#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqy n SER 2 N 0.00 0.61 -4.58 1.61 7.64 -1.26 -4.89 113.62 112.75 2cqy n SER 2 Ca 0.00 -0.93 -0.27 0.00 1.01 0.00 0.00 58.87 58.68 2cqy n SER 2 Cb 0.00 -1.16 -0.11 0.00 -1.01 0.00 0.00 64.21 61.93 2cqy n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2cqy s SER 3 N -3.96 3.61 0.10 6.43 0.15 -1.26 -5.16 113.70 113.62 2cqy s SER 3 Ca 0.03 -1.34 -0.25 0.00 0.70 0.00 0.00 55.95 55.08 2cqy s SER 3 Cb -0.02 -0.34 0.09 0.00 -1.71 0.00 0.00 66.02 64.04 2cqy s SER 3 CO 0.73 -0.43 1.13 -0.83 1.20 0.00 0.00 173.24 175.04 2cqy s GLY 4 N -3.66 -0.08 0.26 9.45 0.00 -1.26 -5.19 107.32 106.85 2cqy s GLY 4 Ca 0.35 -0.01 -0.21 0.00 0.00 0.00 0.00 44.72 44.85 2cqy s GLY 4 CO 0.17 2.50 0.69 -0.56 0.00 0.00 0.00 173.10 175.91 2cqy s SER 5 N -3.37 -0.29 -0.16 1.64 0.01 -1.26 -5.19 113.70 105.09 2cqy s SER 5 Ca 0.21 -0.55 -0.30 0.00 1.31 0.00 0.00 55.95 56.61 2cqy s SER 5 Cb -0.01 0.71 0.14 0.00 0.21 0.00 0.00 66.02 67.07 2cqy s SER 5 CO 0.02 -1.29 1.07 -0.55 0.41 0.00 0.00 173.24 172.89 2cqy s SER 6 N -2.90 -0.28 0.24 2.44 0.15 -1.26 -5.19 113.70 106.90 2cqy s SER 6 Ca 0.10 0.22 -0.15 0.00 0.70 0.00 0.00 55.95 56.83 2cqy s SER 6 Cb -0.05 0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 2cqy s SER 6 CO 0.05 -0.32 0.52 -0.83 1.20 0.00 0.00 173.24 173.86 2cqy s GLY 7 N -1.47 0.33 -0.30 9.45 0.00 -1.26 -5.17 107.32 108.91 2cqy s GLY 7 Ca 0.03 -0.68 -0.15 0.00 0.00 0.00 0.00 44.72 43.91 2cqy s GLY 7 CO -0.02 -0.48 0.98 0.51 0.00 0.00 0.00 173.10 174.09 2cqy s ASP 8 N -2.98 -0.55 -0.09 1.64 -4.77 -1.26 -5.16 116.67 103.51 2cqy s ASP 8 Ca 0.18 0.80 -0.04 0.00 -3.30 0.00 0.00 52.55 50.19 2cqy s ASP 8 Cb -0.02 1.48 0.04 0.00 -1.09 0.00 0.00 42.92 43.33 2cqy s ASP 8 CO 0.07 -0.12 0.20 -0.75 0.70 0.00 0.00 175.17 175.27 2cqy s LYS 9 N 1.99 0.14 -0.05 2.11 2.47 -1.26 -5.14 119.74 120.01 2cqy s LYS 9 Ca -0.05 0.47 -0.02 0.00 -1.56 0.00 0.00 55.97 54.81 2cqy s LYS 9 Cb -0.05 -0.15 0.03 0.00 -1.46 0.00 0.00 37.83 36.20 2cqy s LYS 9 CO -0.16 -0.18 0.04 0.42 0.16 0.00 0.00 175.35 175.63 2cqy s ILE 10 N 1.34 0.05 -0.30 5.43 1.01 -1.26 -5.10 121.20 122.37 2cqy s ILE 10 Ca -0.08 0.32 -0.14 0.00 0.00 0.00 0.00 60.65 60.75 2cqy s ILE 10 Cb -0.11 -0.27 0.18 0.00 0.01 0.00 0.00 42.46 42.26 2cqy s ILE 10 CO -0.07 0.20 1.09 -0.70 0.00 0.00 0.00 174.94 175.46 2cqy s GLU 11 N 2.04 0.15 -0.04 2.79 2.12 -1.26 -5.16 118.70 119.33 2cqy s GLU 11 Ca 0.04 0.25 0.00 0.00 0.36 0.00 0.00 54.97 55.62 2cqy s GLU 11 Cb -0.12 0.14 0.03 0.00 0.26 0.00 0.00 34.13 34.43 2cqy s GLU 11 CO -0.04 -0.17 -0.01 -1.54 -0.54 0.00 0.00 175.26 172.96 2cqy s SER 12 N 2.96 0.78 -0.13 -1.70 1.04 -1.26 -5.14 113.70 110.25 2cqy s SER 12 Ca -0.00 -0.06 -0.29 0.00 0.48 0.00 0.00 55.95 56.08 2cqy s SER 12 Cb -0.09 -0.32 0.08 0.00 0.10 0.00 0.00 66.02 65.80 2cqy s SER 12 CO -0.11 -0.11 0.77 -0.75 0.98 0.00 0.00 173.24 174.02 2cqy s LYS 13 N 1.18 0.89 -0.50 4.02 2.20 -1.26 -5.05 119.74 121.22 2cqy s LYS 13 Ca -0.07 0.44 0.02 0.00 -0.36 0.00 0.00 55.97 55.99 2cqy s LYS 13 Cb -0.13 0.43 0.45 0.00 -1.51 0.00 0.00 37.83 37.07 2cqy s LYS 13 CO -0.02 -0.23 1.67 -0.11 -0.36 0.00 0.00 175.35 176.30 2cqy n LEU 14 N 1.38 6.50 -3.15 5.43 7.94 -1.26 -4.87 117.00 128.98 2cqy n LEU 14 Ca -0.16 -4.49 0.05 0.00 -1.11 0.00 0.00 56.01 50.30 2cqy n LEU 14 Cb 0.57 -0.70 -0.01 0.00 0.53 0.00 0.00 43.42 43.80 2cqy n LEU 14 CO 0.16 1.75 0.53 -0.22 -1.11 0.00 0.00 177.39 178.50 2cqy s LEU 15 N -3.73 -0.57 -0.70 -1.96 1.98 -1.26 -5.08 118.68 107.36 2cqy s LEU 15 Ca 0.59 0.33 0.04 0.00 -2.89 0.00 0.00 54.13 52.20 2cqy s LEU 15 Cb 0.47 1.47 0.31 0.00 0.66 0.00 0.00 46.19 49.10 2cqy s LEU 15 CO 0.01 -0.11 1.05 0.00 -1.89 0.00 0.00 176.35 175.41 2cqy n ALA 16 N 5.45 4.73 -3.07 5.97 0.00 -1.26 -5.02 120.51 127.30 2cqy n ALA 16 Ca -0.05 -4.73 -0.11 0.00 0.00 0.00 0.00 53.44 48.55 2cqy n ALA 16 Cb 0.54 -1.11 -0.10 0.00 0.00 0.00 0.00 19.45 18.78 2cqy n ALA 16 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2cqy s LYS 17 N -3.24 0.53 -0.24 0.00 1.02 -1.26 -5.08 119.74 111.47 2cqy s LYS 17 Ca 0.43 -0.43 -0.17 0.00 0.02 0.00 0.00 55.97 55.82 2cqy s LYS 17 Cb 0.21 0.22 -0.15 0.00 -0.52 0.00 0.00 37.83 37.59 2cqy s LYS 17 CO -0.08 -0.13 -0.11 1.63 -0.92 0.00 0.00 175.35 175.74 2cqy n LYS 18 N 1.31 0.57 -3.65 1.68 5.02 -1.26 -5.04 118.16 116.79 2cqy n LYS 18 Ca -0.22 0.40 -0.00 0.00 -2.02 0.00 0.00 58.31 56.47 2cqy n LYS 18 Cb 0.56 -1.60 -0.06 0.00 -0.02 0.00 0.00 35.03 33.90 2cqy n LYS 18 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2cqy s ALA 19 N -2.46 -2.46 0.00 7.82 0.00 -1.26 -5.16 121.76 118.24 2cqy s ALA 19 Ca -0.34 2.02 -0.20 0.00 0.00 0.00 0.00 51.96 53.45 2cqy s ALA 19 Cb 0.11 -1.85 -0.06 0.00 0.00 0.00 0.00 23.12 21.32 2cqy s ALA 19 CO 0.52 -0.30 0.56 -2.00 0.00 0.00 0.00 175.76 174.55 2cqy s GLU 20 N 1.00 4.26 0.44 0.00 2.56 -1.26 -5.08 118.70 120.62 2cqy s GLU 20 Ca -0.06 0.68 -0.04 0.00 0.00 0.00 0.00 54.97 55.55 2cqy s GLU 20 Cb -0.03 -3.32 -0.04 0.00 2.00 0.00 0.00 34.13 32.75 2cqy s GLU 20 CO -0.12 0.44 0.72 0.54 -0.56 0.00 0.00 175.26 176.28 2cqy s VAL 21 N -0.39 4.96 -0.25 3.70 0.11 -1.26 -5.03 120.40 122.24 2cqy s VAL 21 Ca 0.29 0.04 -0.05 0.00 -2.93 0.00 0.00 61.98 59.33 2cqy s VAL 21 Cb -0.18 -3.86 -0.17 0.00 -1.53 0.00 0.00 36.38 30.64 2cqy s VAL 21 CO 0.17 -0.76 -0.17 -3.20 -3.33 0.00 0.00 175.10 167.80 2cqy n ASN 22 N -2.11 1.99 -4.16 3.54 5.15 -1.26 -5.04 115.26 113.36 2cqy n ASN 22 Ca -0.01 0.06 -0.28 0.00 -0.60 0.00 0.00 54.58 53.76 2cqy n ASN 22 Cb 0.55 -0.61 -0.07 0.00 -0.53 0.00 0.00 39.78 39.12 2cqy n ASN 22 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2cqy s THR 23 N -2.51 0.58 0.32 -0.44 -4.23 -1.26 -5.12 115.64 102.99 2cqy s THR 23 Ca -0.34 -2.00 -0.29 0.00 -1.18 0.00 0.00 61.69 57.88 2cqy s THR 23 Cb 0.10 -2.21 -0.11 0.00 1.34 0.00 0.00 72.50 71.62 2cqy s THR 23 CO 0.59 0.00 1.51 -0.63 -0.54 0.00 0.00 174.62 175.55 2cqy s ILE 24 N -3.11 2.18 -1.18 2.99 1.01 -1.26 -4.86 121.20 116.97 2cqy s ILE 24 Ca 0.17 0.16 -0.23 0.00 0.00 0.00 0.00 60.65 60.76 2cqy s ILE 24 Cb 0.01 -3.10 -0.09 0.00 0.01 0.00 0.00 42.46 39.28 2cqy s ILE 24 CO 0.12 0.03 1.93 -0.81 0.00 0.00 0.00 174.94 176.22 2cqy n PRO 25 N 1.42 1.60 0.00 2.79 -0.04 -1.26 -4.82 135.00 134.70 2cqy n PRO 25 Ca 0.05 -2.45 0.00 0.00 -0.04 0.00 0.00 63.50 61.05 2cqy n PRO 25 Cb 0.39 -3.70 0.00 0.00 -0.04 0.00 0.00 33.50 30.14 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 5.73 -1.32 3.64 0.55 0.00 -1.26 -4.99 105.19 107.55 2cqy n GLY 26 Ca 0.45 -1.27 -0.04 0.00 0.00 0.00 0.00 46.02 45.16 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 -0.42 -0.06 1.61 5.36 -1.24 -4.89 117.98 118.35 2cqy s PHE 27 Ca 0.00 0.91 0.05 0.00 -0.96 0.00 0.00 56.93 56.93 2cqy s PHE 27 Cb 0.00 0.33 -0.07 0.00 -0.34 0.00 0.00 43.02 42.94 2cqy s PHE 27 CO 0.00 -0.21 0.03 -3.47 -1.46 0.00 0.00 175.22 170.11 2cqy n ASP 28 N 2.91 3.53 -4.03 6.13 2.03 -1.26 -4.16 116.55 121.70 2cqy n ASP 28 Ca -0.15 0.00 -0.44 0.00 0.52 0.00 0.00 