#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 -0.16 0.05 1.61 1.04 -1.26 -5.19 113.70 109.79 2cqy s SER 2 Ca 0.00 0.07 -0.28 0.00 0.48 0.00 0.00 55.95 56.22 2cqy s SER 2 Cb 0.00 0.15 0.10 0.00 0.10 0.00 0.00 66.02 66.37 2cqy s SER 2 CO 0.00 -0.22 1.17 -0.44 0.98 0.00 0.00 173.24 174.72 2cqy s SER 3 N -1.76 -0.08 0.00 7.02 0.01 -1.26 -5.19 113.70 112.43 2cqy s SER 3 Ca 0.07 -0.27 0.00 0.00 1.31 0.00 0.00 55.95 57.06 2cqy s SER 3 Cb -0.01 0.29 0.00 0.00 0.21 0.00 0.00 66.02 66.51 2cqy s SER 3 CO -0.05 -0.54 0.00 0.61 0.41 0.00 0.00 173.24 173.67 2cqy n GLY 4 N -0.53 2.23 3.62 3.44 0.00 -1.26 -5.18 105.19 107.50 2cqy n GLY 4 Ca -0.06 -0.57 -0.06 0.00 0.00 0.00 0.00 46.02 45.33 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 0.00 -0.23 0.12 1.61 0.15 -1.26 -5.19 113.70 108.91 2cqy s SER 5 Ca 0.00 0.32 -0.25 0.00 0.70 0.00 0.00 55.95 56.72 2cqy s SER 5 Cb 0.00 0.28 0.08 0.00 -1.71 0.00 0.00 66.02 64.68 2cqy s SER 5 CO 0.00 -0.16 1.07 -0.44 1.20 0.00 0.00 173.24 174.92 2cqy s SER 6 N -0.63 -0.07 0.00 5.45 0.01 -1.26 -5.19 113.70 112.01 2cqy s SER 6 Ca 0.04 -0.45 0.00 0.00 1.31 0.00 0.00 55.95 56.85 2cqy s SER 6 Cb -0.02 0.41 0.00 0.00 0.21 0.00 0.00 66.02 66.62 2cqy s SER 6 CO -0.06 -0.78 0.00 0.61 0.41 0.00 0.00 173.24 173.42 2cqy n GLY 7 N -0.60 3.02 3.15 3.44 0.00 -1.26 -5.16 105.19 107.79 2cqy n GLY 7 Ca -0.05 -0.12 0.05 0.00 0.00 0.00 0.00 46.02 45.91 2cqy n GLY 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2cqy s ASP 8 N 0.00 -0.47 -0.09 1.61 1.01 -1.26 -5.16 116.67 112.31 2cqy s ASP 8 Ca 0.00 0.26 0.01 0.00 0.71 0.00 0.00 52.55 53.53 2cqy s ASP 8 Cb 0.00 1.38 0.02 0.00 1.01 0.00 0.00 42.92 45.33 2cqy s ASP 8 CO 0.00 -0.09 -0.11 -0.54 0.21 0.00 0.00 175.17 174.64 2cqy s LYS 9 N 2.95 1.75 -0.28 8.23 3.01 -1.26 -5.12 119.74 129.03 2cqy s LYS 9 Ca 0.03 -0.39 -0.21 0.00 -1.01 0.00 0.00 55.97 54.38 2cqy s LYS 9 Cb -0.09 -1.57 0.11 0.00 -1.01 0.00 0.00 37.83 35.27 2cqy s LYS 9 CO -0.13 -0.09 0.88 -1.50 0.51 0.00 0.00 175.35 175.02 2cqy s ILE 10 N 1.06 0.00 -0.19 2.17 1.10 -1.26 -5.16 121.20 118.93 2cqy s ILE 10 Ca -0.07 0.00 -0.09 0.00 -0.51 0.00 0.00 60.65 59.98 2cqy s ILE 10 Cb -0.15 -1.00 0.07 0.00 0.15 0.00 0.00 42.46 41.53 2cqy s ILE 10 CO -0.01 0.00 0.44 -1.61 -2.11 0.00 0.00 174.94 171.65 2cqy s GLU 11 N 0.80 0.41 -0.25 3.50 2.02 -1.26 -5.16 118.70 118.76 2cqy s GLU 11 Ca -0.03 0.88 -0.26 0.00 0.02 0.00 0.00 54.97 55.58 2cqy s GLU 11 Cb -0.05 0.06 0.12 0.00 0.10 0.00 0.00 34.13 34.36 2cqy s GLU 11 CO -0.09 -0.17 0.98 0.45 0.02 0.00 0.00 175.26 176.44 2cqy s SER 12 N 1.64 -0.47 -0.30 -0.19 0.15 -1.26 -5.15 113.70 108.12 2cqy s SER 12 Ca -0.08 0.83 -0.09 0.00 0.70 0.00 0.00 55.95 57.30 2cqy s SER 12 Cb -0.09 0.81 0.18 0.00 -1.71 0.00 0.00 66.02 65.21 2cqy s SER 12 CO -0.13 -0.22 0.92 -0.75 1.20 0.00 0.00 173.24 174.25 2cqy s LYS 13 N -0.08 0.30 -0.22 5.44 2.20 -1.26 -5.14 119.74 120.99 2cqy s LYS 13 Ca 0.01 0.52 0.00 0.00 -0.36 0.00 0.00 55.97 56.14 2cqy s LYS 13 Cb -0.04 0.28 0.05 0.00 -1.51 0.00 0.00 37.83 36.62 2cqy s LYS 13 CO -0.03 -0.34 -0.06 -1.17 -0.36 0.00 0.00 175.35 173.39 2cqy s LEU 14 N 2.93 2.32 -0.18 5.43 2.96 -1.26 -5.10 118.68 125.77 2cqy s LEU 14 Ca 0.06 -1.03 -0.10 0.00 -0.22 0.00 0.00 54.13 52.85 2cqy s LEU 14 Cb -0.11 -1.13 0.06 0.00 0.50 0.00 0.00 46.19 45.51 2cqy s LEU 14 CO -0.14 -0.21 0.44 -0.76 -1.32 0.00 0.00 176.35 174.35 2cqy s LEU 15 N 1.45 -0.18 -0.10 -0.68 1.02 -1.26 -5.16 118.68 113.76 2cqy s LEU 15 Ca -0.04 