#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 0.01 -1.26 -5.06 113.70 113.60 2cqy s SER 2 Ca 0.00 0.20 0.00 0.00 1.31 0.00 0.00 55.95 57.46 2cqy s SER 2 Cb 0.00 -0.73 0.00 0.00 0.21 0.00 0.00 66.02 65.50 2cqy s SER 2 CO 0.00 -1.77 0.00 -0.24 0.41 0.00 0.00 173.24 171.64 2cqy n SER 3 N -2.96 0.90 0.00 2.44 2.88 -1.26 -5.16 113.62 110.46 2cqy n SER 3 Ca 0.11 0.12 0.00 0.00 -1.33 0.00 0.00 58.87 57.76 2cqy n SER 3 Cb 0.60 -0.27 0.00 0.00 -0.75 0.00 0.00 64.21 63.79 2cqy n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cqy n GLY 4 N 3.39 0.43 3.84 0.46 0.00 -1.26 -5.11 105.19 106.94 2cqy n GLY 4 Ca 0.00 -1.28 -0.27 0.00 0.00 0.00 0.00 46.02 44.47 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 -4.00 4.52 0.09 1.61 1.04 -1.26 -5.03 113.70 110.67 2cqy s SER 5 Ca 0.00 -1.25 -0.18 0.00 0.48 0.00 0.00 55.95 54.99 2cqy s SER 5 Cb 0.00 0.17 -0.04 0.00 0.10 0.00 0.00 66.02 66.25 2cqy s SER 5 CO 0.00 -0.90 1.12 -1.20 0.98 0.00 0.00 173.24 173.24 2cqy n SER 6 N -1.54 -0.62 0.00 7.02 7.64 -1.26 -4.86 113.62 120.00 2cqy n SER 6 Ca -0.04 1.26 0.00 0.00 1.01 0.00 0.00 58.87 61.09 2cqy n SER 6 Cb 0.65 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 2cqy n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cqy n GLY 7 N -1.15 0.93 3.16 0.23 0.00 -1.26 -5.12 105.19 101.99 2cqy n GLY 7 Ca 0.01 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.75 -0.84 -0.10 1.61 -4.77 -1.26 -5.15 116.67 104.40 2cqy s ASP 8 Ca 0.00 0.55 0.02 0.00 -3.30 0.00 0.00 52.55 49.82 2cqy s ASP 8 Cb 0.00 1.72 0.01 0.00 -1.09 0.00 0.00 42.92 43.56 2cqy s ASP 8 CO 0.00 -0.16 -0.16 -0.54 0.70 0.00 0.00 175.17 175.01 2cqy s LYS 9 N 2.90 2.29 -0.31 2.11 3.01 -1.26 -5.10 119.74 123.39 2cqy s LYS 9 Ca 0.08 -0.60 -0.28 0.00 -1.01 0.00 0.00 55.97 54.15 2cqy s LYS 9 Cb -0.12 -1.88 0.01 0.00 -1.01 0.00 0.00 37.83 34.83 2cqy s LYS 9 CO -0.15 0.00 1.04 0.42 0.51 0.00 0.00 175.35 177.17 2cqy s ILE 10 N 0.80 4.56 0.02 2.17 -1.09 -1.26 -4.98 121.20 121.42 2cqy s ILE 10 Ca -0.10 1.73 -0.29 0.00 -2.23 0.00 0.00 60.65 59.76 2cqy s ILE 10 Cb -0.16 -4.38 0.10 0.00 -1.58 0.00 0.00 42.46 36.45 2cqy s ILE 10 CO 0.01 -0.42 1.07 -1.83 -1.23 0.00 0.00 174.94 172.55 2cqy s GLU 11 N 3.53 0.75 -1.49 2.79 4.04 -1.26 -4.99 118.70 122.08 2cqy s GLU 11 Ca 0.44 -0.37 -0.10 0.00 0.04 0.00 0.00 54.97 54.98 2cqy s GLU 11 Cb -0.13 0.29 0.07 0.00 0.02 0.00 0.00 34.13 34.37 2cqy s GLU 11 CO 0.14 -0.34 0.86 0.45 -1.84 0.00 0.00 175.26 174.53 2cqy n SER 12 N -0.36 -3.52 -4.66 0.83 2.88 -1.26 -4.82 113.62 102.71 2cqy n SER 12 Ca -0.06 -0.82 -0.49 0.00 -1.33 0.00 0.00 58.87 56.17 2cqy n SER 12 Cb 0.61 -3.78 -0.05 0.00 -0.75 0.00 0.00 64.21 60.24 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 -4.55 2.01 -3.04 -1.46 5.02 -1.26 -4.91 118.16 109.97 2cqy n LYS 13 Ca -0.06 0.72 -0.43 0.00 -2.02 0.00 0.00 58.31 56.51 2cqy n LYS 13 Cb 0.57 -2.63 -0.05 0.00 -0.02 0.00 0.00 35.03 32.89 2cqy n LYS 13 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2cqy s LEU 14 N 4.60 4.66 -1.76 -0.35 2.96 -1.26 -4.36 118.68 123.18 2cqy s LEU 14 Ca 0.95 -0.73 -0.20 0.00 -0.22 0.00 0.00 54.13 53.93 2cqy s LEU 14 Cb -0.71 -2.57 0.18 0.00 0.50 0.00 0.00 46.19 43.59 2cqy s LEU 14 CO 0.51 -1.03 0.74 0.18 -1.32 0.00 0.00 176.35 175.44 2cqy n LEU 15 N 6.66 -1.46 -4.58 -0.68 4.77 -1.26 -4.80 