54.79 54.72 2cqy n ASP 28 Cb 0.57 0.69 -0.13 0.00 -0.72 0.00 0.00 41.12 41.53 2cqy n ASP 28 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2cqy n GLY 29 N 2.60 -0.34 3.63 0.27 0.00 -1.26 -4.77 105.19 105.33 2cqy n GLY 29 Ca -0.09 1.05 -0.45 0.00 0.00 0.00 0.00 46.02 46.53 2cqy n GLY 29 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2cqy n VAL 30 N 6.53 1.63 -2.71 1.61 0.31 -1.26 -4.78 118.33 119.65 2cqy n VAL 30 Ca 0.57 -0.41 -0.34 0.00 -0.01 0.00 0.00 64.34 64.15 2cqy n VAL 30 Cb 0.00 -1.23 -0.06 0.00 -0.91 0.00 0.00 33.84 31.64 2cqy n VAL 30 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2cqy s VAL 31 N -0.74 4.15 -0.24 2.52 1.01 -1.23 -4.99 120.40 120.87 2cqy s VAL 31 Ca 0.62 1.38 0.02 0.00 0.00 0.00 0.00 61.98 63.99 2cqy s VAL 31 Cb -0.67 -3.58 -0.16 0.00 0.00 0.00 0.00 36.38 31.97 2cqy s VAL 31 CO 0.57 -0.25 -0.22 0.29 0.00 0.00 0.00 175.10 175.50 2cqy n LYS 32 N -0.64 0.61 -3.68 2.72 4.76 -1.26 -4.53 118.16 116.13 2cqy n LYS 32 Ca 0.07 0.14 -0.13 0.00 -2.87 0.00 0.00 58.31 55.52 2cqy n LYS 32 Cb 0.53 -1.49 -0.07 0.00 -1.84 0.00 0.00 35.03 32.16 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 -6.37 -0.28 0.28 4.39 1.11 -1.26 -5.03 116.67 109.51 2cqy s ASP 33 Ca -0.33 0.09 -0.06 0.00 0.18 0.00 0.00 52.55 52.42 2cqy s ASP 33 Cb 0.08 0.40 0.51 0.00 1.07 0.00 0.00 42.92 44.99 2cqy s ASP 33 CO 0.56 -0.59 1.56 0.00 1.18 0.00 0.00 175.17 177.88 2cqy h ALA 34 N 3.27 0.75 -0.47 5.23 0.00 -1.92 0.52 119.26 126.64 2cqy h ALA 34 Ca -0.30 0.38 0.09 0.00 0.00 0.00 0.00 54.91 55.08 2cqy h ALA 34 Cb 1.19 0.73 -0.08 0.00 0.00 0.00 0.00 17.79 19.63 2cqy h ALA 34 CO 0.42 -0.42 -0.00 0.93 0.00 0.00 0.00 179.25 180.18 2cqy h GLU 35 N 0.00 0.11 -0.91 0.00 5.08 -1.96 -0.71 114.58 116.19 2cqy h GLU 35 Ca 0.50 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.86 2cqy h GLU 35 Cb 0.82 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 30.00 2cqy h GLU 35 CO -1.01 0.07 0.57 1.49 -1.00 0.00 0.00 179.01 179.14 2cqy h GLU 36 N 0.11 1.21 -0.94 2.33 4.57 -0.40 -2.31 114.58 119.15 2cqy h GLU 36 Ca 0.24 -0.09 0.08 0.00 -1.18 0.00 0.00 59.36 58.40 2cqy h GLU 36 Cb 0.35 -0.26 -0.07 0.00 -0.16 0.00 0.00 28.75 28.61 2cqy h GLU 36 CO -0.40 0.83 0.59 0.00 -1.18 0.00 0.00 179.01 178.85 2cqy h ALA 37 N 1.39 1.33 0.36 2.92 0.00 0.02 -2.18 119.26 123.09 2cqy h ALA 37 Ca 0.33 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 2cqy h ALA 37 Cb -0.10 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2cqy h ALA 37 CO -0.07 0.32 -0.28 0.28 0.00 0.00 0.00 179.25 179.50 2cqy h VAL 38 N 1.04 0.42 -0.21 0.00 2.07 -0.86 0.30 116.25 119.01 2cqy h VAL 38 Ca 0.42 0.00 0.06 0.00 0.82 0.00 0.00 66.70 68.00 2cqy h VAL 38 Cb 0.25 0.42 -0.06 0.00 -1.52 0.00 0.00 31.29 30.37 2cqy h VAL 38 CO -0.20 0.00 -0.20 0.03 0.02 0.00 0.00 177.57 177.22 2cqy h ARG 39 N -0.64 -0.21 -0.60 1.57 -0.00 -1.42 0.86 114.38 113.95 2cqy h ARG 39 Ca -0.03 0.01 0.06 0.00 -0.50 0.00 0.00 59.98 59.53 2cqy h ARG 39 Cb 0.56 0.05 -0.05 0.00 0.00 0.00 0.00 29.97 30.52 2cqy h ARG 39 CO -0.01 -0.14 0.31 0.82 0.00 0.00 0.00 179.97 180.95 2cqy h ILE 40 N -0.21 0.92 0.81 2.04 2.04 -1.25 -2.52 117.51 119.35 2cqy h ILE 40 Ca 0.13 -0.20 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 2cqy h ILE 40 Cb 0.40 0.30 0.01 0.00 -0.74 0.00 0.00 36.82 36.80 2cqy h ILE 40 CO -0.34 0.10 -0.39 0.00 0.00 0.00 0.00 178.15 177.53 2cqy h ALA 41 N 1.34 -1.25 -1.35 1.87 0.00 -0.10 -1.86 119.26 117.90 2cqy h ALA 41 Ca 0.28 -0.24 0.45 0.00 0.00 0.00 0.00 