0.96 -0.30 0.00 0.02 0.00 0.00 54.13 54.77 2cqy s LEU 15 Cb -0.18 1.45 0.08 0.00 0.02 0.00 0.00 46.19 47.57 2cqy s LEU 15 CO -0.07 -0.20 0.76 0.00 0.02 0.00 0.00 176.35 176.87 2cqy s ALA 16 N 1.44 -1.81 -0.10 4.21 0.00 -1.26 -5.18 121.76 119.06 2cqy s ALA 16 Ca -0.10 1.45 -0.11 0.00 0.00 0.00 0.00 51.96 53.21 2cqy s ALA 16 Cb -0.08 -0.29 0.03 0.00 0.00 0.00 0.00 23.12 22.77 2cqy s ALA 16 CO -0.14 -0.35 0.30 -1.59 0.00 0.00 0.00 175.76 173.98 2cqy s LYS 17 N -1.00 0.38 -0.55 0.00 -2.85 -1.26 -5.05 119.74 109.40 2cqy s LYS 17 Ca -0.08 0.35 0.02 0.00 -1.00 0.00 0.00 55.97 55.26 2cqy s LYS 17 Cb -0.01 0.18 0.43 0.00 -2.06 0.00 0.00 37.83 36.38 2cqy s LYS 17 CO 0.07 -0.06 1.64 1.63 0.10 0.00 0.00 175.35 178.73 2cqy n LYS 18 N 2.75 3.10 -3.29 1.78 4.01 -1.26 -4.92 118.16 120.32 2cqy n LYS 18 Ca -0.14 -3.79 -0.47 0.00 -0.51 0.00 0.00 58.31 53.41 2cqy n LYS 18 Cb 0.58 -2.28 -0.03 0.00 -0.51 0.00 0.00 35.03 32.79 2cqy n LYS 18 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2cqy s ALA 19 N -3.76 3.95 0.01 7.82 0.00 -1.26 -5.02 121.76 123.50 2cqy s ALA 19 Ca 0.56 -3.14 0.02 0.00 0.00 0.00 0.00 51.96 49.40 2cqy s ALA 19 Cb 0.45 -3.52 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 2cqy s ALA 19 CO -0.10 -2.29 -0.06 -2.00 0.00 0.00 0.00 175.76 171.31 2cqy s GLU 20 N 0.62 0.46 0.04 0.00 2.56 -1.26 -5.06 118.70 116.05 2cqy s GLU 20 Ca 0.17 -0.32 -0.04 0.00 0.00 0.00 0.00 54.97 54.78 2cqy s GLU 20 Cb -0.13 -0.39 -0.01 0.00 2.00 0.00 0.00 34.13 35.60 2cqy s GLU 20 CO -0.07 0.10 -0.07 0.28 -0.56 0.00 0.00 175.26 174.94 2cqy n VAL 21 N 2.61 1.28 -3.73 3.70 0.31 -1.26 -5.04 118.33 116.20 2cqy n VAL 21 Ca -0.15 0.35 -0.24 0.00 -0.01 0.00 0.00 64.34 64.29 2cqy n VAL 21 Cb 0.57 -1.75 -0.17 0.00 -0.91 0.00 0.00 33.84 31.58 2cqy n VAL 21 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2cqy s ASN 22 N -5.98 1.93 0.06 4.52 6.03 -1.26 -5.14 114.94 115.10 2cqy s ASN 22 Ca -0.06 -0.30 0.08 0.00 -1.03 0.00 0.00 52.86 51.56 2cqy s ASN 22 Cb 0.01 -0.42 -0.03 0.00 -3.03 0.00 0.00 41.25 37.78 2cqy s ASN 22 CO 0.09 -0.25 -0.22 -0.89 -2.03 0.00 0.00 177.10 173.81 2cqy s THR 23 N 1.99 2.53 0.01 0.54 2.01 -1.26 -5.00 115.64 116.46 2cqy s THR 23 Ca 0.03 -1.36 -0.20 0.00 0.31 0.00 0.00 61.69 60.48 2cqy s THR 23 Cb -0.14 -2.06 -0.06 0.00 0.01 0.00 0.00 72.50 70.26 2cqy s THR 23 CO -0.06 0.29 0.58 -0.63 -0.69 0.00 0.00 174.62 174.10 2cqy s ILE 24 N -0.93 4.89 -2.00 1.82 1.01 -1.26 -4.95 121.20 119.78 2cqy s ILE 24 Ca 0.14 1.21 0.15 0.00 0.00 0.00 0.00 60.65 62.15 2cqy s ILE 24 Cb -0.10 -3.91 0.43 0.00 0.01 0.00 0.00 42.46 38.89 2cqy s ILE 24 CO 0.05 0.45 1.31 -0.81 0.00 0.00 0.00 174.94 175.94 2cqy n PRO 25 N 2.49 0.49 0.00 2.79 -0.04 -1.26 -4.87 135.00 134.60 2cqy n PRO 25 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 2cqy n PRO 25 Cb 0.51 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 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 -0.01 4.19 3.13 0.55 0.00 -1.26 -4.93 105.19 106.85 2cqy n GLY 26 Ca 0.11 -1.23 -0.21 0.00 0.00 0.00 0.00 46.02 44.69 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 -2.00 1.21 0.00 1.61 5.36 -1.23 -5.03 117.98 117.90 2cqy s PHE 27 Ca 0.00 -0.31 0.00 0.00 -0.96 0.00 0.00 56.93 55.66 2cqy s PHE 27 Cb 0.00 -0.74 0.00 0.00 -0.34 0.00 0.00 43.02 41.94 2cqy s PHE 27 CO 0.00 0.02 0.00 -0.40 -1.46 0.00 0.00 175.22 173.38 2cqy n ASP 28 N 2.20 3.38 -4.40 6.13 5.75 -1.26 -4.36 116.55 123.98 2cqy n ASP 28 Ca -0.17 0.00 -0.27 0.00 -0.01 0.00 