#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 5.31 -0.11 1.61 1.04 -1.26 -4.98 113.70 115.32 2cqy s SER 2 Ca 0.00 -1.15 -0.15 0.00 0.48 0.00 0.00 55.95 55.13 2cqy s SER 2 Cb 0.00 -1.87 -0.12 0.00 0.10 0.00 0.00 66.02 64.13 2cqy s SER 2 CO 0.00 -0.33 0.45 0.28 0.98 0.00 0.00 173.24 174.62 2cqy h SER 3 N 8.22 -0.04 -4.20 7.02 0.02 -2.15 -3.50 113.55 118.91 2cqy h SER 3 Ca -0.23 -0.43 0.00 0.00 -0.84 0.00 0.00 61.79 60.29 2cqy h SER 3 Cb 1.08 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.63 2cqy h SER 3 CO 0.60 0.65 -0.71 0.61 -1.14 0.00 0.00 176.83 176.84 2cqy n GLY 4 N 1.49 -4.63 2.75 -3.77 0.00 -1.26 -5.04 105.19 94.73 2cqy n GLY 4 Ca -0.05 -0.56 -0.19 0.00 0.00 0.00 0.00 46.02 45.21 2cqy n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cqy s SER 5 N -1.68 1.36 -0.23 1.61 1.04 -1.26 -5.13 113.70 109.41 2cqy s SER 5 Ca 0.00 -0.10 -0.28 0.00 0.48 0.00 0.00 55.95 56.05 2cqy s SER 5 Cb 0.00 0.20 0.14 0.00 0.10 0.00 0.00 66.02 66.46 2cqy s SER 5 CO 0.00 -0.30 1.08 -0.55 0.98 0.00 0.00 173.24 174.45 2cqy s SER 6 N 2.27 -0.34 0.00 7.02 0.15 -1.26 -5.19 113.70 116.35 2cqy s SER 6 Ca 0.04 0.52 0.00 0.00 0.70 0.00 0.00 55.95 57.22 2cqy s SER 6 Cb -0.14 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.65 2cqy s SER 6 CO -0.09 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.75 2cqy n GLY 7 N 1.36 0.73 3.58 9.45 0.00 -1.26 -5.19 105.19 113.86 2cqy n GLY 7 Ca -0.10 -0.81 -0.06 0.00 0.00 0.00 0.00 46.02 45.05 2cqy n GLY 7 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2cqy s ASP 8 N 0.00 -0.24 -0.16 1.61 -4.77 -1.26 -5.15 116.67 106.70 2cqy s ASP 8 Ca 0.00 -0.07 0.01 0.00 -3.30 0.00 0.00 52.55 49.19 2cqy s ASP 8 Cb 0.00 0.31 0.02 0.00 -1.09 0.00 0.00 42.92 42.16 2cqy s ASP 8 CO 0.00 -0.51 -0.16 -0.54 0.70 0.00 0.00 175.17 174.66 2cqy s LYS 9 N -2.87 2.52 -0.27 2.11 -0.14 -1.26 -5.10 119.74 114.73 2cqy s LYS 9 Ca 0.08 -0.65 -0.19 0.00 -1.36 0.00 0.00 55.97 53.85 2cqy s LYS 9 Cb -0.00 -2.26 0.07 0.00 -1.68 0.00 0.00 37.83 33.96 2cqy s LYS 9 CO -0.06 -0.23 0.68 -1.50 -0.76 0.00 0.00 175.35 173.48 2cqy s ILE 10 N 1.42 -0.00 0.13 2.17 1.10 -1.26 -5.04 121.20 119.72 2cqy s ILE 10 Ca 0.05 0.00 0.04 0.00 -0.51 0.00 0.00 60.65 60.24 2cqy s ILE 10 Cb -0.13 -0.97 -0.20 0.00 0.15 0.00 0.00 42.46 41.30 2cqy s ILE 10 CO -0.11 0.00 1.29 1.05 -2.11 0.00 0.00 174.94 175.06 2cqy h GLU 11 N 6.29 0.08 -6.72 3.50 9.09 -2.07 -3.47 114.58 121.28 2cqy h GLU 11 Ca -0.30 -0.12 -0.52 0.00 0.05 0.00 0.00 59.36 58.48 2cqy h GLU 11 Cb 1.20 0.04 -0.19 0.00 -1.65 0.00 0.00 28.75 28.16 2cqy h GLU 11 CO 0.13 1.01 -0.80 0.43 0.05 0.00 0.00 179.01 179.82 2cqy n SER 12 N -3.46 0.60 -2.23 3.06 7.64 -1.26 -4.78 113.62 113.19 2cqy n SER 12 Ca -0.02 -1.06 -0.28 0.00 1.01 0.00 0.00 58.87 58.51 2cqy n SER 12 Cb 0.91 -1.32 0.05 0.00 -1.01 0.00 0.00 64.21 62.84 2cqy n SER 12 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2cqy n LYS 13 N -3.94 2.36 -3.89 1.43 5.02 -1.26 -4.75 118.16 113.12 2cqy n LYS 13 Ca -0.24 -2.63 -0.30 0.00 -2.02 0.00 0.00 58.31 53.12 2cqy n LYS 13 Cb 0.57 -2.04 -0.12 0.00 -0.02 0.00 0.00 35.03 33.42 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 -3.03 4.75 0.48 -0.35 1.02 -1.26 -5.09 118.68 115.20 2cqy s LEU 14 Ca 0.51 -3.57 -0.12 0.00 0.02 0.00 0.00 54.13 50.98 2cqy s LEU 14 Cb 0.40 -1.67 -0.06 0.00 0.02 0.00 0.00 46.19 44.88 2cqy s LEU 14 CO -0.05 -0.14 0.87 -1.48 0.02 0.00 0.00 176.35 175.56 2cqy s LEU 15 N -1.07 3.66 -0.10 1.79 0.05 -1.26 -4.91 