54.91 55.40 2cqy h ALA 41 Cb 0.21 0.42 -0.13 0.00 0.00 0.00 0.00 17.79 18.29 2cqy h ALA 41 CO -0.20 -1.17 0.87 0.00 0.00 0.00 0.00 179.25 178.75 2cqy h ARG 42 N -1.13 0.06 0.18 0.00 3.08 -0.75 0.33 114.38 116.16 2cqy h ARG 42 Ca -0.11 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 2cqy h ARG 42 Cb 0.84 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.87 2cqy h ARG 42 CO 0.18 0.04 -0.08 0.93 -1.07 0.00 0.00 179.97 179.97 2cqy h GLU 43 N 0.06 -0.23 -0.43 0.04 4.39 -1.14 -3.29 114.58 113.99 2cqy h GLU 43 Ca 0.84 0.02 0.06 0.00 0.34 0.00 0.00 59.36 60.62 2cqy h GLU 43 Cb 2.66 0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 31.31 2cqy h GLU 43 CO -0.42 0.18 0.11 0.82 -1.16 0.00 0.00 179.01 178.54 2cqy h ILE 44 N -0.77 0.80 0.00 3.13 2.04 0.38 -3.45 117.51 119.64 2cqy h ILE 44 Ca -0.02 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.75 2cqy h ILE 44 Cb 0.52 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 37.13 2cqy h ILE 44 CO 0.04 0.05 0.00 0.61 0.00 0.00 0.00 178.15 178.85 2cqy n GLY 45 N -1.25 1.71 3.71 5.37 0.00 0.08 -4.79 105.19 110.01 2cqy n GLY 45 Ca 0.03 -0.86 -0.35 0.00 0.00 0.00 0.00 46.02 44.85 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 1.89 0.76 1.61 2.02 -1.26 -4.48 117.35 117.89 2cqy s TYR 46 Ca 0.00 1.60 -0.11 0.00 -0.37 0.00 0.00 57.07 58.19 2cqy s TYR 46 Cb 0.00 -3.57 0.05 0.00 -0.40 0.00 0.00 41.96 38.04 2cqy s TYR 46 CO 0.00 -2.91 1.09 -1.25 -1.57 0.00 0.00 175.55 170.92 2cqy s PRO 47 N -3.85 2.32 -0.07 -1.71 0.04 -1.26 -5.00 135.00 125.46 2cqy s PRO 47 Ca 0.77 1.20 0.01 0.00 0.04 0.00 0.00 61.00 63.01 2cqy s PRO 47 Cb -0.32 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.34 2cqy s PRO 47 CO 0.47 -1.60 -0.07 0.14 0.04 0.00 0.00 177.00 175.98 2cqy s VAL 48 N -2.83 0.79 0.06 -0.36 -7.23 -0.00 -2.32 120.40 108.50 2cqy s VAL 48 Ca 0.62 -0.22 -0.20 0.00 -1.81 0.00 0.00 61.98 60.37 2cqy s VAL 48 Cb -0.18 -0.80 -0.06 0.00 0.56 0.00 0.00 36.38 35.90 2cqy s VAL 48 CO 0.54 0.30 0.58 -0.32 -0.31 0.00 0.00 175.10 175.89 2cqy s MET 49 N 1.22 4.24 -0.08 4.82 1.75 0.55 -1.16 119.30 130.64 2cqy s MET 49 Ca -0.05 0.75 0.04 0.00 -1.25 0.00 0.00 55.69 55.17 2cqy s MET 49 Cb -0.14 -3.26 -0.01 0.00 2.84 0.00 0.00 34.83 34.25 2cqy s MET 49 CO -0.02 0.57 -0.20 0.42 -0.65 0.00 0.00 175.02 175.14 2cqy s ILE 50 N -0.88 2.48 0.08 10.11 1.01 -0.06 -0.27 121.20 133.67 2cqy s ILE 50 Ca 0.30 -0.90 0.04 0.00 0.00 0.00 0.00 60.65 60.08 2cqy s ILE 50 Cb -0.19 -1.96 -0.03 0.00 0.01 0.00 0.00 42.46 40.29 2cqy s ILE 50 CO 0.19 0.56 -0.10 -0.54 0.00 0.00 0.00 174.94 175.05 2cqy s LYS 51 N -0.08 0.75 -0.38 2.79 1.02 -0.43 -2.75 119.74 120.67 2cqy s LYS 51 Ca -0.05 -1.01 -0.29 0.00 0.02 0.00 0.00 55.97 54.64 2cqy s LYS 51 Cb -0.14 -0.52 0.02 0.00 -0.52 0.00 0.00 37.83 36.67 2cqy s LYS 51 CO 0.04 0.09 1.10 0.00 -0.92 0.00 0.00 175.35 175.66 2cqy s ALA 52 N -1.94 3.37 0.22 5.17 0.00 -1.26 0.19 121.76 127.51 2cqy s ALA 52 Ca -0.00 -0.22 -0.12 0.00 0.00 0.00 0.00 51.96 51.62 2cqy s ALA 52 Cb -0.06 -3.75 0.28 0.00 0.00 0.00 0.00 23.12 19.58 2cqy s ALA 52 CO 0.00 -1.77 1.62 1.03 0.00 0.00 0.00 175.76 176.64 2cqy h SER 53 N 8.51 -0.60 -1.73 0.00 0.87 -1.09 2.00 113.55 121.51 2cqy h SER 53 Ca -0.21 0.20 0.53 0.00 -1.23 0.00 0.00 61.79 61.08 2cqy h SER 53 Cb 1.06 0.41 -0.10 0.00 -0.44 0.00 0.00 62.40 63.33 2cqy h SER 53 CO 1.07 -0.22 1.20 0.00 -0.53 0.00 0.00 176.83 178.35 2cqy h ALA 54 N 1.68 3.45 0.00 6.23 0.00 -1.86 -3.21 119.26 125.55 2cqy h ALA 54 Ca 0.33 