0.00 54.79 54.34 2cqy n ASP 28 Cb 0.55 0.24 -0.20 0.00 -1.03 0.00 0.00 41.12 40.67 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 2.54 -0.49 3.31 6.12 0.00 -1.26 -4.73 105.19 110.69 2cqy n GLY 29 Ca 0.00 0.32 -0.51 0.00 0.00 0.00 0.00 46.02 45.84 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 5.95 1.05 -1.24 1.61 3.14 -1.26 -4.88 118.33 122.70 2cqy n VAL 30 Ca 0.66 -0.26 -0.31 0.00 -2.96 0.00 0.00 64.34 61.46 2cqy n VAL 30 Cb 0.11 0.00 0.10 0.00 -1.06 0.00 0.00 33.84 32.98 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 -0.53 3.11 -0.11 1.55 1.01 -1.13 -4.96 120.40 119.34 2cqy s VAL 31 Ca 0.73 0.38 0.00 0.00 0.00 0.00 0.00 61.98 63.10 2cqy s VAL 31 Cb -1.04 -2.81 -0.07 0.00 0.00 0.00 0.00 36.38 32.46 2cqy s VAL 31 CO 0.54 -0.45 -0.10 0.29 0.00 0.00 0.00 175.10 175.38 2cqy n LYS 32 N -3.48 0.28 -3.61 2.72 4.76 -1.26 -4.51 118.16 113.05 2cqy n LYS 32 Ca 0.10 0.07 -0.13 0.00 -2.87 0.00 0.00 58.31 55.48 2cqy n LYS 32 Cb 0.53 -1.19 -0.05 0.00 -1.84 0.00 0.00 35.03 32.47 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 -5.19 -0.34 0.29 4.39 1.01 -1.26 -5.01 116.67 110.56 2cqy s ASP 33 Ca -0.15 -0.01 -0.00 0.00 0.71 0.00 0.00 52.55 53.09 2cqy s ASP 33 Cb 0.04 0.47 0.68 0.00 1.01 0.00 0.00 42.92 45.12 2cqy s ASP 33 CO 0.25 -0.74 1.59 0.00 0.21 0.00 0.00 175.17 176.48 2cqy h ALA 34 N 2.73 1.08 -0.74 5.23 0.00 -1.93 0.73 119.26 126.37 2cqy h ALA 34 Ca -0.32 0.32 0.07 0.00 0.00 0.00 0.00 54.91 54.98 2cqy h ALA 34 Cb 1.23 0.56 -0.06 0.00 0.00 0.00 0.00 17.79 19.52 2cqy h ALA 34 CO 0.43 -0.53 0.42 0.93 0.00 0.00 0.00 179.25 180.50 2cqy h GLU 35 N 0.04 0.74 -0.33 0.00 5.08 -1.97 -1.39 114.58 116.74 2cqy h GLU 35 Ca 0.56 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.75 2cqy h GLU 35 Cb 1.11 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 2cqy h GLU 35 CO -0.87 0.49 -0.28 1.49 -1.00 0.00 0.00 179.01 178.84 2cqy h GLU 36 N 0.76 0.69 -0.25 2.33 4.57 -0.02 -2.83 114.58 119.83 2cqy h GLU 36 Ca 0.33 -0.30 -0.04 0.00 -1.18 0.00 0.00 59.36 58.18 2cqy h GLU 36 Cb 0.22 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 2cqy h GLU 36 CO -0.19 0.89 -0.02 0.00 -1.18 0.00 0.00 179.01 178.50 2cqy h ALA 37 N 1.09 1.51 -0.03 2.92 0.00 -0.05 -2.14 119.26 122.56 2cqy h ALA 37 Ca 0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2cqy h ALA 37 Cb 0.78 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 2cqy h ALA 37 CO 0.06 0.36 -0.02 0.28 0.00 0.00 0.00 179.25 179.93 2cqy h VAL 38 N 0.36 1.35 0.59 0.00 2.07 -1.06 -2.18 116.25 117.38 2cqy h VAL 38 Ca 0.08 -1.09 -0.02 0.00 0.82 0.00 0.00 66.70 66.49 2cqy h VAL 38 Cb 0.28 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.06 2cqy h VAL 38 CO 0.01 0.29 -0.39 0.03 0.02 0.00 0.00 177.57 177.54 2cqy h ARG 39 N -0.35 -0.90 -0.46 1.57 3.08 -1.34 -1.71 114.38 114.27 2cqy h ARG 39 Ca 0.01 0.06 0.09 0.00 0.07 0.00 0.00 59.98 60.21 2cqy h ARG 39 Cb 0.49 0.20 -0.09 0.00 0.08 0.00 0.00 29.97 30.65 2cqy h ARG 39 CO 0.01 -0.60 -0.10 0.82 -1.07 0.00 0.00 179.97 179.03 2cqy h ILE 40 N -0.93 0.55 0.14 2.04 2.04 -1.48 -2.59 117.51 117.29 2cqy h ILE 40 Ca -0.07 -0.01 0.01 0.00 1.00 0.00 0.00 64.86 65.79 2cqy h ILE 40 Cb 0.76 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 37.35 2cqy h ILE 40 CO 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 178.15 177.81 2cqy h ALA 41 N 1.45 -0.92 -1.00 1.87 0.00 -1.21 -1.42 119.26 118.03 2cqy h ALA 41 Ca 0.22 -0.10 0.39 0.00 0.00 0.00 0.00 54.91 55.43 2cqy h ALA 41 Cb 0.34 