118.68 116.84 2cqy s LEU 15 Ca 0.22 1.27 -0.10 0.00 0.05 0.00 0.00 54.13 55.58 2cqy s LEU 15 Cb -0.11 -4.20 -0.05 0.00 -2.05 0.00 0.00 46.19 39.77 2cqy s LEU 15 CO -0.11 -0.54 -0.21 0.00 -0.55 0.00 0.00 176.35 174.94 2cqy n ALA 16 N -1.70 1.83 -3.38 1.48 0.00 -1.26 -5.04 120.51 112.44 2cqy n ALA 16 Ca 0.04 -0.54 -0.16 0.00 0.00 0.00 0.00 53.44 52.78 2cqy n ALA 16 Cb 0.54 0.18 0.09 0.00 0.00 0.00 0.00 19.45 20.26 2cqy n ALA 16 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2cqy n LYS 17 N -3.94 -6.40 -1.36 0.00 5.02 -1.26 -4.92 118.16 105.30 2cqy n LYS 17 Ca -0.17 0.82 -0.25 0.00 -2.02 0.00 0.00 58.31 56.69 2cqy n LYS 17 Cb 0.45 -5.74 0.11 0.00 -0.02 0.00 0.00 35.03 29.83 2cqy n LYS 17 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2cqy n LYS 18 N -4.02 2.63 -3.66 1.97 4.01 -1.26 -4.91 118.16 112.92 2cqy n LYS 18 Ca -0.28 -3.40 -0.07 0.00 -0.51 0.00 0.00 58.31 54.06 2cqy n LYS 18 Cb 0.66 -2.18 -0.08 0.00 -0.51 0.00 0.00 35.03 32.92 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 -3.58 -1.59 -0.73 7.82 0.00 -1.26 -5.11 121.76 117.31 2cqy s ALA 19 Ca 0.57 2.06 -0.03 0.00 0.00 0.00 0.00 51.96 54.56 2cqy s ALA 19 Cb 0.47 -1.34 0.18 0.00 0.00 0.00 0.00 23.12 22.43 2cqy s ALA 19 CO 0.02 -0.48 0.58 -2.00 0.00 0.00 0.00 175.76 173.87 2cqy s GLU 20 N 1.90 2.85 -1.04 0.00 2.56 -1.26 -4.82 118.70 118.89 2cqy s GLU 20 Ca -0.08 -2.84 -0.05 0.00 0.00 0.00 0.00 54.97 52.00 2cqy s GLU 20 Cb -0.08 -3.82 0.01 0.00 2.00 0.00 0.00 34.13 32.23 2cqy s GLU 20 CO -0.17 -1.22 0.10 0.28 -0.56 0.00 0.00 175.26 173.70 2cqy n VAL 21 N 3.02 -0.94 -0.01 3.70 0.31 -1.26 -4.85 118.33 118.30 2cqy n VAL 21 Ca 0.13 -0.36 -0.00 0.00 -0.01 0.00 0.00 64.34 64.10 2cqy n VAL 21 Cb 0.38 -0.88 -0.00 0.00 -0.91 0.00 0.00 33.84 32.42 2cqy n VAL 21 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 2cqy h ASN 22 N -0.96 0.00 -4.27 4.52 2.35 -2.00 -3.49 115.58 111.72 2cqy h ASN 22 Ca -0.47 0.00 -0.42 0.00 -0.55 0.00 0.00 56.30 54.86 2cqy h ASN 22 Cb 0.99 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 39.27 2cqy h ASN 22 CO 0.47 0.14 -0.31 0.35 -1.65 0.00 0.00 177.43 176.43 2cqy n THR 23 N -2.73 0.00 -3.30 2.81 -2.24 -1.26 -5.13 114.28 102.43 2cqy n THR 23 Ca -0.00 -1.56 -0.38 0.00 -2.27 0.00 0.00 64.05 59.83 2cqy n THR 23 Cb 0.02 0.36 -0.06 0.00 -2.10 0.00 0.00 70.33 68.55 2cqy n THR 23 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2cqy s ILE 24 N -2.26 4.95 -2.00 2.28 1.01 -1.26 -4.95 121.20 118.97 2cqy s ILE 24 Ca 0.02 1.11 0.11 0.00 0.00 0.00 0.00 60.65 61.89 2cqy s ILE 24 Cb 0.00 -3.86 0.30 0.00 0.01 0.00 0.00 42.46 38.91 2cqy s ILE 24 CO 0.02 0.46 1.07 -0.81 0.00 0.00 0.00 174.94 175.67 2cqy n PRO 25 N 2.52 0.49 -3.05 2.79 -0.04 -1.26 -4.73 135.00 131.72 2cqy n PRO 25 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 2cqy n PRO 25 Cb 0.51 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 32.63 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 -1.24 3.50 0.55 0.00 -1.26 -4.88 105.19 101.83 2cqy n GLY 26 Ca 0.08 -0.84 0.00 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 -2.92 -0.92 -1.55 1.61 5.36 -1.26 -5.01 117.98 113.29 2cqy s PHE 27 Ca 0.00 1.60 0.13 0.00 -0.96 0.00 0.00 56.93 57.70 2cqy s PHE 27 Cb 0.00 0.55 0.08 0.00 -0.34 0.00 0.00 43.02 43.31 2cqy s PHE 27 CO 0.00 -0.46 0.88 -0.40 -1.46 0.00 0.00 175.22 173.78 2cqy n ASP 28 N 5.09 1.94 -3.64 6.13 5.75 -1.26 -4.46 116.55 126.11 2cqy n ASP 28 Ca -0.11 -1.47 0.00 0.00 -0.01 0.00 0.00 54.79 53.20 2cqy