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.11 2cqy h ALA 54 Cb 0.52 0.19 -0.12 0.00 0.00 0.00 0.00 17.79 18.37 2cqy h ALA 54 CO -0.69 -2.06 -0.08 0.41 0.00 0.00 0.00 179.25 176.83 2cqy n GLY 55 N -1.76 -0.58 0.00 0.00 0.00 0.11 -5.02 105.19 97.94 2cqy n GLY 55 Ca 0.43 0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.86 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 0.20 -2.17 0.00 -0.02 0.00 0.64 -4.72 105.19 99.12 2cqy n GLY 56 Ca -0.06 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 44.94 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 1.54 2.97 0.00 -0.02 0.00 -1.26 -4.50 105.19 103.92 2cqy n GLY 57 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 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 0.97 1.84 -0.02 0.00 -1.26 -5.02 105.19 101.70 2cqy n GLY 58 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 0.00 1.86 0.00 1.61 4.01 -1.26 -4.60 118.16 119.78 2cqy n LYS 59 Ca 0.00 -1.93 0.00 0.00 -0.51 0.00 0.00 58.31 55.87 2cqy n LYS 59 Cb 0.00 -1.76 0.00 0.00 -0.51 0.00 0.00 35.03 32.76 2cqy n LYS 59 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2cqy n GLY 60 N -0.37 1.88 2.30 0.72 0.00 -1.26 -5.13 105.19 103.33 2cqy n GLY 60 Ca 0.38 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.31 -3.32 -4.27 1.61 0.00 -1.26 -5.05 117.12 104.52 2cqy n MET 61 Ca 0.00 -1.10 -0.25 0.00 0.00 0.00 0.00 57.70 56.35 2cqy n MET 61 Cb 0.00 -1.23 -0.08 0.00 0.00 0.00 0.00 33.22 31.91 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 -4.57 2.24 0.05 3.17 3.52 -1.11 -5.02 118.95 117.25 2cqy s ARG 62 Ca 0.48 -1.29 0.06 0.00 -0.13 0.00 0.00 55.73 54.84 2cqy s ARG 62 Cb -0.07 -2.21 -0.03 0.00 -1.56 0.00 0.00 34.95 31.09 2cqy s ARG 62 CO 0.38 0.41 -0.16 0.42 -0.81 0.00 0.00 175.30 175.54 2cqy s ILE 63 N -1.97 1.30 0.17 4.11 1.01 -1.26 -0.88 121.20 123.68 2cqy s ILE 63 Ca 0.28 -1.17 0.09 0.00 0.00 0.00 0.00 60.65 59.85 2cqy s ILE 63 Cb -0.08 -1.18 -0.04 0.00 0.01 0.00 0.00 42.46 41.17 2cqy s ILE 63 CO 0.18 -0.01 -0.18 0.00 0.00 0.00 0.00 174.94 174.93 2cqy s ALA 64 N -0.96 2.04 0.00 9.38 0.00 -0.31 -4.95 121.76 126.96 2cqy s ALA 64 Ca 0.03 -1.51 0.00 0.00 0.00 0.00 0.00 51.96 50.48 2cqy s ALA 64 Cb -0.09 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.85 2cqy s ALA 64 CO 0.02 0.23 0.00 0.91 0.00 0.00 0.00 175.76 176.92 2cqy n TRP 65 N 0.25 0.00 -4.24 0.00 7.02 -1.26 -0.82 117.44 118.38 2cqy n TRP 65 Ca -0.13 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.22 2cqy n TRP 65 Cb 0.57 0.00 -0.10 0.00 -2.42 0.00 0.00 31.31 29.36 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 -2.38 1.08 0.23 -0.99 1.01 -1.26 -4.73 116.67 109.62 2cqy s ASP 66 Ca 0.00 -1.21 -0.11 0.00 0.71 0.00 0.00 52.55 51.94 2cqy s ASP 66 Cb 0.00 0.15 0.32 0.00 1.01 0.00 0.00 42.92 44.40 2cqy s ASP 66 CO 0.00 -0.61 1.63 -2.24 0.21 0.00 0.00 175.17 174.15 2cqy h ASP 67 N 2.68 -0.52 -0.64 0.27 2.03 -1.98 0.17 116.42 118.43 2cqy h ASP 67 Ca -0.37 0.20 0.10 0.00 -0.73 0.00 0.00 57.03 56.23 2cqy h ASP 67 Cb 1.21 0.39 -0.07 0.00 -0.83 0.00 0.00 39.33 40.02 2cqy h ASP 67 CO 0.62 -0.20 0.25 1.05 -1.03 0.00 0.00 179.24 179.93 2cqy h GLU 68 N 0.04 0.42 -0.52 4.15 4.11 -2.00 -1.29 114.58 119.49 2cqy h GLU 68 Ca 0.35 -0.03 -0.09 0.00 0.07 0.00 0.00 59.36 59.66 2cqy h GLU 68 Cb 0.56 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 2cqy h GLU 68 CO -0.67 0.28 -0.03 0.93 0.07 0.00 0.00 179.01 179.58 2cqy h GLU 69 N 0.44 0.95 0.18 1.06 5.08 -1.19 -2.08 114.58 119.01 2cqy h GLU 69 Ca 