#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 4.52 0.08 1.61 1.04 -1.26 -5.15 113.70 114.54 2cqy s SER 2 Ca 0.00 -1.11 -0.26 0.00 0.48 0.00 0.00 55.95 55.06 2cqy s SER 2 Cb 0.00 -0.25 0.08 0.00 0.10 0.00 0.00 66.02 65.95 2cqy s SER 2 CO 0.00 -0.68 0.80 -0.94 0.98 0.00 0.00 173.24 173.40 2cqy s SER 3 N -4.00 -0.39 0.00 7.02 1.04 -1.26 -5.18 113.70 110.93 2cqy s SER 3 Ca 0.38 -0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.72 2cqy s SER 3 Cb 0.02 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.62 2cqy s SER 3 CO 0.21 -0.81 0.00 0.61 0.98 0.00 0.00 173.24 174.24 2cqy n GLY 4 N -0.33 4.71 3.63 7.32 0.00 -1.26 -5.18 105.19 114.08 2cqy n GLY 4 Ca -0.10 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.25 2cqy n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cqy s SER 5 N 1.45 -0.71 -0.25 1.61 0.15 -1.26 -5.16 113.70 109.53 2cqy s SER 5 Ca 0.00 1.37 -0.06 0.00 0.70 0.00 0.00 55.95 57.96 2cqy s SER 5 Cb 0.00 1.39 0.12 0.00 -1.71 0.00 0.00 66.02 65.83 2cqy s SER 5 CO 0.00 -0.24 0.50 -0.55 1.20 0.00 0.00 173.24 174.16 2cqy s SER 6 N 0.36 -0.59 -0.30 5.45 0.15 -1.26 -5.13 113.70 112.37 2cqy s SER 6 Ca 0.00 1.01 -0.17 0.00 0.70 0.00 0.00 55.95 57.49 2cqy s SER 6 Cb -0.05 1.70 0.18 0.00 -1.71 0.00 0.00 66.02 66.14 2cqy s SER 6 CO 0.00 -0.24 1.20 -0.83 1.20 0.00 0.00 173.24 174.57 2cqy s GLY 7 N 2.72 -0.05 0.14 9.45 0.00 -1.26 -5.18 107.32 113.14 2cqy s GLY 7 Ca 0.03 3.19 -0.18 0.00 0.00 0.00 0.00 44.72 47.77 2cqy s GLY 7 CO -0.16 3.78 0.46 -0.35 0.00 0.00 0.00 173.10 176.82 2cqy s ASP 8 N 2.74 -0.31 -0.21 1.64 2.15 -1.26 -5.15 116.67 116.27 2cqy s ASP 8 Ca -0.06 -0.27 -0.02 0.00 0.43 0.00 0.00 52.55 52.64 2cqy s ASP 8 Cb -0.07 0.51 0.01 0.00 -0.30 0.00 0.00 42.92 43.07 2cqy s ASP 8 CO -0.10 -0.90 -0.10 -0.54 -0.17 0.00 0.00 175.17 173.36 2cqy s LYS 9 N -3.80 3.11 -0.26 4.34 -0.14 -1.26 -4.98 119.74 116.75 2cqy s LYS 9 Ca 0.03 -0.78 -0.12 0.00 -1.36 0.00 0.00 55.97 53.74 2cqy s LYS 9 Cb 0.01 -2.85 -0.12 0.00 -1.68 0.00 0.00 37.83 33.19 2cqy s LYS 9 CO -0.11 -0.25 -0.33 -0.89 -0.76 0.00 0.00 175.35 173.01 2cqy n ILE 10 N 4.70 1.43 -0.98 2.17 5.41 -1.26 -5.01 119.36 125.83 2cqy n ILE 10 Ca -0.19 -0.37 -0.29 0.00 1.00 0.00 0.00 62.75 62.89 2cqy n ILE 10 Cb 0.50 -1.83 0.23 0.00 -0.71 0.00 0.00 39.64 37.82 2cqy n ILE 10 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 2cqy s GLU 11 N -2.48 -0.85 -0.49 0.38 -1.05 -1.26 -4.32 118.70 108.64 2cqy s GLU 11 Ca -0.36 0.24 -0.03 0.00 -0.15 0.00 0.00 54.97 54.67 2cqy s GLU 11 Cb 0.14 -1.61 0.00 0.00 -0.44 0.00 0.00 34.13 32.22 2cqy s GLU 11 CO 0.46 -3.53 0.43 0.45 0.95 0.00 0.00 175.26 174.03 2cqy n SER 12 N -4.68 -3.54 -3.23 0.83 2.88 -1.26 -4.97 113.62 99.64 2cqy n SER 12 Ca 0.09 -0.20 -0.35 0.00 -1.33 0.00 0.00 58.87 57.08 2cqy n SER 12 Cb 0.58 -2.15 0.00 0.00 -0.75 0.00 0.00 64.21 61.89 2cqy n SER 12 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2cqy n LYS 13 N -2.15 4.26 -3.15 -1.46 5.02 -1.26 -5.00 118.16 114.42 2cqy n LYS 13 Ca -0.00 -4.56 -0.42 0.00 -2.02 0.00 0.00 58.31 51.30 2cqy n LYS 13 Cb 0.52 -2.35 -0.07 0.00 -0.02 0.00 0.00 35.03 33.11 2cqy n LYS 13 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2cqy s LEU 14 N -3.98 4.42 -0.29 -0.35 1.43 -1.26 -5.00 118.68 113.65 2cqy s LEU 14 Ca 0.45 -0.15 -0.24 0.00 -1.03 0.00 0.00 54.13 53.16 2cqy s LEU 14 Cb 0.27 -2.69 0.15 0.00 0.03 0.00 0.00 46.19 43.94 2cqy s LEU 14 CO -0.18 -0.65 1.16 -1.48 0.23 0.00 0.00 176.35 175.43 2cqy s LEU 15 N 2.66 -0.32 -0.66 1.79 2.34 -1.26 -5.11 