n ASP 28 Cb 0.52 0.11 0.00 0.00 -1.03 0.00 0.00 41.12 40.72 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 0.82 -2.94 3.02 6.12 0.00 -1.26 -5.00 105.19 105.94 2cqy n GLY 29 Ca 0.07 -0.97 -0.11 0.00 0.00 0.00 0.00 46.02 45.02 2cqy n GLY 29 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cqy s VAL 30 N 0.00 0.06 0.17 1.61 1.01 -1.26 -4.78 120.40 117.21 2cqy s VAL 30 Ca 0.00 -0.52 -0.13 0.00 0.00 0.00 0.00 61.98 61.33 2cqy s VAL 30 Cb 0.00 -0.28 -0.07 0.00 0.00 0.00 0.00 36.38 36.03 2cqy s VAL 30 CO 0.00 -0.29 0.54 -0.69 0.00 0.00 0.00 175.10 174.66 2cqy s VAL 31 N -0.92 4.89 -0.24 2.92 1.01 -1.19 -4.98 120.40 121.89 2cqy s VAL 31 Ca -0.10 0.71 -0.09 0.00 0.00 0.00 0.00 61.98 62.49 2cqy s VAL 31 Cb -0.06 -3.69 -0.11 0.00 0.00 0.00 0.00 36.38 32.51 2cqy s VAL 31 CO 0.00 0.15 -0.29 0.29 0.00 0.00 0.00 175.10 175.25 2cqy n LYS 32 N 0.53 0.53 -3.94 2.72 4.76 -1.26 -4.34 118.16 117.16 2cqy n LYS 32 Ca -0.04 0.21 -0.09 0.00 -2.87 0.00 0.00 58.31 55.52 2cqy n LYS 32 Cb 0.52 -1.39 -0.09 0.00 -1.84 0.00 0.00 35.03 32.23 2cqy n LYS 32 CO 0.00 0.00 0.00 0.16 -1.37 0.00 0.00 177.40 176.19 2cqy s ASP 33 N -7.00 0.21 0.31 4.39 1.47 -1.26 -5.02 116.67 109.77 2cqy s ASP 33 Ca -0.34 -0.63 0.02 0.00 1.18 0.00 0.00 52.55 52.78 2cqy s ASP 33 Cb 0.12 0.25 0.75 0.00 -0.34 0.00 0.00 42.92 43.71 2cqy s ASP 33 CO 0.45 -0.57 1.58 0.00 0.68 0.00 0.00 175.17 177.30 2cqy h ALA 34 N 3.36 1.18 -0.34 2.11 0.00 -1.92 0.54 119.26 124.19 2cqy h ALA 34 Ca -0.33 0.33 0.05 0.00 0.00 0.00 0.00 54.91 54.97 2cqy h ALA 34 Cb 1.18 0.58 -0.05 0.00 0.00 0.00 0.00 17.79 19.50 2cqy h ALA 34 CO 0.54 -0.57 0.06 0.93 0.00 0.00 0.00 179.25 180.21 2cqy h GLU 35 N 0.02 0.17 -0.65 0.00 4.39 -1.96 -1.61 114.58 114.93 2cqy h GLU 35 Ca 0.60 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.29 2cqy h GLU 35 Cb 1.23 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.81 2cqy h GLU 35 CO -0.91 0.11 0.42 1.49 -1.16 0.00 0.00 179.01 178.96 2cqy h GLU 36 N 0.17 0.87 -0.98 2.33 4.57 -0.37 -2.31 114.58 118.86 2cqy h GLU 36 Ca 0.16 -0.06 0.06 0.00 -1.18 0.00 0.00 59.36 58.34 2cqy h GLU 36 Cb 0.19 -0.19 -0.06 0.00 -0.16 0.00 0.00 28.75 28.52 2cqy h GLU 36 CO -0.22 0.59 0.63 0.00 -1.18 0.00 0.00 179.01 178.84 2cqy h ALA 37 N 1.22 1.43 -0.11 2.92 0.00 -0.56 -1.19 119.26 122.98 2cqy h ALA 37 Ca 0.24 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2cqy h ALA 37 Cb -0.07 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.41 2cqy h ALA 37 CO -0.05 0.42 0.05 0.28 0.00 0.00 0.00 179.25 179.95 2cqy h VAL 38 N 1.14 1.14 -0.42 0.00 2.07 -0.78 0.51 116.25 119.91 2cqy h VAL 38 Ca 0.42 -0.41 0.01 0.00 0.82 0.00 0.00 66.70 67.54 2cqy h VAL 38 Cb 0.17 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 2cqy h VAL 38 CO -0.16 0.12 0.26 0.03 0.02 0.00 0.00 177.57 177.84 2cqy h ARG 39 N 0.02 0.52 -0.62 1.57 3.08 -1.05 0.32 114.38 118.23 2cqy h ARG 39 Ca 0.04 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 2cqy h ARG 39 Cb 0.15 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 2cqy h ARG 39 CO -0.00 0.34 0.18 0.82 -1.07 0.00 0.00 179.97 180.24 2cqy h ILE 40 N 0.53 1.25 0.35 2.04 2.04 -1.12 -2.68 117.51 119.91 2cqy h ILE 40 Ca 0.16 -0.86 -0.02 0.00 1.00 0.00 0.00 64.86 65.14 2cqy h ILE 40 Cb -0.03 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 2cqy h ILE 40 CO -0.05 0.33 -0.17 0.00 0.00 0.00 0.00 178.15 178.26 2cqy h ALA 41 N 1.06 -0.47 -1.01 1.87 0.00 -0.53 -2.69 119.26 117.49 2cqy h ALA 41 Ca 0.20 -0.15 0.24 