0.33 -0.32 0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2cqy h GLU 69 Cb 0.41 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 2cqy h GLU 69 CO -0.31 0.98 -0.28 1.15 -1.00 0.00 0.00 179.01 179.55 2cqy h THR 70 N 0.81 0.40 0.48 1.13 2.02 0.19 0.49 112.91 118.45 2cqy h THR 70 Ca 0.14 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.30 2cqy h THR 70 Cb 0.57 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 2cqy h THR 70 CO 0.03 0.00 -0.26 0.03 0.37 0.00 0.00 175.52 175.69 2cqy h ARG 71 N -0.52 -0.67 -0.84 6.66 3.08 -1.27 0.41 114.38 121.22 2cqy h ARG 71 Ca 0.02 0.05 0.11 0.00 0.07 0.00 0.00 59.98 60.22 2cqy h ARG 71 Cb 0.52 0.15 -0.06 0.00 0.08 0.00 0.00 29.97 30.67 2cqy h ARG 71 CO -0.12 -0.44 0.55 -0.44 -1.07 0.00 0.00 179.97 178.44 2cqy h ASP 72 N -0.69 0.68 1.16 7.04 5.19 -1.26 -0.40 116.42 128.14 2cqy h ASP 72 Ca -0.06 0.02 -0.13 0.00 -0.62 0.00 0.00 57.03 56.24 2cqy h ASP 72 Cb 0.55 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 39.92 2cqy h ASP 72 CO 0.08 0.39 -0.63 1.23 -3.12 0.00 0.00 179.24 177.19 2cqy h GLY 73 N 0.75 0.00 1.70 2.75 0.00 0.40 -3.09 103.07 105.58 2cqy h GLY 73 Ca 0.40 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.55 2cqy h GLY 73 CO -0.16 0.00 -0.73 -2.75 0.00 0.00 0.00 176.54 172.90 2cqy h PHE 74 N 0.00 0.40 -0.24 5.60 3.57 0.14 -2.25 116.94 124.16 2cqy h PHE 74 Ca -0.01 -0.18 -0.12 0.00 3.53 0.00 0.00 57.97 61.19 2cqy h PHE 74 Cb 1.39 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 40.06 2cqy h PHE 74 CO 0.00 0.92 -0.34 0.00 -2.23 0.00 0.00 178.31 176.66 2cqy h ARG 75 N 0.20 0.65 0.52 1.11 3.08 -1.27 -2.57 114.38 116.10 2cqy h ARG 75 Ca -0.03 -0.38 -0.03 0.00 0.07 0.00 0.00 59.98 59.62 2cqy h ARG 75 Cb 1.29 0.03 0.01 0.00 0.08 0.00 0.00 29.97 31.38 2cqy h ARG 75 CO 0.12 0.99 -0.25 -0.07 -1.07 0.00 0.00 179.97 179.69 2cqy h LEU 76 N 0.36 -0.59 -1.75 3.04 3.38 -1.56 -2.78 115.31 115.41 2cqy h LEU 76 Ca 0.03 0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.11 2cqy h LEU 76 Cb 0.92 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 2cqy h LEU 76 CO 0.08 -0.29 0.53 0.28 0.09 0.00 0.00 178.44 179.13 2cqy h SER 77 N -0.96 0.00 0.31 -0.43 0.02 -1.53 -1.03 113.55 109.93 2cqy h SER 77 Ca -0.07 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.86 2cqy h SER 77 Cb 0.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.08 2cqy h SER 77 CO 0.12 0.00 -0.15 0.28 -1.14 0.00 0.00 176.83 175.94 2cqy h SER 78 N 0.00 -0.36 -0.98 3.07 0.02 -1.30 -2.79 113.55 111.21 2cqy h SER 78 Ca 0.15 -0.17 0.17 0.00 -0.84 0.00 0.00 61.79 61.11 2cqy h SER 78 Cb 1.22 0.09 -0.10 0.00 0.14 0.00 0.00 62.40 63.75 2cqy h SER 78 CO -0.00 0.10 0.59 1.56 -1.14 0.00 0.00 176.83 177.93 2cqy h GLN 79 N -0.95 0.75 0.00 3.45 4.20 -0.92 -0.26 115.11 121.38 2cqy h GLN 79 Ca -0.04 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.62 2cqy h GLN 79 Cb 0.51 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.12 2cqy h GLN 79 CO 0.07 0.50 0.00 0.39 -0.67 0.00 0.00 178.83 179.12 2cqy n GLU 80 N -4.76 0.00 -0.34 1.46 1.02 -1.04 -1.92 120.64 115.06 2cqy n GLU 80 Ca 0.22 0.51 0.27 0.00 -0.02 0.00 0.00 57.16 58.14 2cqy n GLU 80 Cb 0.52 -1.50 0.57 0.00 -0.02 0.00 0.00 31.44 31.01 2cqy n GLU 80 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2cqy h ALA 81 N -1.97 2.46 -0.28 0.62 0.00 -1.30 1.25 119.26 120.04 2cqy h ALA 81 Ca 0.00 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2cqy h ALA 81 Cb 0.00 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2cqy