0.76 -0.18 0.00 0.00 0.00 0.00 17.79 18.71 2cqy h ALA 41 CO -0.46 -1.01 0.49 0.00 0.00 0.00 0.00 179.25 178.27 2cqy h ARG 42 N -0.60 0.05 -0.66 0.00 3.08 -0.97 1.39 114.38 116.66 2cqy h ARG 42 Ca -0.01 -0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 2cqy h ARG 42 Cb 0.59 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.60 2cqy h ARG 42 CO -0.19 0.03 0.09 0.93 -1.07 0.00 0.00 179.97 179.77 2cqy h GLU 43 N 0.05 1.09 -0.05 0.04 5.08 -0.92 -2.72 114.58 117.15 2cqy h GLU 43 Ca 0.81 -0.30 -0.11 0.00 -1.00 0.00 0.00 59.36 58.76 2cqy h GLU 43 Cb 2.06 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 31.17 2cqy h GLU 43 CO -0.76 1.01 -0.46 0.82 -1.00 0.00 0.00 179.01 178.61 2cqy h ILE 44 N 1.02 1.34 -0.70 3.13 2.04 0.25 -3.41 117.51 121.18 2cqy h ILE 44 Ca 0.20 -1.63 0.00 0.00 1.00 0.00 0.00 64.86 64.43 2cqy h ILE 44 Cb 0.46 1.82 0.00 0.00 -0.74 0.00 0.00 36.82 38.35 2cqy h ILE 44 CO 0.02 0.47 0.00 0.61 0.00 0.00 0.00 178.15 179.25 2cqy n GLY 45 N -0.13 -0.43 3.71 5.37 0.00 -0.12 -4.56 105.19 109.02 2cqy n GLY 45 Ca -0.02 -0.81 -0.35 0.00 0.00 0.00 0.00 46.02 44.84 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 1.56 1.52 -1.60 1.61 4.02 -1.26 -4.46 117.16 118.54 2cqy n TYR 46 Ca 0.00 0.41 -0.32 0.00 -0.01 0.00 0.00 57.90 57.98 2cqy n TYR 46 Cb 0.00 -2.17 0.06 0.00 -0.02 0.00 0.00 39.34 37.21 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 -3.84 2.63 -0.07 -0.72 0.04 -1.26 -5.02 135.00 126.75 2cqy s PRO 47 Ca 0.77 1.32 0.00 0.00 0.04 0.00 0.00 61.00 63.13 2cqy s PRO 47 Cb -0.32 -1.93 0.02 0.00 0.04 0.00 0.00 34.50 32.30 2cqy s PRO 47 CO 0.47 -1.37 -0.06 0.14 0.04 0.00 0.00 177.00 176.22 2cqy s VAL 48 N -2.51 0.75 0.42 -0.36 -7.23 0.35 -2.62 120.40 109.20 2cqy s VAL 48 Ca 0.65 -0.18 -0.18 0.00 -1.81 0.00 0.00 61.98 60.46 2cqy s VAL 48 Cb -0.19 -0.78 -0.10 0.00 0.56 0.00 0.00 36.38 35.87 2cqy s VAL 48 CO 0.46 0.30 0.91 -0.32 -0.31 0.00 0.00 175.10 176.13 2cqy s MET 49 N 1.32 4.11 -0.11 4.82 1.75 -0.47 -1.19 119.30 129.53 2cqy s MET 49 Ca -0.04 0.97 -0.01 0.00 -1.25 0.00 0.00 55.69 55.36 2cqy s MET 49 Cb -0.14 -2.23 0.03 0.00 2.84 0.00 0.00 34.83 35.33 2cqy s MET 49 CO -0.03 -0.04 -0.04 0.42 -0.65 0.00 0.00 175.02 174.69 2cqy s ILE 50 N -2.23 0.77 0.46 10.11 1.01 -0.48 -2.14 121.20 128.69 2cqy s ILE 50 Ca 0.59 -0.20 0.05 0.00 0.00 0.00 0.00 60.65 61.09 2cqy s ILE 50 Cb -0.09 -0.89 -0.04 0.00 0.01 0.00 0.00 42.46 41.44 2cqy s ILE 50 CO 0.18 0.26 0.07 -0.54 0.00 0.00 0.00 174.94 174.91 2cqy s LYS 51 N 1.80 2.12 -0.44 2.79 3.01 -1.14 -2.91 119.74 124.97 2cqy s LYS 51 Ca 0.04 -2.17 -0.17 0.00 -1.01 0.00 0.00 55.97 52.66 2cqy s LYS 51 Cb -0.13 -1.69 0.04 0.00 -1.01 0.00 0.00 37.83 35.03 2cqy s LYS 51 CO -0.07 -0.23 0.46 0.00 0.51 0.00 0.00 175.35 176.02 2cqy s ALA 52 N -2.76 3.44 0.27 5.17 0.00 -1.26 0.85 121.76 127.47 2cqy s ALA 52 Ca 0.25 -1.65 -0.04 0.00 0.00 0.00 0.00 51.96 50.51 2cqy s ALA 52 Cb 0.05 -3.10 0.54 0.00 0.00 0.00 0.00 23.12 20.61 2cqy s ALA 52 CO 0.13 -1.68 1.60 1.03 0.00 0.00 0.00 175.76 176.84 2cqy h SER 53 N 8.77 -0.53 -0.93 0.00 0.87 0.24 1.17 113.55 123.14 2cqy h SER 53 Ca -0.27 0.25 0.29 0.00 -1.23 0.00 0.00 61.79 60.83 2cqy h SER 53 Cb 1.11 0.45 -0.17 0.00 -0.44 0.00 0.00 62.40 63.35 2cqy h SER 53 CO 0.83 -0.27 0.14 0.00 -0.53 0.00 0.00 176.83 177.00 2cqy n ALA 54 N -3.16 0.60 0.12 6.23 0.00 -1.18 -4.29 120.51 118.83 2cqy n ALA 54 Ca 0.17 0.98 0.00 0.00 0.00 0.00 0.00 53.44 54.60 2cqy n ALA 54 Cb 0.57 