118.68 118.12 2cqy s LEU 15 Ca 0.22 0.60 -0.02 0.00 0.06 0.00 0.00 54.13 54.98 2cqy s LEU 15 Cb -0.15 1.60 0.17 0.00 -0.56 0.00 0.00 46.19 47.25 2cqy s LEU 15 CO 0.16 -0.10 0.48 0.00 -1.06 0.00 0.00 176.35 175.83 2cqy s ALA 16 N 0.33 3.66 -0.13 1.48 0.00 -1.26 -5.02 121.76 120.82 2cqy s ALA 16 Ca 0.03 -3.35 -0.04 0.00 0.00 0.00 0.00 51.96 48.59 2cqy s ALA 16 Cb -0.05 -2.67 0.05 0.00 0.00 0.00 0.00 23.12 20.45 2cqy s ALA 16 CO -0.10 -2.12 0.08 0.15 0.00 0.00 0.00 175.76 173.77 2cqy s LYS 17 N -0.25 0.02 -0.08 0.00 -0.14 -1.26 -5.12 119.74 112.90 2cqy s LYS 17 Ca 0.18 0.06 -0.03 0.00 -1.36 0.00 0.00 55.97 54.82 2cqy s LYS 17 Cb -0.19 -1.43 0.05 0.00 -1.68 0.00 0.00 37.83 34.58 2cqy s LYS 17 CO -0.04 -0.57 0.16 0.15 -0.76 0.00 0.00 175.35 174.29 2cqy s LYS 18 N 2.15 0.03 -0.26 1.68 -0.14 -1.26 -5.13 119.74 116.81 2cqy s LYS 18 Ca 0.03 0.55 0.00 0.00 -1.36 0.00 0.00 55.97 55.19 2cqy s LYS 18 Cb -0.15 -0.28 0.04 0.00 -1.68 0.00 0.00 37.83 35.77 2cqy s LYS 18 CO -0.07 -0.30 -0.07 0.00 -0.76 0.00 0.00 175.35 174.14 2cqy s ALA 19 N 2.26 2.65 0.01 5.17 0.00 -1.26 -5.11 121.76 125.48 2cqy s ALA 19 Ca 0.03 -1.61 -0.01 0.00 0.00 0.00 0.00 51.96 50.36 2cqy s ALA 19 Cb -0.12 -1.67 -0.04 0.00 0.00 0.00 0.00 23.12 21.29 2cqy s ALA 19 CO -0.06 -1.01 0.16 -2.00 0.00 0.00 0.00 175.76 172.86 2cqy s GLU 20 N 1.23 3.33 0.32 0.00 2.12 -1.26 -5.11 118.70 119.33 2cqy s GLU 20 Ca -0.04 -0.40 0.00 0.00 0.36 0.00 0.00 54.97 54.90 2cqy s GLU 20 Cb -0.18 -3.02 -0.04 0.00 0.26 0.00 0.00 34.13 31.16 2cqy s GLU 20 CO -0.05 0.65 0.52 0.54 -0.54 0.00 0.00 175.26 176.38 2cqy s VAL 21 N -1.34 5.12 0.46 3.70 0.11 -1.26 -5.04 120.40 122.15 2cqy s VAL 21 Ca 0.28 -0.44 -0.20 0.00 -2.93 0.00 0.00 61.98 58.69 2cqy s VAL 21 Cb -0.13 -3.84 -0.13 0.00 -1.53 0.00 0.00 36.38 30.75 2cqy s VAL 21 CO 0.20 -0.49 0.24 0.59 -3.33 0.00 0.00 175.10 172.31 2cqy n ASN 22 N -1.57 -2.19 -4.49 3.54 3.02 -1.26 -4.99 115.26 107.31 2cqy n ASN 22 Ca -0.05 0.79 -0.24 0.00 -0.03 0.00 0.00 54.58 55.05 2cqy n ASN 22 Cb 0.56 -0.99 -0.10 0.00 -0.61 0.00 0.00 39.78 38.64 2cqy n ASN 22 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2cqy s THR 23 N -1.71 2.62 -0.25 3.41 -4.23 -1.26 -4.97 115.64 109.25 2cqy s THR 23 Ca 0.62 -2.28 -0.10 0.00 -1.18 0.00 0.00 61.69 58.74 2cqy s THR 23 Cb -0.56 -2.37 -0.05 0.00 1.34 0.00 0.00 72.50 70.87 2cqy s THR 23 CO 0.61 -0.36 0.16 -0.63 -0.54 0.00 0.00 174.62 173.86 2cqy s ILE 24 N -2.38 5.32 -2.00 2.99 1.01 -1.25 -4.96 121.20 119.93 2cqy s ILE 24 Ca 0.29 0.17 0.13 0.00 0.00 0.00 0.00 60.65 61.23 2cqy s ILE 24 Cb -0.06 -3.49 0.36 0.00 0.01 0.00 0.00 42.46 39.28 2cqy s ILE 24 CO 0.15 0.33 1.18 -0.81 0.00 0.00 0.00 174.94 175.78 2cqy n PRO 25 N 4.46 0.49 0.00 2.79 -0.04 -1.26 -4.71 135.00 136.72 2cqy n PRO 25 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 2cqy n PRO 25 Cb 0.52 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.58 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 4.05 3.25 0.55 0.00 -1.26 -4.95 105.19 106.81 2cqy n GLY 26 Ca 0.09 -0.73 -0.35 0.00 0.00 0.00 0.00 46.02 45.03 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 0.00 3.11 -0.12 1.61 5.36 -1.22 -4.96 117.98 121.76 2cqy s PHE 27 Ca 0.00 -1.36 0.07 0.00 -0.96 0.00 0.00 56.93 54.68 2cqy s PHE 27 Cb 0.00 -2.13 -0.24 0.00 -0.34 0.00 0.00 43.02 40.31 2cqy s PHE 27 CO 0.00 -0.68 0.38 -0.40 -1.46 0.00 0.00 175.22 173.06 2cqy n ASP 28 N 4.74 1.20 -3.13 6.13 5.75 -1.26 -3.84 116.55 126.13 2cqy n ASP 28 Ca -0.16 0.23 -0.36 0.00 -0.01 0.00 0.00 54.79 54.49 