h ALA 81 CO 0.00 -0.89 0.05 0.00 0.00 0.00 0.00 179.25 178.41 2cqy h ALA 82 N 1.58 1.58 0.00 0.00 0.00 0.04 0.21 119.26 122.67 2cqy h ALA 82 Ca 0.63 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.41 2cqy h ALA 82 Cb 1.81 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.47 2cqy h ALA 82 CO -0.27 0.32 -0.66 0.45 0.00 0.00 0.00 179.25 179.09 2cqy n SER 83 N -4.37 1.43 -0.29 0.00 2.88 0.23 -2.97 113.62 110.54 2cqy n SER 83 Ca 0.01 0.24 -0.01 0.00 -1.33 0.00 0.00 58.87 57.78 2cqy n SER 83 Cb 0.18 -0.62 0.03 0.00 -0.75 0.00 0.00 64.21 63.05 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 -3.92 -0.48 -0.09 -3.46 3.41 0.36 -3.26 113.62 106.18 2cqy n SER 84 Ca -0.09 1.30 -0.18 0.00 -0.26 0.00 0.00 58.87 59.63 2cqy n SER 84 Cb 0.34 -0.30 -0.06 0.00 -0.26 0.00 0.00 64.21 63.94 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 -5.09 0.00 0.00 7.33 3.72 -1.10 -5.05 117.46 117.27 2cqy n PHE 85 Ca 0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 2cqy n PHE 85 Cb 0.30 -0.62 0.00 0.00 -0.94 0.00 0.00 39.48 38.21 2cqy n PHE 85 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2cqy n GLY 86 N 1.88 1.53 3.88 1.37 0.00 0.69 -5.02 105.19 109.51 2cqy n GLY 86 Ca -0.33 -0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.30 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 6.23 -0.08 1.61 1.01 -0.84 -4.55 116.67 120.05 2cqy s ASP 87 Ca 0.00 0.32 0.09 0.00 0.71 0.00 0.00 52.55 53.68 2cqy s ASP 87 Cb 0.00 -1.94 0.41 0.00 1.01 0.00 0.00 42.92 42.41 2cqy s ASP 87 CO 0.00 0.29 1.22 -0.90 0.21 0.00 0.00 175.17 175.98 2cqy n ASP 88 N 1.14 3.05 -4.71 0.27 5.75 -1.26 -1.52 116.55 119.27 2cqy n ASP 88 Ca -0.13 -2.32 -0.42 0.00 -0.01 0.00 0.00 54.79 51.91 2cqy n ASP 88 Cb 0.53 -0.48 -0.03 0.00 -1.03 0.00 0.00 41.12 40.11 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 -1.78 4.19 0.47 0.11 1.81 -1.26 -4.79 118.95 117.71 2cqy s ARG 89 Ca 0.28 2.41 0.04 0.00 -1.72 0.00 0.00 55.73 56.75 2cqy s ARG 89 Cb 0.19 -3.32 -0.03 0.00 -0.45 0.00 0.00 34.95 31.34 2cqy s ARG 89 CO 0.12 -0.69 0.09 -0.51 -0.68 0.00 0.00 175.30 173.63 2cqy s LEU 90 N 1.76 2.64 0.07 2.53 1.43 -1.26 -0.68 118.68 125.16 2cqy s LEU 90 Ca 0.73 -1.43 -0.06 0.00 -1.03 0.00 0.00 54.13 52.34 2cqy s LEU 90 Cb -0.44 -0.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.81 2cqy s LEU 90 CO 0.32 -0.73 0.12 -0.76 0.23 0.00 0.00 176.35 175.53 2cqy s LEU 91 N -3.90 1.74 -0.03 1.79 1.43 0.52 -3.52 118.68 116.71 2cqy s LEU 91 Ca 0.23 -0.68 -0.01 0.00 -1.03 0.00 0.00 54.13 52.64 2cqy s LEU 91 Cb 0.04 0.76 0.03 0.00 0.03 0.00 0.00 46.19 47.04 2cqy s LEU 91 CO 0.13 -0.64 0.03 -0.63 0.23 0.00 0.00 176.35 175.47 2cqy s ILE 92 N -3.53 -0.04 0.09 -0.59 1.01 -1.26 -1.31 121.20 115.57 2cqy s ILE 92 Ca 0.03 0.26 0.03 0.00 0.00 0.00 0.00 60.65 60.96 2cqy s ILE 92 Cb 0.04 -0.13 -0.04 0.00 0.01 0.00 0.00 42.46 42.34 2cqy s ILE 92 CO -0.09 0.12 -0.08 -1.61 0.00 0.00 0.00 174.94 173.28 2cqy s GLU 93 N 1.39 0.80 0.16 2.79 0.41 0.63 -3.60 118.70 121.29 2cqy s GLU 93 Ca -0.05 -1.19 -0.31 0.00 -0.41 0.00 0.00 54.97 53.01 2cqy s GLU 93 Cb -0.13 -0.35 -0.09 0.00 -1.78 0.00 0.00 34.13 31.78 2cqy s GLU 93 CO -0.03 0.03 1.39 0.21 -0.49 0.00 0.00 175.26 176.37 2cqy s LYS 94 N -3.11 4.32 -0.32 1.61 2.47 -1.26 -0.33 119.74 123.11 2cqy s LYS 94 Ca 0.06 2.13 -0.10 0.00 -1.56 0.00 0.00 55.97 56.50 2cqy s LYS 94 Cb -0.00 -3.20 -0.01 0.00 -1.46 0.00 0.00 37.83 33.16 2cqy s LYS 94 CO -0.02 -0.40 0.17 0.12 0.16 0.00 0.00 175.35 175.38 2cqy s PHE 