0.00 0.00 0.00 0.00 54.91 55.20 2cqy h ALA 41 Cb 0.31 0.18 -0.11 0.00 0.00 0.00 0.00 17.79 18.17 2cqy h ALA 41 CO -0.00 -0.68 0.62 0.00 0.00 0.00 0.00 179.25 179.19 2cqy h ARG 42 N -0.64 0.53 -0.39 0.00 3.08 -0.91 0.13 114.38 116.18 2cqy h ARG 42 Ca -0.05 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 2cqy h ARG 42 Cb 0.46 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 2cqy h ARG 42 CO 0.08 0.35 0.16 0.93 -1.07 0.00 0.00 179.97 180.42 2cqy h GLU 43 N 0.55 0.58 -0.46 0.04 5.08 -1.27 -3.01 114.58 116.09 2cqy h GLU 43 Ca 0.61 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.80 2cqy h GLU 43 Cb 1.26 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 2cqy h GLU 43 CO -0.39 0.55 0.02 0.82 -1.00 0.00 0.00 179.01 179.00 2cqy h ILE 44 N 0.49 1.26 0.00 3.13 2.04 -0.51 -3.44 117.51 120.48 2cqy h ILE 44 Ca 0.13 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 64.97 2cqy h ILE 44 Cb 0.18 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2cqy h ILE 44 CO -0.01 0.35 0.00 0.61 0.00 0.00 0.00 178.15 179.10 2cqy n GLY 45 N -0.41 1.75 3.73 5.37 0.00 -0.04 -5.00 105.19 110.58 2cqy n GLY 45 Ca 0.00 -0.99 -0.34 0.00 0.00 0.00 0.00 46.02 44.70 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 2.19 0.73 1.61 1.51 -1.26 -4.44 117.35 117.69 2cqy s TYR 46 Ca 0.00 1.59 -0.12 0.00 -1.01 0.00 0.00 57.07 57.53 2cqy s TYR 46 Cb 0.00 -3.40 0.04 0.00 -0.11 0.00 0.00 41.96 38.49 2cqy s TYR 46 CO 0.00 -2.38 1.10 -1.25 -1.11 0.00 0.00 175.55 171.91 2cqy s PRO 47 N -3.95 2.44 -0.05 -1.71 0.04 -1.26 -5.01 135.00 125.49 2cqy s PRO 47 Ca 0.72 1.25 0.01 0.00 0.04 0.00 0.00 61.00 63.02 2cqy s PRO 47 Cb -0.27 -1.91 0.02 0.00 0.04 0.00 0.00 34.50 32.38 2cqy s PRO 47 CO 0.44 -1.51 -0.04 0.14 0.04 0.00 0.00 177.00 176.07 2cqy s VAL 48 N -2.70 0.52 0.21 -0.36 -7.23 0.49 -2.21 120.40 109.13 2cqy s VAL 48 Ca 0.63 -0.11 -0.10 0.00 -1.81 0.00 0.00 61.98 60.60 2cqy s VAL 48 Cb -0.18 -0.56 -0.07 0.00 0.56 0.00 0.00 36.38 36.13 2cqy s VAL 48 CO 0.51 0.23 0.54 -0.32 -0.31 0.00 0.00 175.10 175.74 2cqy s MET 49 N 0.98 3.82 -0.13 4.82 1.75 -0.12 -0.39 119.30 130.03 2cqy s MET 49 Ca -0.10 0.29 0.00 0.00 -1.25 0.00 0.00 55.69 54.63 2cqy s MET 49 Cb -0.14 -2.71 0.02 0.00 2.84 0.00 0.00 34.83 34.84 2cqy s MET 49 CO -0.00 0.36 -0.12 0.42 -0.65 0.00 0.00 175.02 175.02 2cqy s ILE 50 N -1.74 1.39 0.36 10.11 1.01 0.25 -1.37 121.20 131.22 2cqy s ILE 50 Ca 0.45 -0.53 0.08 0.00 0.00 0.00 0.00 60.65 60.65 2cqy s ILE 50 Cb -0.12 -1.33 -0.05 0.00 0.01 0.00 0.00 42.46 40.97 2cqy s ILE 50 CO 0.21 0.43 0.11 -0.54 0.00 0.00 0.00 174.94 175.15 2cqy s LYS 51 N 1.48 2.23 -0.44 2.79 3.01 -0.53 -2.69 119.74 125.59 2cqy s LYS 51 Ca 0.03 -1.71 -0.23 0.00 -1.01 0.00 0.00 55.97 53.06 2cqy s LYS 51 Cb -0.13 -2.03 0.02 0.00 -1.01 0.00 0.00 37.83 34.68 2cqy s LYS 51 CO -0.09 0.05 0.78 0.00 0.51 0.00 0.00 175.35 176.60 2cqy s ALA 52 N -2.51 3.32 0.27 5.17 0.00 -1.26 -0.08 121.76 126.66 2cqy s ALA 52 Ca 0.38 -0.96 -0.02 0.00 0.00 0.00 0.00 51.96 51.36 2cqy s ALA 52 Cb 0.00 -3.44 0.60 0.00 0.00 0.00 0.00 23.12 20.28 2cqy s ALA 52 CO 0.22 -1.84 1.63 1.03 0.00 0.00 0.00 175.76 176.79 2cqy h SER 53 N 8.90 -0.21 0.08 0.00 0.87 -1.01 1.78 113.55 123.95 2cqy h SER 53 Ca -0.25 0.21 -0.02 0.00 -1.23 0.00 0.00 61.79 60.51 2cqy h SER 53 Cb 1.09 0.33 -0.00 0.00 -0.44 0.00 0.00 62.40 63.38 2cqy h SER 53 CO 0.95 -0.19 -0.07 0.00 -0.53 0.00 0.00 176.83 176.98 2cqy h ALA 54 N 1.78 1.87 -0.73 6.23 0.00 -1.84 -3.34 119.26 123.22 2cqy h