2cqy n ASP 28 Cb 0.47 -0.14 -0.10 0.00 -1.03 0.00 0.00 41.12 40.32 2cqy n ASP 28 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2cqy n GLY 29 N 1.79 -0.23 3.67 6.12 0.00 -1.26 -4.75 105.19 110.53 2cqy n GLY 29 Ca -0.27 0.82 -0.45 0.00 0.00 0.00 0.00 46.02 46.12 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 5.01 1.15 -2.50 1.61 3.14 -1.26 -4.76 118.33 120.71 2cqy n VAL 30 Ca 0.43 -0.29 -0.35 0.00 -2.96 0.00 0.00 64.34 61.17 2cqy n VAL 30 Cb -0.00 -1.44 -0.03 0.00 -1.06 0.00 0.00 33.84 31.30 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 -0.26 3.66 -0.21 1.55 1.01 -1.16 -4.98 120.40 120.00 2cqy s VAL 31 Ca 0.66 1.16 0.01 0.00 0.00 0.00 0.00 61.98 63.81 2cqy s VAL 31 Cb -0.65 -3.54 -0.20 0.00 0.00 0.00 0.00 36.38 31.99 2cqy s VAL 31 CO 0.52 -0.10 -0.03 0.29 0.00 0.00 0.00 175.10 175.77 2cqy n LYS 32 N -0.53 0.68 -4.03 2.72 4.76 -1.26 -4.45 118.16 116.06 2cqy n LYS 32 Ca 0.07 0.17 -0.11 0.00 -2.87 0.00 0.00 58.31 55.58 2cqy n LYS 32 Cb 0.51 -1.58 -0.05 0.00 -1.84 0.00 0.00 35.03 32.07 2cqy n LYS 32 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2cqy s ASP 33 N -6.58 0.20 0.15 4.39 1.11 -1.26 -5.05 116.67 109.62 2cqy s ASP 33 Ca -0.29 -1.12 -0.17 0.00 0.18 0.00 0.00 52.55 51.14 2cqy s ASP 33 Cb 0.08 0.61 0.02 0.00 1.07 0.00 0.00 42.92 44.70 2cqy s ASP 33 CO 0.66 -1.19 1.76 0.00 1.18 0.00 0.00 175.17 177.58 2cqy h ALA 34 N 2.23 0.37 -0.11 5.23 0.00 -1.94 -1.54 119.26 123.49 2cqy h ALA 34 Ca -0.28 0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.71 2cqy h ALA 34 Cb 1.25 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.97 2cqy h ALA 34 CO 0.38 -0.27 -0.29 1.05 0.00 0.00 0.00 179.25 180.12 2cqy h GLU 35 N 0.27 -0.36 -0.25 0.00 4.11 -1.98 -0.05 114.58 116.32 2cqy h GLU 35 Ca 0.14 0.02 0.04 0.00 0.07 0.00 0.00 59.36 59.63 2cqy h GLU 35 Cb 0.09 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2cqy h GLU 35 CO -0.13 -0.24 0.17 1.49 0.07 0.00 0.00 179.01 180.37 2cqy h GLU 36 N -0.37 0.17 -0.11 1.06 4.57 -1.92 -0.68 114.58 117.30 2cqy h GLU 36 Ca 0.09 -0.01 -0.09 0.00 -1.18 0.00 0.00 59.36 58.17 2cqy h GLU 36 Cb 0.51 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.05 2cqy h GLU 36 CO -0.32 0.11 -0.33 0.00 -1.18 0.00 0.00 179.01 177.28 2cqy h ALA 37 N 1.87 1.24 -0.04 2.92 0.00 -0.00 -2.23 119.26 123.01 2cqy h ALA 37 Ca 0.11 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 2cqy h ALA 37 Cb 0.21 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2cqy h ALA 37 CO -0.02 0.52 -0.13 0.28 0.00 0.00 0.00 179.25 179.90 2cqy h VAL 38 N 0.19 1.47 0.39 0.00 2.07 -0.08 -2.15 116.25 118.13 2cqy h VAL 38 Ca 0.02 -1.56 -0.01 0.00 0.82 0.00 0.00 66.70 65.97 2cqy h VAL 38 Cb 0.69 2.40 -0.01 0.00 -1.52 0.00 0.00 31.29 32.85 2cqy h VAL 38 CO 0.05 0.43 -0.25 0.03 0.02 0.00 0.00 177.57 177.84 2cqy h ARG 39 N -0.41 -0.60 0.11 1.57 3.08 -1.42 -0.75 114.38 115.96 2cqy h ARG 39 Ca -0.01 0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.10 2cqy h ARG 39 Cb 0.76 0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.92 2cqy h ARG 39 CO 0.03 -0.40 -0.23 0.82 -1.07 0.00 0.00 179.97 179.12 2cqy h ILE 40 N -0.62 0.49 -0.69 2.04 2.04 -1.51 -2.40 117.51 116.86 2cqy h ILE 40 Ca -0.04 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.96 2cqy h ILE 40 Cb 0.52 0.49 -0.10 0.00 -0.74 0.00 0.00 36.82 36.99 2cqy h ILE 40 CO 0.03 0.00 0.20 0.00 0.00 0.00 0.00 178.15 178.38 2cqy h ALA 41 N 0.35 0.89 -0.51 1.87 0.00 -1.30 0.20 119.26 120.77 2cqy h ALA 41 Ca 0.03 0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.17 