117.00 115.66 2cqy n LEU 15 Ca -0.04 -1.08 -0.40 0.00 -0.03 0.00 0.00 56.01 54.47 2cqy n LEU 15 Cb 0.46 -1.95 -0.01 0.00 -2.33 0.00 0.00 43.42 39.59 2cqy n LEU 15 CO 0.58 0.24 1.87 0.00 -1.33 0.00 0.00 177.39 178.75 2cqy s ALA 16 N -3.27 3.00 0.16 -1.18 0.00 -1.26 -4.93 121.76 114.28 2cqy s ALA 16 Ca 0.78 -2.75 0.10 0.00 0.00 0.00 0.00 51.96 50.09 2cqy s ALA 16 Cb -0.43 -4.65 -0.04 0.00 0.00 0.00 0.00 23.12 17.99 2cqy s ALA 16 CO 0.96 -3.69 -0.24 0.15 0.00 0.00 0.00 175.76 172.94 2cqy s LYS 17 N 4.69 1.40 -0.10 0.00 1.02 -1.26 -5.12 119.74 120.38 2cqy s LYS 17 Ca 0.57 -1.41 -0.02 0.00 0.02 0.00 0.00 55.97 55.13 2cqy s LYS 17 Cb 0.03 -1.74 -0.03 0.00 -0.52 0.00 0.00 37.83 35.57 2cqy s LYS 17 CO 0.09 0.39 -0.01 0.15 -0.92 0.00 0.00 175.35 175.04 2cqy s LYS 18 N -2.40 3.07 -0.11 1.68 1.02 -1.26 -5.11 119.74 116.63 2cqy s LYS 18 Ca 0.16 -0.44 0.01 0.00 0.02 0.00 0.00 55.97 55.71 2cqy s LYS 18 Cb -0.09 -2.79 -0.02 0.00 -0.52 0.00 0.00 37.83 34.42 2cqy s LYS 18 CO 0.08 0.62 -0.13 0.00 -0.92 0.00 0.00 175.35 174.99 2cqy s ALA 19 N -0.65 2.63 0.52 5.17 0.00 -1.26 -5.12 121.76 123.05 2cqy s ALA 19 Ca 0.10 -0.90 -0.10 0.00 0.00 0.00 0.00 51.96 51.06 2cqy s ALA 19 Cb -0.12 -1.17 -0.05 0.00 0.00 0.00 0.00 23.12 21.78 2cqy s ALA 19 CO 0.02 0.31 0.90 -2.00 0.00 0.00 0.00 175.76 174.99 2cqy s GLU 20 N 0.13 3.69 0.56 0.00 2.12 -1.26 -5.05 118.70 118.88 2cqy s GLU 20 Ca -0.06 0.57 -0.18 0.00 0.36 0.00 0.00 54.97 55.66 2cqy s GLU 20 Cb -0.15 -2.24 -0.05 0.00 0.26 0.00 0.00 34.13 31.95 2cqy s GLU 20 CO 0.05 -0.30 1.07 0.14 -0.54 0.00 0.00 175.26 175.68 2cqy s VAL 21 N -2.78 3.62 -0.08 3.70 -7.23 -1.26 -5.01 120.40 111.35 2cqy s VAL 21 Ca 0.53 0.88 -0.02 0.00 -1.81 0.00 0.00 61.98 61.56 2cqy s VAL 21 Cb -0.10 -3.35 -0.01 0.00 0.56 0.00 0.00 36.38 33.48 2cqy s VAL 21 CO 0.42 -0.34 -0.03 0.78 -0.31 0.00 0.00 175.10 175.62 2cqy h ASN 22 N 0.87 0.00 -5.42 4.85 2.35 -2.08 -3.50 115.58 112.64 2cqy h ASN 22 Ca -0.48 0.00 0.17 0.00 -0.55 0.00 0.00 56.30 55.44 2cqy h ASN 22 Cb 1.23 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.56 2cqy h ASN 22 CO 0.57 0.42 0.58 0.28 -1.65 0.00 0.00 177.43 177.64 2cqy s THR 23 N -1.54 0.00 -0.23 2.81 -1.32 -1.26 -5.14 115.64 108.95 2cqy s THR 23 Ca -0.03 -0.58 -0.18 0.00 -1.21 0.00 0.00 61.69 59.70 2cqy s THR 23 Cb 0.00 -2.73 -0.03 0.00 -1.51 0.00 0.00 72.50 68.23 2cqy s THR 23 CO 0.04 0.00 0.49 -0.63 -2.21 0.00 0.00 174.62 172.31 2cqy s ILE 24 N -2.33 5.10 -1.66 5.08 1.01 -1.26 -4.94 121.20 122.20 2cqy s ILE 24 Ca 0.20 0.86 0.15 0.00 0.00 0.00 0.00 60.65 61.87 2cqy s ILE 24 Cb -0.02 -3.81 0.33 0.00 0.01 0.00 0.00 42.46 38.96 2cqy s ILE 24 CO 0.04 0.14 1.37 -0.81 0.00 0.00 0.00 174.94 175.69 2cqy n PRO 25 N 5.16 0.32 0.00 2.79 -0.04 -1.26 -4.66 135.00 137.30 2cqy n PRO 25 Ca -0.05 0.09 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 2cqy n PRO 25 Cb 0.50 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 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 -0.04 1.10 3.56 0.55 0.00 -1.26 -4.64 105.19 104.46 2cqy n GLY 26 Ca 0.09 0.51 -0.13 0.00 0.00 0.00 0.00 46.02 46.48 2cqy n GLY 26 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2cqy n PHE 27 N 0.00 1.16 -0.28 1.61 7.35 -1.04 -4.75 117.46 121.50 2cqy n PHE 27 Ca 0.00 -0.02 -0.05 0.00 -0.76 0.00 0.00 57.45 56.62 2cqy n PHE 