ALA 54 Ca 0.50 -0.07 -0.34 0.00 0.00 0.00 0.00 54.91 55.00 2cqy h ALA 54 Cb 0.97 -0.01 -0.24 0.00 0.00 0.00 0.00 17.79 18.51 2cqy h ALA 54 CO -0.70 0.09 -0.72 0.41 0.00 0.00 0.00 179.25 178.34 2cqy n GLY 55 N -1.32 1.31 3.86 0.00 0.00 0.35 -4.98 105.19 104.42 2cqy n GLY 55 Ca -0.03 -0.53 -0.30 0.00 0.00 0.00 0.00 46.02 45.16 2cqy n GLY 55 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2cqy s GLY 56 N -1.58 1.62 0.00 -0.02 0.00 0.52 -4.26 107.32 103.59 2cqy s GLY 56 Ca 0.31 -0.38 0.00 0.00 0.00 0.00 0.00 44.72 44.66 2cqy s GLY 56 CO -0.15 0.05 0.00 0.61 0.00 0.00 0.00 173.10 173.61 2cqy n GLY 57 N -2.75 2.94 0.00 0.20 0.00 -1.26 -4.91 105.19 99.40 2cqy n GLY 57 Ca 0.07 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.72 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 1.52 0.35 -0.02 0.00 -1.26 -4.96 105.19 100.82 2cqy n GLY 58 Ca 0.00 0.00 0.27 0.00 0.00 0.00 0.00 46.02 46.29 2cqy n GLY 58 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2cqy h LYS 59 N 1.88 0.24 -0.23 1.61 3.64 -1.93 -3.15 116.57 118.64 2cqy h LYS 59 Ca 0.00 -0.01 -0.23 0.00 -1.27 0.00 0.00 60.65 59.13 2cqy h LYS 59 Cb 0.00 -0.05 -0.22 0.00 -0.41 0.00 0.00 32.23 31.54 2cqy h LYS 59 CO 0.00 0.16 -0.57 0.41 -2.27 0.00 0.00 179.45 177.18 2cqy n GLY 60 N -1.32 1.61 2.20 5.01 0.00 -1.26 -5.14 105.19 106.30 2cqy n GLY 60 Ca 0.33 -0.45 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.77 0.50 -4.30 1.61 0.00 -1.19 -5.04 117.12 107.93 2cqy n MET 61 Ca -0.04 -1.66 -0.19 0.00 0.00 0.00 0.00 57.70 55.82 2cqy n MET 61 Cb 0.85 -0.25 -0.11 0.00 0.00 0.00 0.00 33.22 33.71 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 -3.70 1.19 0.20 3.17 3.52 -1.09 -5.04 118.95 117.20 2cqy s ARG 62 Ca 0.36 -1.42 0.09 0.00 -0.13 0.00 0.00 55.73 54.63 2cqy s ARG 62 Cb -0.02 -1.05 -0.05 0.00 -1.56 0.00 0.00 34.95 32.27 2cqy s ARG 62 CO 0.23 0.19 -0.18 0.42 -0.81 0.00 0.00 175.30 175.15 2cqy s ILE 63 N -2.52 1.98 0.07 4.11 1.01 -1.26 -0.59 121.20 124.00 2cqy s ILE 63 Ca 0.16 -2.12 0.03 0.00 0.00 0.00 0.00 60.65 58.72 2cqy s ILE 63 Cb -0.03 -2.03 -0.03 0.00 0.01 0.00 0.00 42.46 40.38 2cqy s ILE 63 CO 0.05 -0.40 -0.09 0.00 0.00 0.00 0.00 174.94 174.49 2cqy s ALA 64 N -2.40 0.88 -0.00 9.38 0.00 0.48 -4.91 121.76 125.19 2cqy s ALA 64 Ca 0.21 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 51.16 2cqy s ALA 64 Cb -0.04 0.04 -0.00 0.00 0.00 0.00 0.00 23.12 23.11 2cqy s ALA 64 CO 0.09 -0.03 0.00 0.91 0.00 0.00 0.00 175.76 176.73 2cqy n TRP 65 N 0.93 0.00 -4.20 0.00 7.02 -1.26 -0.38 117.44 119.56 2cqy n TRP 65 Ca -0.19 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.16 2cqy n TRP 65 Cb 0.56 -0.00 -0.10 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 -2.91 1.49 0.28 -0.99 1.01 -1.26 -4.73 116.67 109.57 2cqy s ASP 66 Ca -0.00 -0.94 -0.03 0.00 0.71 0.00 0.00 52.55 52.29 2cqy s ASP 66 Cb 0.00 0.03 0.60 0.00 1.01 0.00 0.00 42.92 44.56 2cqy s ASP 66 CO 0.00 -0.35 1.59 -2.24 0.21 0.00 0.00 175.17 174.38 2cqy h ASP 67 N 3.09 -0.55 -0.97 0.27 2.03 -1.97 0.98 116.42 119.29 2cqy h ASP 67 Ca -0.36 0.26 0.12 0.00 -0.73 0.00 0.00 57.03 56.32 2cqy h ASP 67 Cb 1.18 0.48 -0.08 0.00 -0.83 0.00 0.00 39.33 40.08 2cqy h ASP 67 CO 0.60 -0.30 0.62 1.05 -1.03 0.00 0.00 179.24 180.18 2cqy h GLU 68 N 0.03 0.91 -0.13 4.15 4.11 -2.00 -1.28 114.58 120.37 2cqy h GLU 68 Ca 0.52 -0.06 -0.21 0.00 0.07 0.00 0.00 59.36 59.69 2cqy h GLU 68 Cb 0.98 -0.21 0.01 0.00 0.50 0.00 0.00 28.75 30.04 2cqy h GLU 68 CO -0.88 0.61 -0.74 