2cqy h ALA 41 Cb 0.45 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 2cqy h ALA 41 CO -0.13 -0.28 0.35 0.00 0.00 0.00 0.00 179.25 179.18 2cqy h ARG 42 N 0.33 0.24 -0.14 0.00 3.08 -0.65 -1.18 114.38 116.06 2cqy h ARG 42 Ca 0.38 -0.01 -0.21 0.00 0.07 0.00 0.00 59.98 60.20 2cqy h ARG 42 Cb 0.58 -0.06 0.01 0.00 0.08 0.00 0.00 29.97 30.59 2cqy h ARG 42 CO -0.43 0.16 -0.72 0.93 -1.07 0.00 0.00 179.97 178.84 2cqy h GLU 43 N 0.25 0.73 -0.83 0.04 5.08 -0.22 -3.22 114.58 116.41 2cqy h GLU 43 Ca 0.23 -0.60 -0.02 0.00 -1.00 0.00 0.00 59.36 57.98 2cqy h GLU 43 Cb 0.59 0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.93 2cqy h GLU 43 CO -0.05 1.21 0.45 0.82 -1.00 0.00 0.00 179.01 180.44 2cqy h ILE 44 N 0.44 1.24 -0.26 3.13 2.04 -0.48 -3.41 117.51 120.21 2cqy h ILE 44 Ca -0.05 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.20 2cqy h ILE 44 Cb 1.35 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 2cqy h ILE 44 CO 0.15 0.27 0.00 0.61 0.00 0.00 0.00 178.15 179.18 2cqy n GLY 45 N -1.15 -0.35 3.27 5.37 0.00 -0.75 -3.97 105.19 107.61 2cqy n GLY 45 Ca 0.09 -0.72 -0.37 0.00 0.00 0.00 0.00 46.02 45.01 2cqy n GLY 45 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2cqy n TYR 46 N 0.26 -2.63 -1.40 1.61 4.02 -1.26 -4.63 117.16 113.13 2cqy n TYR 46 Ca 0.00 0.32 -0.32 0.00 -0.01 0.00 0.00 57.90 57.90 2cqy n TYR 46 Cb 0.00 -1.72 0.08 0.00 -0.02 0.00 0.00 39.34 37.68 2cqy n TYR 46 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 2cqy s PRO 47 N -1.79 2.40 -0.07 -0.72 0.04 -1.26 -5.01 135.00 128.59 2cqy s PRO 47 Ca 0.57 1.23 -0.00 0.00 0.04 0.00 0.00 61.00 62.84 2cqy s PRO 47 Cb -0.39 -1.91 0.02 0.00 0.04 0.00 0.00 34.50 32.27 2cqy s PRO 47 CO 0.66 -1.54 -0.03 0.14 0.04 0.00 0.00 177.00 176.28 2cqy s VAL 48 N -2.74 0.55 0.05 -0.36 -7.23 0.22 -2.34 120.40 108.55 2cqy s VAL 48 Ca 0.63 -0.04 -0.27 0.00 -1.81 0.00 0.00 61.98 60.49 2cqy s VAL 48 Cb -0.18 -0.64 -0.05 0.00 0.56 0.00 0.00 36.38 36.07 2cqy s VAL 48 CO 0.52 0.27 0.84 -0.32 -0.31 0.00 0.00 175.10 176.09 2cqy s MET 49 N 1.53 4.55 -0.26 4.82 1.75 -0.12 -1.08 119.30 130.48 2cqy s MET 49 Ca -0.01 1.19 -0.01 0.00 -1.25 0.00 0.00 55.69 55.61 2cqy s MET 49 Cb -0.13 -3.38 0.03 0.00 2.84 0.00 0.00 34.83 34.19 2cqy s MET 49 CO -0.04 0.21 -0.05 0.42 -0.65 0.00 0.00 175.02 174.91 2cqy s ILE 50 N 0.15 2.86 0.39 10.11 1.01 -0.63 -1.46 121.20 133.64 2cqy s ILE 50 Ca 0.42 -1.15 0.08 0.00 0.00 0.00 0.00 60.65 60.00 2cqy s ILE 50 Cb -0.21 -2.51 -0.06 0.00 0.01 0.00 0.00 42.46 39.69 2cqy s ILE 50 CO 0.25 0.11 0.12 -0.54 0.00 0.00 0.00 174.94 174.88 2cqy s LYS 51 N 1.29 2.16 -0.41 2.79 3.01 -0.87 -2.93 119.74 124.79 2cqy s LYS 51 Ca -0.02 -1.85 -0.21 0.00 -1.01 0.00 0.00 55.97 52.88 2cqy s LYS 51 Cb -0.18 -1.93 0.02 0.00 -1.01 0.00 0.00 37.83 34.73 2cqy s LYS 51 CO -0.04 -0.04 0.68 0.00 0.51 0.00 0.00 175.35 176.46 2cqy s ALA 52 N -2.59 3.38 0.31 5.17 0.00 -1.26 0.13 121.76 126.90 2cqy s ALA 52 Ca 0.39 -1.00 0.09 0.00 0.00 0.00 0.00 51.96 51.43 2cqy s ALA 52 Cb 0.04 -3.29 0.87 0.00 0.00 0.00 0.00 23.12 20.73 2cqy s ALA 52 CO 0.21 -1.63 1.71 1.03 0.00 0.00 0.00 175.76 177.08 2cqy h SER 53 N 8.72 0.56 -0.83 0.00 0.87 -1.60 0.72 113.55 121.99 2cqy h SER 53 Ca -0.26 0.15 0.21 0.00 -1.23 0.00 0.00 61.79 60.66 2cqy h SER 53 Cb 1.10 0.07 -0.14 0.00 -0.44 0.00 0.00 62.40 63.00 2cqy h SER 53 CO 0.89 0.04 0.12 0.00 -0.53 0.00 0.00 176.83 177.35 2cqy h ALA 54 N 1.74 1.04 0.00 6.23 0.00 -1.89 -3.40 119.26 122.98 2cqy h ALA 54 Ca 0.63 