27 Cb 0.00 -2.61 0.06 0.00 0.35 0.00 0.00 39.48 37.29 2cqy n PHE 27 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 2cqy h ASP 28 N 12.68 0.95 0.00 -2.13 3.32 -1.98 -3.30 116.42 125.96 2cqy h ASP 28 Ca 0.00 -0.09 -0.54 0.00 0.02 0.00 0.00 57.03 56.42 2cqy h ASP 28 Cb 1.00 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.28 2cqy h ASP 28 CO 1.01 0.76 0.95 0.61 -1.72 0.00 0.00 179.24 180.85 2cqy n GLY 29 N -1.12 -0.12 3.75 2.75 0.00 -1.26 -4.78 105.19 104.41 2cqy n GLY 29 Ca 0.07 0.80 -0.41 0.00 0.00 0.00 0.00 46.02 46.47 2cqy n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cqy s VAL 30 N 4.34 2.31 0.76 1.61 0.11 -1.26 -4.73 120.40 123.54 2cqy s VAL 30 Ca 0.86 0.27 -0.11 0.00 -2.93 0.00 0.00 61.98 60.07 2cqy s VAL 30 Cb -1.06 -3.17 0.05 0.00 -1.53 0.00 0.00 36.38 30.67 2cqy s VAL 30 CO 0.46 0.05 1.08 -0.69 -3.33 0.00 0.00 175.10 172.67 2cqy s VAL 31 N -0.24 3.48 -0.10 2.04 1.01 -1.13 -4.95 120.40 120.50 2cqy s VAL 31 Ca 0.59 0.48 -0.02 0.00 0.00 0.00 0.00 61.98 63.03 2cqy s VAL 31 Cb -0.45 -3.04 -0.06 0.00 0.00 0.00 0.00 36.38 32.83 2cqy s VAL 31 CO 0.49 -0.63 -0.11 0.29 0.00 0.00 0.00 175.10 175.14 2cqy n LYS 32 N -3.43 0.24 -4.07 2.72 4.76 -1.26 -4.47 118.16 112.64 2cqy n LYS 32 Ca 0.08 0.08 -0.08 0.00 -2.87 0.00 0.00 58.31 55.52 2cqy n LYS 32 Cb 0.53 -1.06 -0.09 0.00 -1.84 0.00 0.00 35.03 32.57 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 -5.42 0.36 0.19 4.39 1.11 -1.26 -5.04 116.67 111.01 2cqy s ASP 33 Ca -0.14 -1.01 -0.12 0.00 0.18 0.00 0.00 52.55 51.46 2cqy s ASP 33 Cb 0.05 0.26 0.23 0.00 1.07 0.00 0.00 42.92 44.52 2cqy s ASP 33 CO 0.21 -0.67 1.71 0.00 1.18 0.00 0.00 175.17 177.60 2cqy h ALA 34 N 2.98 0.60 -0.84 5.23 0.00 -1.94 -0.39 119.26 124.90 2cqy h ALA 34 Ca -0.34 0.12 0.11 0.00 0.00 0.00 0.00 54.91 54.80 2cqy h ALA 34 Cb 1.17 0.17 -0.08 0.00 0.00 0.00 0.00 17.79 19.05 2cqy h ALA 34 CO 0.62 -0.32 0.47 0.93 0.00 0.00 0.00 179.25 180.95 2cqy h GLU 35 N 0.22 0.74 -0.30 0.00 4.39 -1.97 -0.64 114.58 117.03 2cqy h GLU 35 Ca 0.27 -0.04 -0.12 0.00 0.34 0.00 0.00 59.36 59.81 2cqy h GLU 35 Cb 0.39 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 2cqy h GLU 35 CO -0.37 0.49 -0.31 1.49 -1.16 0.00 0.00 179.01 179.15 2cqy h GLU 36 N 0.76 0.64 -0.49 2.33 4.81 -1.60 -2.70 114.58 118.33 2cqy h GLU 36 Ca 0.42 -0.29 -0.06 0.00 -0.13 0.00 0.00 59.36 59.31 2cqy h GLU 36 Cb 0.44 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 2cqy h GLU 36 CO -0.28 0.87 0.07 0.00 -0.73 0.00 0.00 179.01 178.95 2cqy h ALA 37 N 1.11 1.20 0.10 2.92 0.00 0.31 -1.60 119.26 123.30 2cqy h ALA 37 Ca 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2cqy h ALA 37 Cb 0.81 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2cqy h ALA 37 CO 0.07 0.54 -0.05 0.28 0.00 0.00 0.00 179.25 180.08 2cqy h VAL 38 N 0.74 1.09 -0.19 0.00 2.07 -1.05 -1.09 116.25 117.81 2cqy h VAL 38 Ca 0.16 -0.79 0.03 0.00 0.82 0.00 0.00 66.70 66.91 2cqy h VAL 38 Cb 0.35 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.68 2cqy h VAL 38 CO 0.01 0.19 0.02 0.03 0.02 0.00 0.00 177.57 177.84 2cqy h ARG 39 N -0.51 0.09 0.20 1.57 3.08 -1.41 -1.43 114.38 115.97 2cqy h ARG 39 Ca -0.01 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 2cqy h ARG 39 Cb 0.42 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.44 2cqy h ARG 39 CO 0.02 