2cqy s HIS 101 N -3.78 2.34 0.28 5.89 -3.43 -1.26 -5.11 115.29 110.22 2cqy s HIS 101 Ca 0.18 -0.40 -0.29 0.00 -0.80 0.00 0.00 55.06 53.75 2cqy s HIS 101 Cb -0.03 -1.38 -0.10 0.00 -1.43 0.00 0.00 32.58 29.64 2cqy s HIS 101 CO 0.09 0.16 1.31 0.42 -2.00 0.00 0.00 174.74 174.73 2cqy s ILE 102 N -0.85 2.89 0.29 -5.38 1.09 -1.26 -5.03 121.20 112.96 2cqy s ILE 102 Ca 0.12 0.83 0.05 0.00 -1.10 0.00 0.00 60.65 60.55 2cqy s ILE 102 Cb -0.10 -3.53 -0.03 0.00 -1.06 0.00 0.00 42.46 37.74 2cqy s ILE 102 CO 0.03 0.17 0.24 -0.44 -0.10 0.00 0.00 174.94 174.84 2cqy s SER 103 N -0.19 1.23 -0.57 3.58 0.01 -1.26 -5.12 113.70 111.38 2cqy s SER 103 Ca 0.52 -1.65 0.04 0.00 1.31 0.00 0.00 55.95 56.17 2cqy s SER 103 Cb -0.39 0.51 0.16 0.00 0.21 0.00 0.00 66.02 66.51 2cqy s SER 103 CO 0.47 -1.00 0.37 -0.83 0.41 0.00 0.00 173.24 172.66 2cqy s GLY 104 N -3.31 2.29 0.00 3.44 0.00 -1.26 -4.92 107.32 103.56 2cqy s GLY 104 Ca 0.40 -3.25 0.11 0.00 0.00 0.00 0.00 44.72 41.99 2cqy s GLY 104 CO 0.23 1.35 1.11 -1.55 0.00 0.00 0.00 173.10 174.24 2cqy n PRO 105 N 2.64 0.49 -2.61 2.90 -0.04 -1.26 -4.75 135.00 132.37 2cqy n PRO 105 Ca 0.17 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.21 2cqy n PRO 105 Cb 0.37 -1.36 -0.03 0.00 -0.04 0.00 0.00 33.50 32.43 2cqy n PRO 105 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2cqy s SER 106 N -1.87 7.27 0.12 3.54 0.01 -1.26 -5.03 113.70 116.49 2cqy s SER 106 Ca 0.17 1.79 -0.19 0.00 1.31 0.00 0.00 55.95 59.03 2cqy s SER 106 Cb 0.08 -2.57 0.05 0.00 0.21 0.00 0.00 66.02 63.78 2cqy s SER 106 CO 0.13 -0.33 0.47 -0.44 0.41 0.00 0.00 173.24 173.48 2cqy s SER 107 N 1.00 -0.36 0.00 2.44 0.01 -1.26 -5.28 113.70 110.26 2cqy s SER 107 Ca 0.54 -0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.66 2cqy s SER 107 Cb -0.24 0.51 0.00 0.00 0.21 0.00 0.00 66.02 66.50 2cqy s SER 107 CO 0.28 -0.85 0.40 0.61 0.41 0.00 0.00 173.24 174.09