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.78 2cqy h ALA 54 Cb 1.24 0.37 0.00 0.00 0.00 0.00 0.00 17.79 19.40 2cqy h ALA 54 CO -0.51 -0.44 0.00 0.41 0.00 0.00 0.00 179.25 178.71 2cqy n GLY 55 N -1.40 -0.21 7.00 0.00 0.00 0.18 -5.02 105.19 105.74 2cqy n GLY 55 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 2.18 0.45 0.00 -0.02 0.00 0.23 -4.94 105.19 103.09 2cqy n GLY 56 Ca 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.10 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 2.90 0.00 -0.02 0.00 -1.26 -4.67 105.19 102.14 2cqy n GLY 57 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.08 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 0.67 0.63 -0.02 0.00 -1.26 -5.07 105.19 100.13 2cqy n GLY 58 Ca 0.00 -0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.78 2cqy n GLY 58 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2cqy n LYS 59 N 0.00 0.25 -2.68 1.61 0.00 -1.26 -4.87 118.16 111.20 2cqy n LYS 59 Ca 0.00 0.11 -0.08 0.00 0.00 0.00 0.00 58.31 58.34 2cqy n LYS 59 Cb 0.00 -0.93 0.03 0.00 0.00 0.00 0.00 35.03 34.14 2cqy n LYS 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2cqy n GLY 60 N 2.35 2.18 4.02 3.14 0.00 -1.26 -5.10 105.19 110.51 2cqy n GLY 60 Ca -0.19 -1.38 -0.21 0.00 0.00 0.00 0.00 46.02 44.24 2cqy n GLY 60 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2cqy s MET 61 N -3.43 2.28 0.17 1.61 0.23 -1.26 -5.04 119.30 113.85 2cqy s MET 61 Ca 0.30 -1.72 0.08 0.00 -1.03 0.00 0.00 55.69 53.32 2cqy s MET 61 Cb 0.40 -2.56 -0.04 0.00 -1.53 0.00 0.00 34.83 31.10 2cqy s MET 61 CO -0.01 -0.85 -0.17 0.50 -2.03 0.00 0.00 175.02 172.46 2cqy s ARG 62 N -4.63 1.26 0.08 3.16 3.52 -1.15 -5.05 118.95 116.14 2cqy s ARG 62 Ca 0.58 -1.43 0.09 0.00 -0.13 0.00 0.00 55.73 54.84 2cqy s ARG 62 Cb -0.05 -1.21 -0.03 0.00 -1.56 0.00 0.00 34.95 32.09 2cqy s ARG 62 CO 0.37 0.23 -0.23 0.42 -0.81 0.00 0.00 175.30 175.28 2cqy s ILE 63 N -2.32 2.44 0.10 4.11 1.01 -1.26 -1.60 121.20 123.68 2cqy s ILE 63 Ca 0.17 -1.47 0.10 0.00 0.00 0.00 0.00 60.65 59.45 2cqy s ILE 63 Cb -0.04 -2.04 -0.04 0.00 0.01 0.00 0.00 42.46 40.36 2cqy s ILE 63 CO 0.06 0.23 -0.26 0.00 0.00 0.00 0.00 174.94 174.97 2cqy s ALA 64 N -0.96 2.34 -0.01 9.38 0.00 -0.24 -4.94 121.76 127.32 2cqy s ALA 64 Ca 0.14 -1.39 0.00 0.00 0.00 0.00 0.00 51.96 50.72 2cqy s ALA 64 Cb -0.10 -0.43 -0.01 0.00 0.00 0.00 0.00 23.12 22.58 2cqy s ALA 64 CO 0.05 0.54 0.01 0.91 0.00 0.00 0.00 175.76 177.28 2cqy n TRP 65 N 1.25 0.00 -4.05 0.00 7.02 -1.26 -0.61 117.44 119.79 2cqy n TRP 65 Ca -0.17 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.21 2cqy n TRP 65 Cb 0.53 -0.00 -0.07 0.00 -2.42 0.00 0.00 31.31 29.35 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 -1.45 -0.03 0.16 -0.99 1.01 -1.26 -4.77 116.67 109.34 2cqy s ASP 66 Ca 0.00 -1.05 -0.19 0.00 0.71 0.00 0.00 52.55 52.02 2cqy s ASP 66 Cb 0.00 0.53 0.06 0.00 1.01 0.00 0.00 42.92 44.52 2cqy s ASP 66 CO 0.02 -1.06 1.66 -2.24 0.21 0.00 0.00 175.17 173.76 2cqy h ASP 67 N 2.36 -0.46 -0.87 0.27 3.04 -1.97 0.23 116.42 119.02 2cqy h ASP 67 Ca -0.29 0.12 0.13 0.00 -3.24 0.00 0.00 57.03 53.75 2cqy h ASP 67 Cb 1.25 0.27 -0.09 0.00 -1.04 0.00 0.00 39.33 39.72 2cqy h ASP 67 CO 0.40 -0.17 0.48 1.05 -2.04 0.00 0.00 179.24 178.96 2cqy h GLU 68 N -0.08 0.71 -0.24 4.15 4.11 -2.00 -0.81 114.58 120.42 2cqy h GLU 68 Ca 0.16 -0.04 -0.16 0.00 0.07 0.00 0.00 59.36 59.39 2cqy h GLU 68 Cb 0.33 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2cqy h GLU 68 CO -0.38 0.47 -0.51 0.93 0.07 0.00 0.00 179.01 179.59 2cqy h