0.06 -0.13 0.82 -1.07 0.00 0.00 179.97 179.67 2cqy h ILE 40 N 0.09 0.72 -0.59 2.04 2.04 -1.33 -2.69 117.51 117.81 2cqy h ILE 40 Ca 0.09 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.07 2cqy h ILE 40 Cb 0.10 0.72 -0.09 0.00 -0.74 0.00 0.00 36.82 36.81 2cqy h ILE 40 CO -0.13 0.00 0.05 0.00 0.00 0.00 0.00 178.15 178.07 2cqy h ALA 41 N 0.47 0.62 -0.85 1.87 0.00 -0.99 0.90 119.26 121.28 2cqy h ALA 41 Ca -0.02 0.16 0.13 0.00 0.00 0.00 0.00 54.91 55.18 2cqy h ALA 41 Cb 0.27 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.25 2cqy h ALA 41 CO 0.01 -0.36 0.55 0.00 0.00 0.00 0.00 179.25 179.45 2cqy h ARG 42 N 0.17 0.64 -0.50 0.00 3.08 -1.02 -0.49 114.38 116.26 2cqy h ARG 42 Ca 0.31 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 60.21 2cqy h ARG 42 Cb 0.48 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 2cqy h ARG 42 CO -0.45 0.42 -0.12 0.93 -1.07 0.00 0.00 179.97 179.68 2cqy h GLU 43 N 0.66 0.97 -0.46 0.04 5.08 -0.52 -3.04 114.58 117.30 2cqy h GLU 43 Ca 0.42 -0.37 -0.10 0.00 -1.00 0.00 0.00 59.36 58.30 2cqy h GLU 43 Cb 0.67 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 2cqy h GLU 43 CO -0.18 1.04 -0.13 0.82 -1.00 0.00 0.00 179.01 179.56 2cqy h ILE 44 N 0.82 1.26 0.00 3.13 2.04 -0.50 -3.49 117.51 120.78 2cqy h ILE 44 Ca 0.13 -1.23 0.00 0.00 1.00 0.00 0.00 64.86 64.76 2cqy h ILE 44 Cb 0.68 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 2cqy h ILE 44 CO 0.05 0.42 0.00 0.61 0.00 0.00 0.00 178.15 179.23 2cqy n GLY 45 N -0.36 0.78 3.67 5.37 0.00 -0.37 -4.97 105.19 109.32 2cqy n GLY 45 Ca 0.01 -0.85 -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 1.16 1.17 -1.73 1.61 4.01 -1.26 -4.47 117.16 117.64 2cqy n TYR 46 Ca 0.00 0.40 -0.33 0.00 -0.16 0.00 0.00 57.90 57.81 2cqy n TYR 46 Cb 0.00 -2.13 0.05 0.00 -0.31 0.00 0.00 39.34 36.95 2cqy n TYR 46 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2cqy s PRO 47 N -3.71 2.78 -0.08 -0.72 0.04 -1.26 -5.02 135.00 127.03 2cqy s PRO 47 Ca 0.75 1.38 0.01 0.00 0.04 0.00 0.00 61.00 63.18 2cqy s PRO 47 Cb -0.33 -1.95 0.02 0.00 0.04 0.00 0.00 34.50 32.29 2cqy s PRO 47 CO 0.49 -1.27 -0.09 0.14 0.04 0.00 0.00 177.00 176.31 2cqy s VAL 48 N -2.37 1.01 0.33 -0.36 -7.23 -0.62 -2.49 120.40 108.67 2cqy s VAL 48 Ca 0.67 -0.35 -0.18 0.00 -1.81 0.00 0.00 61.98 60.31 2cqy s VAL 48 Cb -0.20 -0.98 -0.09 0.00 0.56 0.00 0.00 36.38 35.67 2cqy s VAL 48 CO 0.42 0.34 0.79 -0.32 -0.31 0.00 0.00 175.10 176.03 2cqy s MET 49 N 1.15 4.13 -0.18 4.82 1.75 0.36 -2.02 119.30 129.32 2cqy s MET 49 Ca -0.06 0.85 -0.00 0.00 -1.25 0.00 0.00 55.69 55.22 2cqy s MET 49 Cb -0.14 -2.48 0.05 0.00 2.84 0.00 0.00 34.83 35.10 2cqy s MET 49 CO -0.02 0.17 -0.04 0.42 -0.65 0.00 0.00 175.02 174.89 2cqy s ILE 50 N -1.92 1.14 0.35 10.11 1.01 -0.66 -1.04 121.20 130.19 2cqy s ILE 50 Ca 0.54 -0.76 0.08 0.00 0.00 0.00 0.00 60.65 60.51 2cqy s ILE 50 Cb -0.12 -1.37 -0.03 0.00 0.01 0.00 0.00 42.46 40.95 2cqy s ILE 50 CO 0.17 0.04 0.23 -0.54 0.00 0.00 0.00 174.94 174.84 2cqy s LYS 51 N 1.60 2.54 -0.40 2.79 3.01 -1.13 -3.18 119.74 124.96 2cqy s LYS 51 Ca -0.01 -1.45 -0.24 0.00 -1.01 0.00 0.00 55.97 53.26 2cqy s LYS 51 Cb -0.16 -2.32 0.02 0.00 -1.01 0.00 0.00 37.83 34.36 2cqy s LYS 51 CO -0.07 0.07 0.84 0.00 0.51 0.00 0.00 175.35 176.69 2cqy s ALA 52 N -2.38 3.36 0.31 5.17 0.00 -1.26 -0.03 121.76 