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 19.24 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 -1.41 -0.25 7.00 0.00 0.00 0.82 -5.06 105.19 106.30 2cqy n GLY 55 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 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 1.79 3.05 0.00 -0.02 0.00 0.37 -4.89 105.19 105.49 2cqy n GLY 56 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 2.94 0.00 -0.02 0.00 -1.26 -4.43 105.19 102.42 2cqy n GLY 57 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.20 0.78 3.63 -0.02 0.00 -1.26 -5.14 105.19 102.98 2cqy n GLY 58 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2cqy n GLY 58 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2cqy s LYS 59 N 0.44 0.74 -1.06 1.61 2.47 -1.26 -4.92 119.74 117.75 2cqy s LYS 59 Ca 0.00 1.01 0.00 0.00 -1.56 0.00 0.00 55.97 55.42 2cqy s LYS 59 Cb 0.00 0.29 0.00 0.00 -1.46 0.00 0.00 37.83 36.66 2cqy s LYS 59 CO 0.00 -0.11 0.00 0.41 0.16 0.00 0.00 175.35 175.81 2cqy n GLY 60 N 3.19 1.14 3.89 5.54 0.00 -1.26 -4.92 105.19 112.77 2cqy n GLY 60 Ca -0.16 -0.58 -0.25 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.86 2.31 0.20 1.61 0.23 -1.26 -5.02 119.30 114.51 2cqy s MET 61 Ca 0.00 -1.90 0.10 0.00 -1.03 0.00 0.00 55.69 52.86 2cqy s MET 61 Cb 0.00 -2.16 -0.04 0.00 -1.53 0.00 0.00 34.83 31.09 2cqy s MET 61 CO 0.00 -0.51 -0.19 0.50 -2.03 0.00 0.00 175.02 172.79 2cqy s ARG 62 N -4.24 1.42 0.07 3.16 3.52 -1.14 -5.03 118.95 116.71 2cqy s ARG 62 Ca 0.39 -1.54 0.09 0.00 -0.13 0.00 0.00 55.73 54.53 2cqy s ARG 62 Cb -0.02 -1.49 -0.03 0.00 -1.56 0.00 0.00 34.95 31.85 2cqy s ARG 62 CO 0.23 0.29 -0.24 0.42 -0.81 0.00 0.00 175.30 175.19 2cqy s ILE 63 N -2.24 1.97 0.11 4.11 1.01 -1.26 -1.39 121.20 123.50 2cqy s ILE 63 Ca 0.21 -1.43 0.10 0.00 0.00 0.00 0.00 60.65 59.53 2cqy s ILE 63 Cb -0.05 -1.72 -0.04 0.00 0.01 0.00 0.00 42.46 40.66 2cqy s ILE 63 CO 0.09 0.21 -0.26 0.00 0.00 0.00 0.00 174.94 174.98 2cqy s ALA 64 N -0.90 2.37 -0.12 9.38 0.00 -0.33 -4.95 121.76 127.21 2cqy s ALA 64 Ca 0.10 -1.41 0.05 0.00 0.00 0.00 0.00 51.96 50.70 2cqy s ALA 64 Cb -0.10 -0.43 -0.06 0.00 0.00 0.00 0.00 23.12 22.53 2cqy s ALA 64 CO 0.03 0.54 0.16 0.91 0.00 0.00 0.00 175.76 177.40 2cqy n TRP 65 N 1.14 0.00 -3.76 0.00 7.02 -1.26 -0.49 117.44 120.08 2cqy n TRP 65 Ca -0.18 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.21 2cqy n TRP 65 Cb 0.53 -0.05 -0.05 0.00 -2.42 0.00 0.00 31.31 29.31 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 -1.98 -0.10 0.17 -0.99 1.11 -1.26 -4.72 116.67 108.89 2cqy s ASP 66 Ca 0.00 -0.52 -0.29 0.00 0.18 0.00 0.00 52.55 51.93 2cqy s ASP 66 Cb 0.03 0.45 -0.01 0.00 1.07 0.00 0.00 42.92 44.46 2cqy s ASP 66 CO 0.20 -0.86 1.54 -0.78 1.18 0.00 0.00 175.17 176.46 2cqy h ASP 67 N 2.46 -1.97 -0.90 0.27 1.82 -1.97 0.53 116.42 116.68 2cqy h ASP 67 Ca -0.33 0.31 0.25 0.00 -0.39 0.00 0.00 57.03 56.87 2cqy h ASP 67 Cb 1.24 0.89 -0.15 0.00 0.68 0.00 0.00 39.33 41.99 2cqy h ASP 67 CO 0.48 -0.27 0.24 1.05 -1.61 0.00 0.00 179.24 179.13 2cqy h GLU 68 N -0.06 0.18 -0.22 0.28 4.11 -2.00 0.21 114.58 117.08 2cqy h GLU 68 Ca 0.18 -0.01 -0.11 0.00 0.07 0.00 0.00 59.36 59.49 2cqy h GLU 68 Cb 0.47 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 2cqy h GLU 68 CO -0.89 0.12 -0.31 0.93 0.07 0.00 0.00 179.01 178.93 2cqy h GLU 69 N 0.18 0.59 -0.50 1.06 5.08 -0.53 -2.30 114.58 118.16 2cqy h GLU 69 Ca 0.57 -0.35 0.10 0.00 -1.00 0.00 0.00 59.36 58.68 2cqy h GLU 69 Cb 1.18 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 