GLU 69 N 0.73 0.67 0.26 1.06 5.08 -1.62 -2.72 114.58 118.05 2cqy h GLU 69 Ca 0.45 -0.41 0.01 0.00 -1.00 0.00 0.00 59.36 58.41 2cqy h GLU 69 Cb 0.55 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 2cqy h GLU 69 CO -0.31 1.02 -0.37 1.15 -1.00 0.00 0.00 179.01 179.50 2cqy h THR 70 N 0.53 0.24 0.79 1.13 2.02 0.84 0.15 112.91 118.61 2cqy h THR 70 Ca 0.02 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.16 2cqy h THR 70 Cb 1.07 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 2cqy h THR 70 CO 0.10 0.00 -0.42 0.03 0.37 0.00 0.00 175.52 175.60 2cqy h ARG 71 N -0.69 -1.08 -0.73 6.66 3.08 -1.46 0.37 114.38 120.54 2cqy h ARG 71 Ca -0.00 0.07 0.16 0.00 0.07 0.00 0.00 59.98 60.28 2cqy h ARG 71 Cb 0.66 0.24 -0.13 0.00 0.08 0.00 0.00 29.97 30.83 2cqy h ARG 71 CO -0.13 -0.72 0.00 -0.44 -1.07 0.00 0.00 179.97 177.62 2cqy h ASP 72 N -1.12 -0.34 -0.12 7.04 5.19 -1.42 0.23 116.42 125.88 2cqy h ASP 72 Ca -0.11 0.19 -0.15 0.00 -0.62 0.00 0.00 57.03 56.35 2cqy h ASP 72 Cb 0.88 0.33 -0.01 0.00 0.18 0.00 0.00 39.33 40.71 2cqy h ASP 72 CO 0.15 -0.17 -0.43 1.23 -3.12 0.00 0.00 179.24 176.90 2cqy h GLY 73 N 0.10 0.72 0.95 2.75 0.00 -0.51 -2.76 103.07 104.33 2cqy h GLY 73 Ca 0.39 -0.75 -0.03 0.00 0.00 0.00 0.00 47.33 46.94 2cqy h GLY 73 CO -0.64 0.67 0.15 -2.75 0.00 0.00 0.00 176.54 173.98 2cqy h PHE 74 N 0.54 0.69 -0.67 5.60 3.04 0.21 0.36 116.94 126.70 2cqy h PHE 74 Ca 0.04 -0.06 -0.01 0.00 3.98 0.00 0.00 57.97 61.91 2cqy h PHE 74 Cb 0.96 -0.20 -0.03 0.00 2.56 0.00 0.00 35.95 39.24 2cqy h PHE 74 CO 0.05 0.61 0.36 0.00 -2.02 0.00 0.00 178.31 177.30 2cqy h ARG 75 N 0.56 0.93 0.32 1.11 3.08 -0.65 -1.13 114.38 118.60 2cqy h ARG 75 Ca 0.14 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 2cqy h ARG 75 Cb 0.23 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2cqy h ARG 75 CO -0.01 0.71 -0.15 -0.07 -1.07 0.00 0.00 179.97 179.38 2cqy h LEU 76 N 0.91 -0.36 -1.79 3.04 3.38 -1.30 -3.01 115.31 116.18 2cqy h LEU 76 Ca 0.23 0.01 0.36 0.00 0.09 0.00 0.00 57.88 58.57 2cqy h LEU 76 Cb 0.05 0.09 -0.07 0.00 0.09 0.00 0.00 40.66 40.83 2cqy h LEU 76 CO -0.04 0.04 0.86 0.28 0.09 0.00 0.00 178.44 179.67 2cqy h SER 77 N -1.02 0.13 0.12 -0.43 0.02 -0.33 0.11 113.55 112.15 2cqy h SER 77 Ca -0.04 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 2cqy h SER 77 Cb 0.33 0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.89 2cqy h SER 77 CO 0.07 0.00 -0.06 0.28 -1.14 0.00 0.00 176.83 175.99 2cqy h SER 78 N 0.10 -0.14 -0.64 3.07 0.02 -1.23 -2.80 113.55 111.93 2cqy h SER 78 Ca 0.63 -0.26 0.13 0.00 -0.84 0.00 0.00 61.79 61.45 2cqy h SER 78 Cb 2.26 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 64.80 2cqy h SER 78 CO -0.12 0.20 0.44 1.56 -1.14 0.00 0.00 176.83 177.77 2cqy h GLN 79 N -0.49 0.31 0.52 3.45 4.20 -0.65 -1.93 115.11 120.53 2cqy h GLN 79 Ca -0.02 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 2cqy h GLN 79 Cb 0.39 -0.07 0.01 0.00 0.30 0.00 0.00 27.48 28.11 2cqy h GLN 79 CO 0.03 0.21 -0.25 0.93 -0.67 0.00 0.00 178.83 179.08 2cqy h GLU 80 N 0.32 -0.67 -0.91 1.46 5.08 -1.26 -3.14 114.58 115.46 2cqy h GLU 80 Ca 0.31 0.05 0.21 0.00 -1.00 0.00 0.00 59.36 58.92 2cqy h GLU 80 Cb 0.76 0.15 -0.12 0.00 0.50 0.00 0.00 28.75 30.04 2cqy h GLU 80 CO -0.08 -0.45 0.45 0.00 -1.00 0.00 0.00 179.01 177.93 2cqy h ALA 81 N -1.57 1.48 -1.01 3.43 0.00 -1.23 0.38 119.26 120.74 2cqy h ALA 81 Ca -0.07 0.14 0.27 0.00 0.00 0.00 0.00 54.91 55.25 2cqy h ALA 81 Cb 0.53 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.35 2cqy h ALA 81 