0.93 0.07 0.00 0.00 179.01 179.00 2cqy h GLU 69 N 0.94 0.74 -0.31 1.06 5.08 0.48 -2.41 114.58 120.16 2cqy h GLU 69 Ca 0.48 -0.62 0.05 0.00 -1.00 0.00 0.00 59.36 58.27 2cqy h GLU 69 Cb 0.51 0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.85 2cqy h GLU 69 CO -0.24 1.22 0.05 1.15 -1.00 0.00 0.00 179.01 180.19 2cqy h THR 70 N 0.45 0.84 0.12 1.13 2.02 0.05 0.33 112.91 117.84 2cqy h THR 70 Ca -0.05 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 67.06 2cqy h THR 70 Cb 1.38 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 68.45 2cqy h THR 70 CO 0.15 0.03 -0.06 0.03 0.37 0.00 0.00 175.52 176.04 2cqy h ARG 71 N 0.16 -0.16 -0.96 6.66 3.08 -1.33 0.24 114.38 122.07 2cqy h ARG 71 Ca 0.14 0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.30 2cqy h ARG 71 Cb 0.16 0.04 -0.07 0.00 0.08 0.00 0.00 29.97 30.17 2cqy h ARG 71 CO -0.20 0.15 0.60 -0.44 -1.07 0.00 0.00 179.97 179.01 2cqy h ASP 72 N -0.47 0.91 1.13 7.04 3.32 -1.24 -0.85 116.42 126.26 2cqy h ASP 72 Ca -0.02 0.03 -0.14 0.00 0.02 0.00 0.00 57.03 56.92 2cqy h ASP 72 Cb 0.38 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 2cqy h ASP 72 CO 0.03 0.53 -0.69 1.23 -1.72 0.00 0.00 179.24 178.62 2cqy h GLY 73 N 1.02 0.00 1.58 2.75 0.00 -0.27 -3.19 103.07 104.95 2cqy h GLY 73 Ca 0.45 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.64 2cqy h GLY 73 CO -0.22 0.00 -0.50 -2.75 0.00 0.00 0.00 176.54 173.06 2cqy h PHE 74 N 0.00 0.55 -0.35 5.60 3.04 0.62 0.74 116.94 127.15 2cqy h PHE 74 Ca -0.01 -0.18 -0.08 0.00 3.98 0.00 0.00 57.97 61.68 2cqy h PHE 74 Cb 1.44 -0.11 -0.01 0.00 2.56 0.00 0.00 35.95 39.83 2cqy h PHE 74 CO 0.00 0.86 -0.10 0.00 -2.02 0.00 0.00 178.31 177.05 2cqy h ARG 75 N 0.35 0.68 0.06 1.11 3.08 -1.24 -1.18 114.38 117.26 2cqy h ARG 75 Ca 0.01 -0.27 -0.00 0.00 0.07 0.00 0.00 59.98 59.79 2cqy h ARG 75 Cb 1.01 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.03 2cqy h ARG 75 CO 0.09 0.86 -0.03 -0.07 -1.07 0.00 0.00 179.97 179.75 2cqy h LEU 76 N 0.47 -0.07 -1.75 3.04 3.38 -1.54 -2.23 115.31 116.62 2cqy h LEU 76 Ca 0.09 -0.56 0.12 0.00 0.09 0.00 0.00 57.88 57.62 2cqy h LEU 76 Cb 0.62 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 2cqy h LEU 76 CO 0.04 0.60 0.41 0.28 0.09 0.00 0.00 178.44 179.85 2cqy h SER 77 N -0.83 0.25 0.22 -0.43 0.02 -0.93 -1.49 113.55 110.37 2cqy h SER 77 Ca -0.01 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2cqy h SER 77 Cb 0.63 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.13 2cqy h SER 77 CO 0.01 0.14 -0.11 -1.28 -1.14 0.00 0.00 176.83 174.46 2cqy h SER 78 N 0.27 -0.25 -1.33 3.07 0.87 -1.25 -2.98 113.55 111.95 2cqy h SER 78 Ca 0.28 0.01 0.39 0.00 -1.23 0.00 0.00 61.79 61.24 2cqy h SER 78 Cb 0.74 0.07 -0.06 0.00 -0.44 0.00 0.00 62.40 62.70 2cqy h SER 78 CO -0.06 0.07 0.95 0.06 -0.53 0.00 0.00 176.83 177.31 2cqy h GLN 79 N -0.79 0.02 0.54 2.24 3.07 -1.21 -0.99 115.11 117.99 2cqy h GLN 79 Ca -0.03 -0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.68 2cqy h GLN 79 Cb 0.23 -0.01 0.01 0.00 0.08 0.00 0.00 27.48 27.79 2cqy h GLN 79 CO 0.05 0.02 -0.26 0.93 0.09 0.00 0.00 178.83 179.66 2cqy h GLU 80 N 0.03 -0.70 -1.12 0.06 5.08 -1.32 -2.07 114.58 114.55 2cqy h GLU 80 Ca 0.64 0.05 0.31 0.00 -1.00 0.00 0.00 59.36 59.36 2cqy h GLU 80 Cb 2.51 0.16 -0.10 0.00 0.50 0.00 0.00 28.75 31.82 2cqy h GLU 80 CO -0.04 -0.46 0.73 0.00 -1.00 0.00 0.00 179.01 178.24 2cqy h ALA 81 N -1.37 2.42 -0.23 3.43 0.00 -1.04 0.88 119.26 123.35 2cqy h ALA 81 Ca -0.07 