126.92 2cqy s ALA 52 Ca 0.40 -0.72 0.04 0.00 0.00 0.00 0.00 51.96 51.68 2cqy s ALA 52 Cb -0.04 -3.47 0.82 0.00 0.00 0.00 0.00 23.12 20.43 2cqy s ALA 52 CO 0.25 -1.72 1.60 1.03 0.00 0.00 0.00 175.76 176.92 2cqy h SER 53 N 8.71 -0.20 -0.26 0.00 0.87 -1.48 1.59 113.55 122.79 2cqy h SER 53 Ca -0.24 0.25 0.06 0.00 -1.23 0.00 0.00 61.79 60.63 2cqy h SER 53 Cb 1.09 0.38 -0.08 0.00 -0.44 0.00 0.00 62.40 63.35 2cqy h SER 53 CO 0.96 -0.30 -0.33 0.00 -0.53 0.00 0.00 176.83 176.63 2cqy h ALA 54 N 1.91 -0.29 -0.81 6.23 0.00 -1.81 -3.37 119.26 121.13 2cqy h ALA 54 Ca 0.62 0.06 -0.34 0.00 0.00 0.00 0.00 54.91 55.24 2cqy h ALA 54 Cb 1.33 0.66 -0.25 0.00 0.00 0.00 0.00 17.79 19.53 2cqy h ALA 54 CO -0.81 -0.77 -0.74 0.41 0.00 0.00 0.00 179.25 177.34 2cqy n GLY 55 N -1.41 1.64 0.00 0.00 0.00 0.55 -5.08 105.19 100.89 2cqy n GLY 55 Ca -0.01 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.37 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 0.65 -0.35 3.88 -0.02 0.00 0.51 -4.67 105.19 105.20 2cqy n GLY 56 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 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 2.09 -0.36 3.26 -0.02 0.00 -1.26 -2.88 105.19 106.02 2cqy n GLY 57 Ca 0.00 0.15 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.69 -1.20 2.86 -0.02 0.00 -1.26 -4.98 105.19 98.89 2cqy n GLY 58 Ca -0.15 0.51 -0.29 0.00 0.00 0.00 0.00 46.02 46.09 2cqy n GLY 58 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cqy s LYS 59 N -3.89 1.95 -1.69 1.61 -0.14 -1.14 -4.84 119.74 111.59 2cqy s LYS 59 Ca 0.17 -2.72 -0.16 0.00 -1.36 0.00 0.00 55.97 51.89 2cqy s LYS 59 Cb -0.03 -3.06 0.15 0.00 -1.68 0.00 0.00 37.83 33.20 2cqy s LYS 59 CO 0.78 -1.19 0.68 0.41 -0.76 0.00 0.00 175.35 175.26 2cqy n GLY 60 N 2.79 -0.40 2.12 -3.33 0.00 -1.26 -4.94 105.19 100.18 2cqy n GLY 60 Ca 0.12 0.13 -0.15 0.00 0.00 0.00 0.00 46.02 46.12 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 -4.35 -0.41 -4.39 1.61 0.00 -1.26 -5.11 117.12 103.22 2cqy n MET 61 Ca 0.02 -1.24 -0.28 0.00 0.00 0.00 0.00 57.70 56.20 2cqy n MET 61 Cb 0.52 -0.62 -0.12 0.00 0.00 0.00 0.00 33.22 32.99 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 -4.36 1.40 0.01 3.17 3.52 -1.19 -5.03 118.95 116.47 2cqy s ARG 62 Ca 0.40 -1.39 0.07 0.00 -0.13 0.00 0.00 55.73 54.69 2cqy s ARG 62 Cb -0.01 -1.81 -0.02 0.00 -1.56 0.00 0.00 34.95 31.55 2cqy s ARG 62 CO 0.27 0.41 -0.23 0.42 -0.81 0.00 0.00 175.30 175.37 2cqy s ILE 63 N -1.29 1.80 0.14 4.11 1.01 -1.26 -1.65 121.20 124.06 2cqy s ILE 63 Ca 0.15 -1.09 0.09 0.00 0.00 0.00 0.00 60.65 59.81 2cqy s ILE 63 Cb -0.09 -1.52 -0.04 0.00 0.01 0.00 0.00 42.46 40.82 2cqy s ILE 63 CO 0.07 0.40 -0.18 0.00 0.00 0.00 0.00 174.94 175.23 2cqy s ALA 64 N -0.64 2.70 -0.10 9.38 0.00 -0.85 -4.97 121.76 127.26 2cqy s ALA 64 Ca 0.09 -1.43 0.03 0.00 0.00 0.00 0.00 51.96 50.64 2cqy s ALA 64 Cb -0.09 -0.60 -0.03 0.00 0.00 0.00 0.00 23.12 22.40 2cqy s ALA 64 CO 0.00 0.54 0.10 0.91 0.00 0.00 0.00 175.76 177.31 2cqy n TRP 65 N 0.55 0.00 -3.68 0.00 7.02 -1.26 -1.60 117.44 118.48 2cqy n TRP 65 Ca -0.14 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.23 2cqy n TRP 65 Cb 0.54 -0.01 -0.05 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 -1.40 -0.19 0.20 -0.99 1.11 -1.26 -4.79 116.67 109.35 2cqy s ASP 66 Ca 0.01 -0.28 -0.21 0.00 0.18 0.00 0.00 