CO 0.12 -0.27 0.70 0.00 0.00 0.00 0.00 179.25 179.80 2cqy h ALA 82 N 1.68 2.65 0.02 0.00 0.00 -0.08 -1.52 119.26 122.02 2cqy h ALA 82 Ca 0.56 -0.00 -0.38 0.00 0.00 0.00 0.00 54.91 55.08 2cqy h ALA 82 Cb 1.00 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.79 2cqy h ALA 82 CO -0.48 -0.97 -2.18 0.45 0.00 0.00 0.00 179.25 176.06 2cqy n SER 83 N -4.38 1.98 -0.06 0.00 2.88 0.10 -2.92 113.62 111.22 2cqy n SER 83 Ca 0.22 0.19 -0.07 0.00 -1.33 0.00 0.00 58.87 57.88 2cqy n SER 83 Cb 0.97 -0.74 -0.05 0.00 -0.75 0.00 0.00 64.21 63.64 2cqy n SER 83 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2cqy h SER 84 N -0.51 -0.96 0.00 -3.46 0.87 -0.10 -3.36 113.55 106.02 2cqy h SER 84 Ca -0.55 0.12 -0.31 0.00 -1.23 0.00 0.00 61.79 59.83 2cqy h SER 84 Cb 1.72 0.39 -0.05 0.00 -0.44 0.00 0.00 62.40 64.02 2cqy h SER 84 CO -0.19 -0.22 -2.08 0.49 -0.53 0.00 0.00 176.83 174.30 2cqy n PHE 85 N -4.09 0.00 0.00 2.24 3.01 -0.65 -5.05 117.46 112.92 2cqy n PHE 85 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 2cqy n PHE 85 Cb 0.18 -0.71 0.00 0.00 -0.01 0.00 0.00 39.48 38.95 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 2.14 1.38 3.94 1.37 0.00 -0.72 -5.03 105.19 108.26 2cqy n GLY 86 Ca -0.36 -0.06 -0.25 0.00 0.00 0.00 0.00 46.02 45.35 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 6.35 -0.38 1.61 1.01 -1.24 -4.51 116.67 119.51 2cqy s ASP 87 Ca 0.00 0.37 0.07 0.00 0.71 0.00 0.00 52.55 53.70 2cqy s ASP 87 Cb 0.00 -1.99 0.68 0.00 1.01 0.00 0.00 42.92 42.62 2cqy s ASP 87 CO 0.00 -0.13 1.82 -0.90 0.21 0.00 0.00 175.17 176.17 2cqy n ASP 88 N -1.15 4.07 -4.77 0.27 5.75 -1.26 -0.64 116.55 118.83 2cqy n ASP 88 Ca -0.05 -3.46 -0.37 0.00 -0.01 0.00 0.00 54.79 50.90 2cqy n ASP 88 Cb 0.55 -0.78 0.01 0.00 -1.03 0.00 0.00 41.12 39.87 2cqy n ASP 88 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2cqy s ARG 89 N -3.17 3.45 0.31 0.11 1.81 -1.26 -4.73 118.95 115.47 2cqy s ARG 89 Ca 0.55 1.81 0.04 0.00 -1.72 0.00 0.00 55.73 56.40 2cqy s ARG 89 Cb 0.45 -2.21 -0.04 0.00 -0.45 0.00 0.00 34.95 32.71 2cqy s ARG 89 CO 0.11 -0.82 0.18 -0.51 -0.68 0.00 0.00 175.30 173.58 2cqy s LEU 90 N -3.45 1.68 0.11 2.53 1.43 -1.26 -2.26 118.68 117.46 2cqy s LEU 90 Ca 0.69 -1.59 -0.06 0.00 -1.03 0.00 0.00 54.13 52.14 2cqy s LEU 90 Cb -0.29 0.25 -0.02 0.00 0.03 0.00 0.00 46.19 46.16 2cqy s LEU 90 CO 0.34 -0.92 0.15 -0.76 0.23 0.00 0.00 176.35 175.39 2cqy s LEU 91 N -3.38 1.56 -0.05 1.79 1.43 0.34 -2.97 118.68 117.40 2cqy s LEU 91 Ca 0.36 -0.87 -0.02 0.00 -1.03 0.00 0.00 54.13 52.57 2cqy s LEU 91 Cb 0.04 0.80 0.03 0.00 0.03 0.00 0.00 46.19 47.10 2cqy s LEU 91 CO 0.19 -0.75 0.08 -0.63 0.23 0.00 0.00 176.35 175.47 2cqy s ILE 92 N -3.93 -0.14 0.00 -0.59 1.01 -1.25 -2.06 121.20 114.25 2cqy s ILE 92 Ca 0.12 0.41 0.02 0.00 0.00 0.00 0.00 60.65 61.20 2cqy s ILE 92 Cb 0.05 -0.18 -0.01 0.00 0.01 0.00 0.00 42.46 42.34 2cqy s ILE 92 CO -0.06 0.17 -0.06 -1.61 0.00 0.00 0.00 174.94 173.38 2cqy s GLU 93 N 2.19 0.50 0.04 2.79 2.02 -0.53 -3.39 118.70 122.32 2cqy s GLU 93 Ca 0.05 -0.28 -0.36 0.00 0.02 0.00 0.00 54.97 54.39 2cqy s GLU 93 Cb -0.12 -0.47 -0.16 0.00 0.10 0.00 0.00 34.13 33.49 2cqy s GLU 93 CO -0.04 0.12 1.48 1.17 0.02 0.00 0.00 175.26 178.02 2cqy n LYS 94 N 2.76 1.41 -3.17 1.61 3.00 -1.26 -0.95 118.16 121.57 2cqy n LYS 94 Ca -0.14 0.51 -0.44 0.00 -0.00 0.00 0.00 58.31 58.25 2cqy n LYS 94 Cb 0.58 -2.20 -0.07 0.00 0.00 0.00 0.00 35.03 33.34 2cqy n LYS 94 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.40 177.52 2cqy s PHE 95 N 1.21 3.06 -0.37 5.64 2.19 -0.99 -4.73 117.98 123.99 2cqy s PHE 95 Ca 0.86 -0.45 0.04 0.00 0.33 0.00 0.00 56.93 57.71 2cqy s PHE 95 Cb -0.90 -3.44 0.11 0.00 -1.31 0.00 0.00 43.02 37.48 2cqy s PHE 95 CO 0.48 -0.97 0.09 0.42 1.83 0.00 0.00 175.22 177.07 2cqy s ILE 96 N 2.60 2.21 -0.11 3.12 1.01 -1.26 -4.53 121.20 124.25 2cqy s ILE 96 Ca 0.16 -2.45 0.00 0.00 0.00 0.00 0.00 60.65 58.36 2cqy s ILE 96 Cb -0.18 -2.62 0.11 0.00 0.01 0.00 0.00 42.46 39.77 2cqy s ILE 96 CO 0.13 -0.65 1.62 -0.67 0.00 0.00 0.00 174.94 175.37 2cqy n ASP 97 N 4.08 4.55 -3.49 3.58 2.03 -1.26 -4.81 116.55 121.23 2cqy n ASP 97 Ca 0.04 -2.50 -0.13 0.00 0.52 0.00 0.00 54.79 52.72 2cqy n ASP 97 Cb 0.40 -0.85 -0.03 0.00 -0.72 0.00 0.00 41.12 39.92 2cqy n ASP 97 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 2cqy s ASN 98 N 0.94 -0.50 0.00 1.67 0.01 -1.26 -5.02 114.94 110.77 2cqy s ASN 98 Ca 0.12 0.07 0.15 0.00 -0.71 0.00 0.00 52.86 52.49 2cqy s ASN 98 Cb 0.09 0.55 0.82 0.00 0.41 0.00 0.00 41.25 43.13 2cqy s ASN 98 CO 0.01 -0.86 1.38 -0.81 -1.51 0.00 0.00 177.10 175.31 2cqy n PRO 99 N -0.06 0.32 -1.40 -0.60 -0.04 -1.26 -4.86 135.00 127.10 2cqy n PRO 99 Ca -0.17 0.09 -0.40 0.00 -0.04 0.00 0.00 63.50 62.97 2cqy n PRO 99 Cb 0.63 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.60 2cqy n PRO 99 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2cqy n ARG 100 N -1.17 0.37 -3.80 0.54 0.63 -1.26 -5.00 116.66 106.97 2cqy n ARG 100 Ca 0.09 0.14 -0.13 0.00 -0.92 0.00 0.00 57.85 57.03 2cqy n ARG 100 Cb 0.09 -1.39 -0.10 0.00 0.45 0.00 0.00 32.46 31.52 2cqy n ARG 100 CO 0.00 0.00 0.00 -3.38 -2.51 0.00 0.00 177.63 171.74 2cqy s HIS 101 N -1.65 -0.16 0.12 -0.14 -3.43 -1.26 -5.11 115.29 103.66 2cqy s HIS 101 Ca 0.63 0.31 0.04 0.00 -0.80 0.00 0.00 55.06 55.23 2cqy s HIS 101 Cb -0.55 0.06 -0.04 0.00 -1.43 0.00 0.00 32.58 30.61 2cqy s HIS 101 CO 0.59 -0.28 0.13 -1.50 -2.00 0.00 0.00 174.74 171.69 2cqy s ILE 102 N -0.85 4.66 0.22 -5.38 2.07 -1.26 -5.13 121.20 115.53 2cqy s ILE 102 Ca -0.09 -0.86 0.06 0.00 -1.41 0.00 0.00 60.65 58.35 2cqy s ILE 102 Cb -0.05 -3.32 -0.05 0.00 0.13 0.00 0.00 42.46 39.17 2cqy s ILE 102 CO 0.02 0.01 -0.08 -0.55 -1.91 0.00 0.00 174.94 172.44 2cqy s SER 103 N -2.77 2.25 0.00 4.50 0.15 -1.26 -5.03 113.70 111.54 2cqy s SER 103 Ca 0.31 -1.11 0.00 0.00 0.70 0.00 0.00 55.95 55.85 2cqy s SER 103 Cb -0.11 -0.08 0.00 0.00 -1.71 0.00 0.00 66.02 64.12 2cqy s SER 103 CO 0.24 -0.34 0.00 0.61 1.20 0.00 0.00 173.24 174.95 2cqy n GLY 104 N -0.40 0.61 0.25 9.45 0.00 -1.26 -5.00 105.19 108.84 2cqy n GLY 104 Ca -0.07 -0.65 0.13 0.00 0.00 0.00 0.00 46.02 45.43 2cqy n GLY 104 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cqy h PRO 105 N 0.00 0.00 -6.36 1.61 0.13 -2.05 -3.46 132.00 121.88 2cqy h PRO 105 Ca 0.00 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.55 2cqy h PRO 105 Cb 0.00 0.00 0.18 0.00 0.13 0.00 0.00 31.00 31.31 2cqy h PRO 105 CO 0.00 0.13 -0.73 0.45 -0.23 0.00 0.00 178.00 177.61 2cqy n SER 106 N -3.31 -2.24 -3.69 1.44 2.88 -1.26 -5.01 113.62 102.42 2cqy n SER 106 Ca -0.00 0.63 -0.13 0.00 -1.33 0.00 0.00 58.87 58.04 2cqy n SER 106 Cb 0.35 -1.06 -0.09 0.00 -0.75 0.00 0.00 64.21 62.66 2cqy n SER 106 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2cqy s SER 107 N -1.19 -0.55 0.00 -3.46 0.15 -1.26 -5.13 113.70 102.25 2cqy s SER 107 Ca 0.62 1.05 0.00 0.00 0.70 0.00 0.00 55.95 58.32 2cqy s SER 107 Cb -0.41 1.05 0.00 0.00 -1.71 0.00 0.00 66.02 64.95 2cqy s SER 107 CO 0.61 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.48