0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 2cqy h ALA 81 Cb 0.55 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2cqy h ALA 81 CO 0.12 -0.88 -0.48 0.00 0.00 0.00 0.00 179.25 178.02 2cqy h ALA 82 N 1.60 0.73 0.00 0.00 0.00 -0.93 -0.26 119.26 120.40 2cqy h ALA 82 Ca 0.65 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2cqy h ALA 82 Cb 1.83 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.52 2cqy h ALA 82 CO -0.31 0.67 -0.44 0.45 0.00 0.00 0.00 179.25 179.62 2cqy n SER 83 N -4.00 0.53 -0.03 0.00 2.88 0.19 -2.79 113.62 110.40 2cqy n SER 83 Ca -0.03 0.07 -0.02 0.00 -1.33 0.00 0.00 58.87 57.56 2cqy n SER 83 Cb 0.57 0.03 -0.01 0.00 -0.75 0.00 0.00 64.21 64.05 2cqy n SER 83 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2cqy n SER 84 N -1.80 0.78 -0.12 -3.46 2.88 0.25 -4.83 113.62 107.32 2cqy n SER 84 Ca 0.05 0.38 -0.21 0.00 -1.33 0.00 0.00 58.87 57.75 2cqy n SER 84 Cb 0.38 -0.65 -0.10 0.00 -0.75 0.00 0.00 64.21 63.09 2cqy n SER 84 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2cqy n PHE 85 N -3.28 0.00 0.00 0.66 3.01 -0.25 -5.04 117.46 112.56 2cqy n PHE 85 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.43 2cqy n PHE 85 Cb 0.13 -0.93 0.00 0.00 -0.01 0.00 0.00 39.48 38.67 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 1.94 1.97 3.84 1.37 0.00 -0.35 -5.01 105.19 108.96 2cqy n GLY 86 Ca -0.46 -0.13 -0.36 0.00 0.00 0.00 0.00 46.02 45.07 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 6.81 0.00 1.61 1.01 -1.23 -4.51 116.67 120.36 2cqy s ASP 87 Ca 0.00 1.02 0.22 0.00 0.71 0.00 0.00 52.55 54.50 2cqy s ASP 87 Cb 0.00 -2.27 0.58 0.00 1.01 0.00 0.00 42.92 42.24 2cqy s ASP 87 CO 0.00 0.16 1.47 -0.90 0.21 0.00 0.00 175.17 176.11 2cqy n ASP 88 N 1.04 2.49 -4.67 0.27 5.75 -1.26 -2.21 116.55 117.96 2cqy n ASP 88 Ca -0.07 -1.85 -0.47 0.00 -0.01 0.00 0.00 54.79 52.39 2cqy n ASP 88 Cb 0.52 -0.17 -0.04 0.00 -1.03 0.00 0.00 41.12 40.39 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 0.87 2.18 -4.25 0.11 1.74 -1.26 -4.74 116.66 111.30 2cqy n ARG 89 Ca 0.17 0.79 -0.26 0.00 -0.77 0.00 0.00 57.85 57.78 2cqy n ARG 89 Cb 0.46 -2.59 -0.07 0.00 -1.02 0.00 0.00 32.46 29.24 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 1.88 2.92 0.06 0.55 1.43 -1.26 -0.50 118.68 123.76 2cqy s LEU 90 Ca 0.83 -1.22 0.01 0.00 -1.03 0.00 0.00 54.13 52.72 2cqy s LEU 90 Cb -0.68 -1.23 -0.03 0.00 0.03 0.00 0.00 46.19 44.28 2cqy s LEU 90 CO 0.42 -0.64 -0.06 -0.76 0.23 0.00 0.00 176.35 175.53 2cqy s LEU 91 N -3.92 2.35 -0.10 1.79 1.43 0.88 -3.17 118.68 117.94 2cqy s LEU 91 Ca 0.35 -0.72 -0.01 0.00 -1.03 0.00 0.00 54.13 52.71 2cqy s LEU 91 Cb 0.04 -0.07 0.03 0.00 0.03 0.00 0.00 46.19 46.22 2cqy s LEU 91 CO 0.19 -0.33 -0.02 -0.63 0.23 0.00 0.00 176.35 175.79 2cqy s ILE 92 N -2.30 0.60 0.05 -0.59 1.01 -1.26 -1.45 121.20 117.26 2cqy s ILE 92 Ca -0.03 -0.07 0.06 0.00 0.00 0.00 0.00 60.65 60.62 2cqy s ILE 92 Cb -0.04 -0.74 -0.03 0.00 0.01 0.00 0.00 42.46 41.67 2cqy s ILE 92 CO -0.02 0.25 -0.17 -1.61 0.00 0.00 0.00 174.94 173.39 2cqy s GLU 93 N 1.88 1.10 0.19 2.79 0.41 -0.47 -4.26 118.70 120.34 2cqy s GLU 93 Ca 0.04 -0.90 -0.33 0.00 -0.41 0.00 0.00 54.97 53.37 2cqy s GLU 93 Cb -0.13 -1.19 -0.13 0.00 -1.78 0.00 0.00 34.13 30.90 2cqy s GLU 93 CO -0.06 0.29 1.64 1.17 -0.49 0.00 0.00 175.26 177.81 2cqy n LYS 94 N 1.69 2.44 -3.71 1.61 3.00 -1.26 -0.95 118.16 120.98 2cqy n LYS 94 Ca -0.18 0.88 -0.37 0.00 -0.00 0.00 0.00 58.31 58.64 2cqy n LYS 94 Cb 0.54 -2.68 -0.11 0.00 0.00 0.00 