30.38 2cqy h GLU 69 CO -0.68 0.95 0.01 1.15 -1.00 0.00 0.00 179.01 179.44 2cqy h THR 70 N 0.28 0.62 0.10 1.13 2.02 0.26 0.37 112.91 117.69 2cqy h THR 70 Ca 0.02 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.15 2cqy h THR 70 Cb 0.88 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2cqy h THR 70 CO 0.07 0.02 -0.05 0.03 0.37 0.00 0.00 175.52 175.97 2cqy h ARG 71 N 0.13 -0.13 -0.72 6.66 3.08 -1.21 0.19 114.38 122.39 2cqy h ARG 71 Ca 0.26 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.43 2cqy h ARG 71 Cb 0.38 0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.42 2cqy h ARG 71 CO -0.41 0.20 0.48 -0.44 -1.07 0.00 0.00 179.97 178.72 2cqy h ASP 72 N -0.47 0.47 0.36 7.04 5.19 -0.96 -0.99 116.42 127.05 2cqy h ASP 72 Ca -0.01 0.02 -0.32 0.00 -0.62 0.00 0.00 57.03 56.09 2cqy h ASP 72 Cb 0.39 -0.08 0.02 0.00 0.18 0.00 0.00 39.33 39.85 2cqy h ASP 72 CO 0.02 0.27 -1.47 1.23 -3.12 0.00 0.00 179.24 176.17 2cqy h GLY 73 N 0.51 0.50 1.95 2.75 0.00 -0.13 -3.15 103.07 105.50 2cqy h GLY 73 Ca 0.34 -1.28 -0.04 0.00 0.00 0.00 0.00 47.33 46.35 2cqy h GLY 73 CO -0.11 1.12 -0.14 -2.75 0.00 0.00 0.00 176.54 174.66 2cqy h PHE 74 N 0.12 0.06 0.09 5.60 3.57 0.15 0.19 116.94 126.72 2cqy h PHE 74 Ca -0.24 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.25 2cqy h PHE 74 Cb 2.11 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.83 2cqy h PHE 74 CO 0.10 0.20 -0.04 0.00 -2.23 0.00 0.00 178.31 176.34 2cqy h ARG 75 N 0.06 -0.12 0.48 1.11 3.08 -1.29 -2.75 114.38 114.96 2cqy h ARG 75 Ca 0.01 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 2cqy h ARG 75 Cb 0.29 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2cqy h ARG 75 CO 0.02 0.39 -0.23 -0.07 -1.07 0.00 0.00 179.97 179.01 2cqy h LEU 76 N -0.73 -0.54 -1.73 3.04 3.38 -1.48 -2.63 115.31 114.61 2cqy h LEU 76 Ca -0.01 -0.07 0.13 0.00 0.09 0.00 0.00 57.88 58.02 2cqy h LEU 76 Cb 0.56 0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 2cqy h LEU 76 CO 0.02 -0.16 0.60 0.28 0.09 0.00 0.00 178.44 179.28 2cqy h SER 77 N -1.02 0.00 0.16 -0.43 0.02 -0.78 -0.97 113.55 110.54 2cqy h SER 77 Ca -0.07 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 2cqy h SER 77 Cb 0.59 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.13 2cqy h SER 77 CO 0.11 0.00 -0.08 -1.28 -1.14 0.00 0.00 176.83 174.44 2cqy h SER 78 N 0.00 -0.18 -0.63 3.07 0.87 -1.31 -3.11 113.55 112.26 2cqy h SER 78 Ca 0.22 -0.26 0.18 0.00 -1.23 0.00 0.00 61.79 60.71 2cqy h SER 78 Cb 1.42 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 63.40 2cqy h SER 78 CO -0.00 0.38 0.57 1.56 -0.53 0.00 0.00 176.83 178.80 2cqy h GLN 79 N -0.97 0.00 0.22 2.24 4.20 -0.82 -1.47 115.11 118.51 2cqy h GLN 79 Ca -0.02 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 2cqy h GLN 79 Cb 0.43 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.21 2cqy h GLN 79 CO 0.04 0.00 -0.11 0.93 -0.67 0.00 0.00 178.83 179.02 2cqy h GLU 80 N 0.00 -0.28 -0.37 1.46 4.39 -1.46 -3.08 114.58 115.23 2cqy h GLU 80 Ca 0.30 0.02 0.11 0.00 0.34 0.00 0.00 59.36 60.13 2cqy h GLU 80 Cb 1.43 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 30.13 2cqy h GLU 80 CO -0.00 -0.19 0.45 0.00 -1.16 0.00 0.00 179.01 178.10 2cqy h ALA 81 N -1.70 2.04 0.14 3.43 0.00 -1.37 0.26 119.26 122.05 2cqy h ALA 81 Ca -0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2cqy h ALA 81 Cb 0.23 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2cqy h ALA 81 CO 0.05 -0.64 -0.07 0.00 0.00 0.00 0.00 