95 N 0.66 3.19 -0.19 4.03 2.19 -0.98 -4.74 117.98 122.14 2cqy s PHE 95 Ca 0.62 -0.55 -0.01 0.00 0.33 0.00 0.00 56.93 57.32 2cqy s PHE 95 Cb -0.38 -2.38 0.05 0.00 -1.31 0.00 0.00 43.02 39.00 2cqy s PHE 95 CO 0.34 -0.46 -0.01 0.42 1.83 0.00 0.00 175.22 177.35 2cqy s ILE 96 N 1.62 0.92 0.14 3.12 1.01 -1.26 -4.36 121.20 122.39 2cqy s ILE 96 Ca 0.05 -0.70 -0.04 0.00 0.00 0.00 0.00 60.65 59.96 2cqy s ILE 96 Cb -0.17 -1.26 -0.17 0.00 0.01 0.00 0.00 42.46 40.87 2cqy s ILE 96 CO 0.07 -0.06 1.32 -0.78 0.00 0.00 0.00 174.94 175.49 2cqy h ASP 97 N 8.14 0.51 -4.01 3.58 3.58 -2.00 -3.46 116.42 122.76 2cqy h ASP 97 Ca -0.19 -0.40 -0.07 0.00 0.42 0.00 0.00 57.03 56.79 2cqy h ASP 97 Cb 1.11 -0.16 -0.22 0.00 1.72 0.00 0.00 39.33 41.78 2cqy h ASP 97 CO 0.37 1.20 -0.01 0.21 -2.88 0.00 0.00 179.24 178.13 2cqy s ASN 98 N -7.06 -0.62 1.16 2.28 2.47 -1.26 -5.17 114.94 106.74 2cqy s ASN 98 Ca -0.06 1.17 -0.18 0.00 0.42 0.00 0.00 52.86 54.22 2cqy s ASN 98 Cb 0.09 1.19 0.27 0.00 -1.45 0.00 0.00 41.25 41.35 2cqy s ASN 98 CO 0.86 -0.23 1.11 -2.16 -3.72 0.00 0.00 177.10 172.96 2cqy s PRO 99 N 0.24 -0.88 -0.24 0.43 0.04 -1.26 -5.09 135.00 128.23 2cqy s PRO 99 Ca -0.01 0.06 -0.27 0.00 0.04 0.00 0.00 61.00 60.82 2cqy s PRO 99 Cb -0.04 -1.62 0.12 0.00 0.04 0.00 0.00 34.50 33.00 2cqy s PRO 99 CO 0.01 -3.51 1.03 0.50 0.04 0.00 0.00 177.00 175.07 2cqy s ARG 100 N -5.31 0.53 1.05 4.56 3.52 -1.26 -5.16 118.95 116.88 2cqy s ARG 100 Ca 0.70 0.43 -0.24 0.00 -0.13 0.00 0.00 55.73 56.49 2cqy s ARG 100 Cb -0.12 0.25 -0.08 0.00 -1.56 0.00 0.00 34.95 33.45 2cqy s ARG 100 CO 0.56 -0.10 -0.96 0.72 -0.81 0.00 0.00 175.30 174.72 2cqy n HIS 101 N 1.70 -1.37 -1.58 5.12 8.25 -1.26 -4.92 115.22 121.17 2cqy n HIS 101 Ca -0.12 0.46 -0.31 0.00 -0.26 0.00 0.00 57.72 57.49 2cqy n HIS 101 Cb 0.57 -1.45 0.05 0.00 1.12 0.00 0.00 29.99 30.28 2cqy n HIS 101 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 2cqy s ILE 102 N -2.09 3.89 0.15 1.59 -5.25 -1.26 -5.08 121.20 113.16 2cqy s ILE 102 Ca 0.44 0.65 -0.18 0.00 -0.99 0.00 0.00 60.65 60.57 2cqy s ILE 102 Cb 0.02 -3.32 0.04 0.00 2.95 0.00 0.00 42.46 42.15 2cqy s ILE 102 CO 0.66 -0.77 0.47 -0.55 -1.79 0.00 0.00 174.94 172.96 2cqy s SER 103 N -3.61 -0.29 0.06 4.36 0.15 -1.26 -5.17 113.70 107.93 2cqy s SER 103 Ca 0.59 -0.33 0.07 0.00 0.70 0.00 0.00 55.95 56.98 2cqy s SER 103 Cb -0.15 0.53 -0.04 0.00 -1.71 0.00 0.00 66.02 64.66 2cqy s SER 103 CO 0.53 -0.94 -0.14 -0.83 1.20 0.00 0.00 173.24 173.06 2cqy s GLY 104 N -2.82 1.68 0.28 9.45 0.00 -1.26 -5.11 107.32 109.54 2cqy s GLY 104 Ca 0.05 -1.19 -0.29 0.00 0.00 0.00 0.00 44.72 43.28 2cqy s GLY 104 CO -0.09 -1.11 1.25 2.56 0.00 0.00 0.00 173.10 175.71 2cqy s PRO 105 N -1.71 4.45 -0.23 2.90 0.04 -1.26 -5.03 135.00 134.15 2cqy s PRO 105 Ca 0.17 2.05 -0.04 0.00 0.04 0.00 0.00 61.00 63.23 2cqy s PRO 105 Cb -0.11 -3.14 0.10 0.00 0.04 0.00 0.00 34.50 31.39 2cqy s PRO 105 CO 0.08 -0.09 0.20 -1.54 0.04 0.00 0.00 177.00 175.69 2cqy s SER 106 N -0.35 1.95 -0.01 6.66 1.04 -1.26 -5.13 113.70 116.59 2cqy s SER 106 Ca 0.50 -0.56 -0.29 0.00 0.48 0.00 0.00 55.95 56.08 2cqy s SER 106 Cb -0.37 0.18 0.10 0.00 0.10 0.00 0.00 66.02 66.03 2cqy s SER 106 CO 0.45 -0.36 0.88 -0.55 0.98 0.00 0.00 173.24 174.64 2cqy s SER 107 N 2.26 -0.38 0.00 7.02 0.15 -1.26 -5.36 113.70 116.14 2cqy s SER 107 Ca 0.07 0.05 0.00 0.00 0.70 0.00 0.00 55.95 56.77 2cqy s SER 107 Cb -0.15 0.39 0.00 0.00 -1.71 0.00 0.00 66.02 64.54 2cqy s SER 107 CO -0.19 -0.61 0.00 0.61 1.20 0.00 0.00 173.24 174.25