52.55 52.25 2cqy s ASP 66 Cb 0.02 0.44 0.15 0.00 1.07 0.00 0.00 42.92 44.59 2cqy s ASP 66 CO 0.11 -0.78 1.49 -0.90 1.18 0.00 0.00 175.17 176.27 2cqy n ASP 67 N 0.03 -0.74 -0.26 0.27 5.75 -1.26 0.45 116.55 120.79 2cqy n ASP 67 Ca -0.17 1.69 0.05 0.00 -0.01 0.00 0.00 54.79 56.35 2cqy n ASP 67 Cb 0.62 -0.34 0.14 0.00 -1.03 0.00 0.00 41.12 40.52 2cqy n ASP 67 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 2cqy h GLU 68 N 0.00 0.07 -0.48 0.11 4.11 -2.00 0.16 114.58 116.55 2cqy h GLU 68 Ca 0.28 -0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.63 2cqy h GLU 68 Cb 0.52 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 2cqy h GLU 68 CO -0.94 0.04 -0.03 0.93 0.07 0.00 0.00 179.01 179.08 2cqy h GLU 69 N 0.07 0.87 -0.90 1.06 5.08 -0.41 -2.13 114.58 118.21 2cqy h GLU 69 Ca 0.41 -0.29 0.11 0.00 -1.00 0.00 0.00 59.36 58.59 2cqy h GLU 69 Cb 0.70 -0.07 -0.08 0.00 0.50 0.00 0.00 28.75 29.80 2cqy h GLU 69 CO -0.71 0.92 0.54 1.15 -1.00 0.00 0.00 179.01 179.91 2cqy h THR 70 N 0.72 0.90 0.27 1.13 2.02 0.17 0.24 112.91 118.35 2cqy h THR 70 Ca 0.13 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 67.00 2cqy h THR 70 Cb 0.55 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.92 2cqy h THR 70 CO 0.03 0.16 -0.13 0.03 0.37 0.00 0.00 175.52 175.98 2cqy h ARG 71 N 0.86 -0.34 -0.96 6.66 3.08 -1.00 -0.46 114.38 122.22 2cqy h ARG 71 Ca 0.45 0.02 0.15 0.00 0.07 0.00 0.00 59.98 60.67 2cqy h ARG 71 Cb 0.45 0.08 -0.09 0.00 0.08 0.00 0.00 29.97 30.48 2cqy h ARG 71 CO -0.27 0.01 0.58 -0.44 -1.07 0.00 0.00 179.97 178.78 2cqy h ASP 72 N -0.90 0.80 0.26 7.04 5.19 -1.13 -0.69 116.42 126.99 2cqy h ASP 72 Ca -0.04 0.07 -0.19 0.00 -0.62 0.00 0.00 57.03 56.25 2cqy h ASP 72 Cb 0.51 -0.08 -0.00 0.00 0.18 0.00 0.00 39.33 39.94 2cqy h ASP 72 CO 0.06 0.37 -0.77 1.23 -3.12 0.00 0.00 179.24 177.01 2cqy h GLY 73 N 0.84 0.46 1.03 2.75 0.00 -0.56 -2.90 103.07 104.70 2cqy h GLY 73 Ca 0.51 -0.68 -0.06 0.00 0.00 0.00 0.00 47.33 47.10 2cqy h GLY 73 CO -0.32 0.61 0.18 -2.75 0.00 0.00 0.00 176.54 174.26 2cqy h PHE 74 N 0.28 1.06 -0.17 5.60 3.57 0.26 0.19 116.94 127.72 2cqy h PHE 74 Ca -0.04 -0.12 -0.02 0.00 3.53 0.00 0.00 57.97 61.33 2cqy h PHE 74 Cb 1.36 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.78 2cqy h PHE 74 CO 0.05 0.87 0.04 0.00 -2.23 0.00 0.00 178.31 177.03 2cqy h ARG 75 N 0.94 0.28 0.45 1.11 3.08 -1.21 -0.10 114.38 118.94 2cqy h ARG 75 Ca 0.21 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 2cqy h ARG 75 Cb 0.32 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.34 2cqy h ARG 75 CO -0.00 0.44 -0.22 -0.07 -1.07 0.00 0.00 179.97 179.05 2cqy h LEU 76 N 0.08 -0.51 -0.58 3.04 3.38 -1.41 -2.34 115.31 116.97 2cqy h LEU 76 Ca 0.05 -0.09 0.10 0.00 0.09 0.00 0.00 57.88 58.03 2cqy h LEU 76 Cb 0.29 0.13 -0.08 0.00 0.09 0.00 0.00 40.66 41.09 2cqy h LEU 76 CO 0.00 -0.14 0.14 0.28 0.09 0.00 0.00 178.44 178.81 2cqy h SER 77 N -0.95 0.04 -0.74 -0.43 0.02 -0.68 -0.81 113.55 109.99 2cqy h SER 77 Ca -0.06 0.10 0.07 0.00 -0.84 0.00 0.00 61.79 61.06 2cqy h SER 77 Cb 0.58 0.13 -0.06 0.00 0.14 0.00 0.00 62.40 63.19 2cqy h SER 77 CO 0.10 0.03 0.43 0.77 -1.14 0.00 0.00 176.83 177.02 2cqy h SER 78 N 0.28 0.64 -0.50 3.07 4.64 -1.03 -0.92 113.55 119.73 2cqy h SER 78 Ca 0.30 0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.61 2cqy h