179.25 178.59 2cqy h ALA 82 N 1.45 -0.18 0.14 0.00 0.00 0.20 -1.74 119.26 119.14 2cqy h ALA 82 Ca 0.18 -0.08 -0.27 0.00 0.00 0.00 0.00 54.91 54.74 2cqy h ALA 82 Cb 1.07 0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.94 2cqy h ALA 82 CO -0.00 -0.55 -1.31 1.03 0.00 0.00 0.00 179.25 178.42 2cqy h SER 83 N -0.29 0.47 0.00 0.00 0.87 -1.12 -2.33 113.55 111.14 2cqy h SER 83 Ca -0.02 -0.89 0.00 0.00 -1.23 0.00 0.00 61.79 59.65 2cqy h SER 83 Cb 0.23 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 2cqy h SER 83 CO 0.03 1.59 0.00 -1.20 -0.53 0.00 0.00 176.83 176.72 2cqy n SER 84 N -3.92 0.00 -0.11 6.23 7.64 0.77 -4.21 113.62 120.03 2cqy n SER 84 Ca -0.22 0.91 -0.19 0.00 1.01 0.00 0.00 58.87 60.39 2cqy n SER 84 Cb 0.92 -0.41 -0.08 0.00 -1.01 0.00 0.00 64.21 63.62 2cqy n SER 84 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2cqy n PHE 85 N -2.36 0.61 0.00 1.43 3.01 -1.02 -5.03 117.46 114.09 2cqy n PHE 85 Ca 0.00 0.27 0.00 0.00 1.01 0.00 0.00 57.45 58.73 2cqy n PHE 85 Cb 0.00 -0.94 0.00 0.00 -0.01 0.00 0.00 39.48 38.53 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 1.42 0.66 3.86 1.37 0.00 -0.68 -5.04 105.19 106.79 2cqy n GLY 86 Ca -0.31 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.50 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 5.05 0.00 1.61 1.01 -1.13 -4.70 116.67 118.52 2cqy s ASP 87 Ca 0.00 -0.72 0.12 0.00 0.71 0.00 0.00 52.55 52.65 2cqy s ASP 87 Cb 0.00 -0.63 0.32 0.00 1.01 0.00 0.00 42.92 43.62 2cqy s ASP 87 CO 0.00 -0.60 1.26 -0.90 0.21 0.00 0.00 175.17 175.14 2cqy n ASP 88 N -1.50 2.97 -4.66 0.27 5.75 -1.26 -0.60 116.55 117.51 2cqy n ASP 88 Ca 0.02 -1.98 -0.48 0.00 -0.01 0.00 0.00 54.79 52.35 2cqy n ASP 88 Cb 0.62 -0.24 -0.05 0.00 -1.03 0.00 0.00 41.12 40.42 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 0.60 2.12 -3.82 0.11 5.12 -1.26 -4.79 116.66 114.75 2cqy n ARG 89 Ca 0.12 0.76 -0.25 0.00 -1.93 0.00 0.00 57.85 56.55 2cqy n ARG 89 Cb 0.44 -2.69 -0.01 0.00 -1.16 0.00 0.00 32.46 29.03 2cqy n ARG 89 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2cqy s LEU 90 N 4.66 2.85 0.27 0.55 1.43 -1.26 0.81 118.68 127.98 2cqy s LEU 90 Ca 0.94 -1.14 0.03 0.00 -1.03 0.00 0.00 54.13 52.93 2cqy s LEU 90 Cb -0.67 -1.35 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 2cqy s LEU 90 CO 0.50 -1.01 0.19 -0.76 0.23 0.00 0.00 176.35 175.51 2cqy s LEU 91 N -4.25 1.48 -0.23 1.79 1.43 0.25 -2.84 118.68 116.31 2cqy s LEU 91 Ca 0.38 -1.57 -0.08 0.00 -1.03 0.00 0.00 54.13 51.83 2cqy s LEU 91 Cb -0.02 0.42 0.10 0.00 0.03 0.00 0.00 46.19 46.72 2cqy s LEU 91 CO 0.23 -0.94 0.49 -0.63 0.23 0.00 0.00 176.35 175.74 2cqy s ILE 92 N -3.78 -0.74 0.06 -0.59 1.01 -1.26 -2.90 121.20 112.99 2cqy s ILE 92 Ca 0.39 0.11 0.04 0.00 0.00 0.00 0.00 60.65 61.19 2cqy s ILE 92 Cb 0.05 -0.77 -0.03 0.00 0.01 0.00 0.00 42.46 41.72 2cqy s ILE 92 CO 0.19 0.05 -0.12 -1.61 0.00 0.00 0.00 174.94 173.45 2cqy s GLU 93 N 2.67 0.71 0.21 2.79 2.02 -0.91 -3.57 118.70 122.62 2cqy s GLU 93 Ca -0.03 -0.88 -0.32 0.00 0.02 0.00 0.00 54.97 53.75 2cqy s GLU 93 Cb -0.12 -0.63 -0.13 0.00 0.10 0.00 0.00 34.13 33.35 2cqy s GLU 93 CO -0.15 0.13 1.54 1.17 0.02 0.00 0.00 175.26 177.98 2cqy n LYS 94 N 1.34 2.25 -3.70 1.61 3.00 -1.26 -1.37 118.16 120.03 2cqy n LYS 94 Ca -0.22 0.81 -0.38 0.00 -0.00 0.00 0.00 58.31 58.52 2cqy n LYS 94 Cb 0.54 -2.55 -0.12 0.00 0.00 0.00 0.00 35.03 32.90 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 0.51 3.17 -0.19 5.64 5.36 -1.08 -4.74 117.98 126.65 