0.00 35.03 32.78 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 0.98 3.23 -0.34 5.64 5.36 -0.94 -4.73 117.98 127.17 2cqy s PHE 95 Ca 0.76 0.03 0.03 0.00 -0.96 0.00 0.00 56.93 56.79 2cqy s PHE 95 Cb -0.60 -2.27 0.10 0.00 -0.34 0.00 0.00 43.02 39.91 2cqy s PHE 95 CO 0.36 -0.08 0.05 0.42 -1.46 0.00 0.00 175.22 174.51 2cqy s ILE 96 N 1.29 2.39 0.01 3.12 -1.09 -1.26 -4.29 121.20 121.37 2cqy s ILE 96 Ca 0.06 -2.24 -0.20 0.00 -2.23 0.00 0.00 60.65 56.05 2cqy s ILE 96 Cb -0.14 -2.72 -0.22 0.00 -1.58 0.00 0.00 42.46 37.80 2cqy s ILE 96 CO 0.06 -0.55 1.13 -0.78 -1.23 0.00 0.00 174.94 173.56 2cqy h ASP 97 N 7.68 0.53 -2.92 3.58 3.58 -1.97 -3.45 116.42 123.45 2cqy h ASP 97 Ca -0.07 -0.73 -0.62 0.00 0.42 0.00 0.00 57.03 56.03 2cqy h ASP 97 Cb 1.03 -0.16 -0.05 0.00 1.72 0.00 0.00 39.33 41.86 2cqy h ASP 97 CO 0.53 1.18 -0.33 0.54 -2.88 0.00 0.00 179.24 178.28 2cqy s ASN 98 N -6.69 6.57 0.00 2.28 2.20 -1.26 -4.97 114.94 113.07 2cqy s ASN 98 Ca -0.13 0.68 0.15 0.00 -0.94 0.00 0.00 52.86 52.62 2cqy s ASN 98 Cb 0.04 -2.14 0.80 0.00 -2.00 0.00 0.00 41.25 37.95 2cqy s ASN 98 CO 0.82 0.28 1.39 -0.81 -2.94 0.00 0.00 177.10 175.83 2cqy n PRO 99 N 1.38 0.29 0.04 3.55 -0.04 -1.26 -3.78 135.00 135.18 2cqy n PRO 99 Ca -0.13 0.10 -0.02 0.00 -0.04 0.00 0.00 63.50 63.42 2cqy n PRO 99 Cb 0.53 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.48 2cqy n PRO 99 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 2cqy h ARG 100 N 0.00 -0.11 -5.72 0.54 9.65 -1.98 -3.35 114.38 113.42 2cqy h ARG 100 Ca 0.00 0.01 -0.38 0.00 -1.10 0.00 0.00 59.98 58.51 2cqy h ARG 100 Cb 0.10 0.02 -0.06 0.00 -1.39 0.00 0.00 29.97 28.65 2cqy h ARG 100 CO 0.00 -0.07 1.05 -1.58 2.80 0.00 0.00 179.97 182.16 2cqy s HIS 101 N -3.26 2.03 -0.83 2.20 2.46 -1.25 -4.76 115.29 111.89 2cqy s HIS 101 Ca -0.02 0.20 0.03 0.00 0.47 0.00 0.00 55.06 55.74 2cqy s HIS 101 Cb 0.00 -4.18 0.16 0.00 -0.13 0.00 0.00 32.58 28.43 2cqy s HIS 101 CO 0.05 -1.63 0.76 0.44 -2.47 0.00 0.00 174.74 171.88 2cqy n ILE 102 N 7.60 0.56 -3.31 0.89 -6.64 -1.26 -4.83 119.36 112.38 2cqy n ILE 102 Ca 0.41 -0.27 -0.18 0.00 -1.77 0.00 0.00 62.75 60.94 2cqy n ILE 102 Cb 0.47 -0.48 0.06 0.00 -1.44 0.00 0.00 39.64 38.26 2cqy n ILE 102 CO 0.00 0.00 0.00 -0.24 -1.77 0.00 0.00 176.55 174.54 2cqy n SER 103 N 0.12 -4.75 -1.12 7.28 2.88 -1.26 -4.77 113.62 112.00 2cqy n SER 103 Ca 0.06 -0.44 0.12 0.00 -1.33 0.00 0.00 58.87 57.28 2cqy n SER 103 Cb 0.44 -4.08 -0.04 0.00 -0.75 0.00 0.00 64.21 59.78 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 -1.57 -1.70 3.02 0.46 0.00 -1.26 -4.88 105.19 99.26 2cqy n GLY 104 Ca -0.04 -0.71 -0.26 0.00 0.00 0.00 0.00 46.02 45.01 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 -3.48 -2.86 -3.00 1.61 -0.04 -1.26 -5.08 135.00 120.89 2cqy n PRO 105 Ca -0.02 -1.51 -0.20 0.00 -0.04 0.00 0.00 63.50 61.73 2cqy n PRO 105 Cb 0.62 -1.41 0.07 0.00 -0.04 0.00 0.00 33.50 32.74 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 -4.04 4.98 0.18 3.54 0.01 -1.26 -5.08 113.70 112.04 2cqy s SER 106 Ca 0.61 -0.84 0.00 0.00 1.31 0.00 0.00 55.95 57.03 2cqy s SER 106 Cb -0.06 0.35 0.00 0.00 0.21 0.00 0.00 66.02 66.52 2cqy s SER 106 CO 0.47 -1.44 0.00 -0.24 0.41 0.00 0.00 173.24 172.44 2cqy n SER 107 N -2.33 0.19 0.00 2.44 2.88 -1.26 -5.19 113.62 110.35 2cqy n SER 107 Ca 0.16 0.31 0.00 0.00 -1.33 0.00 0.00 58.87 58.01 2cqy n SER 107 Cb 0.62 0.14 0.00 0.00 -0.75 0.00 0.00 64.21 64.22 2cqy n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42