SER 78 Cb 0.43 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.39 2cqy h SER 78 CO -0.37 0.40 0.17 1.56 -0.87 0.00 0.00 176.83 177.73 2cqy h GLN 79 N 0.77 0.82 0.55 4.77 4.20 -0.62 -2.44 115.11 123.16 2cqy h GLN 79 Ca 0.34 -0.15 -0.03 0.00 0.06 0.00 0.00 58.65 58.87 2cqy h GLN 79 Cb 0.21 -0.13 0.01 0.00 0.30 0.00 0.00 27.48 27.87 2cqy h GLN 79 CO -0.19 0.71 -0.26 0.93 -0.67 0.00 0.00 178.83 179.35 2cqy h GLU 80 N 0.80 -0.71 -1.23 1.46 4.39 -0.20 -3.08 114.58 116.02 2cqy h GLU 80 Ca 0.18 0.05 0.35 0.00 0.34 0.00 0.00 59.36 60.28 2cqy h GLU 80 Cb 0.24 0.16 -0.06 0.00 -0.10 0.00 0.00 28.75 28.98 2cqy h GLU 80 CO -0.01 -0.47 0.87 0.00 -1.16 0.00 0.00 179.01 178.24 2cqy h ALA 81 N -1.38 3.01 0.08 3.43 0.00 -1.22 1.08 119.26 124.27 2cqy h ALA 81 Ca -0.07 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2cqy h ALA 81 Cb 0.56 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2cqy h ALA 81 CO 0.12 -1.39 -0.05 0.00 0.00 0.00 0.00 179.25 177.93 2cqy h ALA 82 N 1.42 -0.97 0.01 0.00 0.00 -0.88 -0.02 119.26 118.82 2cqy h ALA 82 Ca 0.61 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.49 2cqy h ALA 82 Cb 2.27 0.12 0.00 0.00 0.00 0.00 0.00 17.79 20.18 2cqy h ALA 82 CO -0.08 -0.96 -0.03 0.77 0.00 0.00 0.00 179.25 178.94 2cqy h SER 83 N -0.12 0.02 -0.48 0.00 0.02 -1.35 0.51 113.55 112.15 2cqy h SER 83 Ca -0.01 -0.99 0.04 0.00 -0.84 0.00 0.00 61.79 59.99 2cqy h SER 83 Cb 0.10 -0.01 -0.06 0.00 0.14 0.00 0.00 62.40 62.57 2cqy h SER 83 CO 0.01 1.01 -0.28 -0.24 -1.14 0.00 0.00 176.83 176.19 2cqy n SER 84 N -4.59 -0.51 -0.12 3.07 2.88 0.37 -3.68 113.62 111.03 2cqy n SER 84 Ca -0.10 1.18 -0.24 0.00 -1.33 0.00 0.00 58.87 58.38 2cqy n SER 84 Cb 0.49 -0.27 -0.08 0.00 -0.75 0.00 0.00 64.21 63.60 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 -4.11 0.00 0.00 0.66 3.72 -1.13 -5.03 117.46 111.56 2cqy n PHE 85 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 2cqy n PHE 85 Cb 0.12 -0.84 0.00 0.00 -0.94 0.00 0.00 39.48 37.82 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 1.39 0.43 3.24 1.37 0.00 0.16 -5.03 105.19 106.73 2cqy n GLY 86 Ca -0.43 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.29 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 2.87 0.00 1.61 1.01 -0.18 -4.76 116.67 117.22 2cqy s ASP 87 Ca 0.00 -0.48 0.27 0.00 0.71 0.00 0.00 52.55 53.05 2cqy s ASP 87 Cb 0.00 -0.79 1.15 0.00 1.01 0.00 0.00 42.92 44.29 2cqy s ASP 87 CO 0.00 0.22 1.85 -0.90 0.21 0.00 0.00 175.17 176.56 2cqy n ASP 88 N 2.99 0.00 -4.53 0.27 5.75 -1.26 -1.96 116.55 117.82 2cqy n ASP 88 Ca -0.18 0.46 -0.50 0.00 -0.01 0.00 0.00 54.79 54.56 2cqy n ASP 88 Cb 0.52 -0.49 -0.04 0.00 -1.03 0.00 0.00 41.12 40.08 2cqy n ASP 88 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2cqy n ARG 89 N -1.49 0.75 -4.62 0.11 1.74 -1.26 -4.55 116.66 107.35 2cqy n ARG 89 Ca 0.07 0.27 -0.28 0.00 -0.77 0.00 0.00 57.85 57.14 2cqy n ARG 89 Cb 0.30 -1.67 -0.11 0.00 -1.02 0.00 0.00 32.46 29.97 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 0.96 2.85 0.20 0.55 1.43 -1.26 -1.49 118.68 121.91 2cqy s LEU 90 Ca 0.74 -1.38 0.01 0.00 -1.03 0.00 0.00 54.13 52.47 2cqy s LEU 90 Cb -0.93 -0.88 -0.05 0.00 0.03 0.00 0.00 46.19 44.36 2cqy s LEU 90 CO 0.54 -0.46 0.04 -0.76 0.23 0.00 0.00 176.35 175.94 2cqy s LEU 91 N -3.71 1.87 -0.16 1.79 1.43 0.95 -2.85 