2cqy s PHE 95 Ca 0.73 -0.78 0.00 0.00 -0.96 0.00 0.00 56.93 55.93 2cqy s PHE 95 Cb -0.63 -2.32 0.05 0.00 -0.34 0.00 0.00 43.02 39.78 2cqy s PHE 95 CO 0.42 -0.52 -0.07 0.42 -1.46 0.00 0.00 175.22 174.01 2cqy s ILE 96 N 1.56 1.40 -0.19 3.12 1.01 -1.26 -4.37 121.20 122.46 2cqy s ILE 96 Ca 0.03 -0.91 -0.21 0.00 0.00 0.00 0.00 60.65 59.57 2cqy s ILE 96 Cb -0.17 -1.57 -0.18 0.00 0.01 0.00 0.00 42.46 40.55 2cqy s ILE 96 CO 0.05 0.09 0.23 -0.78 0.00 0.00 0.00 174.94 174.52 2cqy h ASP 97 N 8.03 0.00 -2.96 3.58 3.58 -1.99 -3.48 116.42 123.18 2cqy h ASP 97 Ca -0.24 -0.50 -0.50 0.00 0.42 0.00 0.00 57.03 56.21 2cqy h ASP 97 Cb 1.10 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.15 2cqy h ASP 97 CO 0.43 1.35 -0.18 0.20 -2.88 0.00 0.00 179.24 178.17 2cqy s ASN 98 N -6.66 6.35 0.73 2.28 0.01 -1.26 -5.08 114.94 111.30 2cqy s ASN 98 Ca -0.26 0.54 -0.12 0.00 -0.71 0.00 0.00 52.86 52.31 2cqy s ASN 98 Cb 0.04 -2.07 0.03 0.00 0.41 0.00 0.00 41.25 39.67 2cqy s ASN 98 CO 0.56 -0.25 1.10 -2.16 -1.51 0.00 0.00 177.10 174.84 2cqy s PRO 99 N -3.98 2.48 0.29 -0.60 0.04 -1.26 -5.07 135.00 126.90 2cqy s PRO 99 Ca 0.41 1.27 -0.07 0.00 0.04 0.00 0.00 61.00 62.65 2cqy s PRO 99 Cb -0.10 -1.92 -0.00 0.00 0.04 0.00 0.00 34.50 32.52 2cqy s PRO 99 CO 0.34 -1.48 0.46 1.03 0.04 0.00 0.00 177.00 177.38 2cqy s ARG 100 N -4.56 1.70 0.26 4.56 0.52 -1.26 -5.19 118.95 114.98 2cqy s ARG 100 Ca 0.64 -1.51 0.01 0.00 -0.52 0.00 0.00 55.73 54.35 2cqy s ARG 100 Cb -0.19 0.45 -0.05 0.00 0.52 0.00 0.00 34.95 35.68 2cqy s ARG 100 CO 0.50 -0.70 0.09 -1.01 0.02 0.00 0.00 175.30 174.20 2cqy s HIS 101 N -3.54 1.55 0.31 -0.53 3.76 -1.26 -5.17 115.29 110.40 2cqy s HIS 101 Ca 0.27 -1.17 0.09 0.00 -0.15 0.00 0.00 55.06 54.10 2cqy s HIS 101 Cb 0.00 -0.91 -0.04 0.00 1.11 0.00 0.00 32.58 32.74 2cqy s HIS 101 CO 0.14 -0.32 0.10 0.96 -0.85 0.00 0.00 174.74 174.77 2cqy s ILE 102 N -3.73 3.26 -0.18 0.60 -4.36 -1.26 -5.07 121.20 110.45 2cqy s ILE 102 Ca 0.37 -1.75 -0.13 0.00 -0.26 0.00 0.00 60.65 58.88 2cqy s ILE 102 Cb 0.08 -2.96 -0.07 0.00 1.25 0.00 0.00 42.46 40.75 2cqy s ILE 102 CO 0.13 -0.26 -0.29 -0.24 0.24 0.00 0.00 174.94 174.52 2cqy n SER 103 N -1.07 1.72 0.00 4.36 2.88 -1.26 -5.14 113.62 115.12 2cqy n SER 103 Ca -0.04 0.29 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 2cqy n SER 103 Cb 0.60 -0.68 0.00 0.00 -0.75 0.00 0.00 64.21 63.39 2cqy n SER 103 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cqy n GLY 104 N 1.68 3.53 0.00 0.46 0.00 -1.26 -4.92 105.19 104.67 2cqy n GLY 104 Ca -0.28 -1.19 0.06 0.00 0.00 0.00 0.00 46.02 44.62 2cqy n GLY 104 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cqy n PRO 105 N -1.44 0.49 -1.64 1.61 -0.04 -1.26 -4.86 135.00 127.86 2cqy n PRO 105 Ca 0.00 0.00 -0.64 0.00 -0.04 0.00 0.00 63.50 62.82 2cqy n PRO 105 Cb 0.00 -1.41 -0.09 0.00 -0.04 0.00 0.00 33.50 31.96 2cqy n PRO 105 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2cqy n SER 106 N -0.91 0.97 0.06 3.54 3.41 -1.26 -4.83 113.62 114.61 2cqy n SER 106 Ca 0.09 1.14 -0.11 0.00 -0.26 0.00 0.00 58.87 59.73 2cqy n SER 106 Cb 0.04 -0.85 -0.05 0.00 -0.26 0.00 0.00 64.21 63.10 2cqy n SER 106 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2cqy h SER 107 N 4.49 -0.51 0.00 4.04 0.02 -2.05 -3.54 113.55 116.00 2cqy h SER 107 Ca -0.43 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 2cqy h SER 107 Cb 1.32 0.21 0.00 0.00 0.14 0.00 0.00 62.40 64.08 2cqy h SER 107 CO 0.89 -0.24 0.00 0.61 -1.14 0.00 0.00 176.83 176.95