118.68 118.00 2cqy s LEU 91 Ca 0.34 -1.25 -0.04 0.00 -1.03 0.00 0.00 54.13 52.14 2cqy s LEU 91 Cb 0.10 0.04 0.08 0.00 0.03 0.00 0.00 46.19 46.43 2cqy s LEU 91 CO 0.18 -0.65 0.26 -0.63 0.23 0.00 0.00 176.35 175.73 2cqy s ILE 92 N -3.76 -0.40 0.16 -0.59 1.01 -1.24 -2.85 121.20 113.52 2cqy s ILE 92 Ca 0.29 0.16 0.08 0.00 0.00 0.00 0.00 60.65 61.18 2cqy s ILE 92 Cb 0.07 -0.53 -0.04 0.00 0.01 0.00 0.00 42.46 41.97 2cqy s ILE 92 CO 0.07 0.02 -0.18 -1.61 0.00 0.00 0.00 174.94 173.25 2cqy s GLU 93 N 2.40 1.23 0.20 2.79 2.02 -0.21 -2.50 118.70 124.64 2cqy s GLU 93 Ca 0.04 -1.38 -0.30 0.00 0.02 0.00 0.00 54.97 53.35 2cqy s GLU 93 Cb -0.13 -1.26 -0.09 0.00 0.10 0.00 0.00 34.13 32.75 2cqy s GLU 93 CO -0.10 0.25 1.33 0.21 0.02 0.00 0.00 175.26 176.97 2cqy s LYS 94 N -2.76 4.37 -0.31 1.61 2.47 -1.26 -0.48 119.74 123.37 2cqy s LYS 94 Ca 0.14 2.09 -0.07 0.00 -1.56 0.00 0.00 55.97 56.57 2cqy s LYS 94 Cb -0.06 -3.18 0.02 0.00 -1.46 0.00 0.00 37.83 33.15 2cqy s LYS 94 CO 0.06 -0.28 0.10 0.12 0.16 0.00 0.00 175.35 175.51 2cqy s PHE 95 N 0.12 3.18 -0.21 4.03 2.19 -1.04 -4.75 117.98 121.51 2cqy s PHE 95 Ca 0.57 -1.07 0.01 0.00 0.33 0.00 0.00 56.93 56.77 2cqy s PHE 95 Cb -0.37 -2.28 0.05 0.00 -1.31 0.00 0.00 43.02 39.11 2cqy s PHE 95 CO 0.39 -0.61 -0.09 0.42 1.83 0.00 0.00 175.22 177.15 2cqy s ILE 96 N 1.49 1.64 -0.01 3.12 1.01 -1.26 -4.36 121.20 122.83 2cqy s ILE 96 Ca 0.02 -1.11 -0.00 0.00 0.00 0.00 0.00 60.65 59.55 2cqy s ILE 96 Cb -0.18 -1.78 -0.00 0.00 0.01 0.00 0.00 42.46 40.51 2cqy s ILE 96 CO 0.03 0.08 0.04 -0.78 0.00 0.00 0.00 174.94 174.31 2cqy h ASP 97 N 7.95 -0.00 -3.56 3.58 1.82 -1.97 -3.47 116.42 120.77 2cqy h ASP 97 Ca -0.24 0.00 -0.57 0.00 -0.39 0.00 0.00 57.03 55.83 2cqy h ASP 97 Cb 1.09 0.00 0.16 0.00 0.68 0.00 0.00 39.33 41.26 2cqy h ASP 97 CO 0.45 0.03 0.12 -0.46 -1.61 0.00 0.00 179.24 177.77 2cqy n ASN 98 N -2.18 0.74 0.00 2.28 6.94 -1.26 -4.84 115.26 116.94 2cqy n ASN 98 Ca -0.00 0.81 0.08 0.00 -0.02 0.00 0.00 54.58 55.44 2cqy n ASN 98 Cb 0.00 -1.39 0.45 0.00 -2.36 0.00 0.00 39.78 36.48 2cqy n ASN 98 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 2cqy n PRO 99 N -0.99 0.43 -4.41 -0.53 -0.04 -1.26 -4.72 135.00 123.47 2cqy n PRO 99 Ca 0.14 0.03 -0.21 0.00 -0.04 0.00 0.00 63.50 63.42 2cqy n PRO 99 Cb 0.47 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.33 2cqy n PRO 99 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2cqy s ARG 100 N -2.13 1.51 1.36 0.54 1.81 -1.26 -5.15 118.95 115.64 2cqy s ARG 100 Ca 0.21 -1.68 -0.23 0.00 -1.72 0.00 0.00 55.73 52.32 2cqy s ARG 100 Cb 0.11 -1.46 0.35 0.00 -0.45 0.00 0.00 34.95 33.49 2cqy s ARG 100 CO 0.19 0.26 1.01 -1.01 -0.68 0.00 0.00 175.30 175.07 2cqy s HIS 101 N -2.73 -0.44 -0.04 -0.53 3.76 -1.26 -4.93 115.29 109.12 2cqy s HIS 101 Ca 0.26 0.45 -0.06 0.00 -0.15 0.00 0.00 55.06 55.56 2cqy s HIS 101 Cb -0.03 -3.16 -0.02 0.00 1.11 0.00 0.00 32.58 30.48 2cqy s HIS 101 CO 0.11 -4.67 -0.12 -0.89 -0.85 0.00 0.00 174.74 168.32 2cqy n ILE 102 N -5.35 0.79 -3.28 0.60 5.41 -1.26 -5.03 119.36 111.24 2cqy n ILE 102 Ca 0.14 0.27 -0.17 0.00 1.00 0.00 0.00 62.75 64.00 2cqy n ILE 102 Cb 0.60 -1.74 0.06 0.00 -0.71 0.00 0.00 39.64 37.85 2cqy n ILE 102 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2cqy n SER 103 N -3.41 -4.85 -3.93 4.38 2.88 -1.26 -4.98 113.62 102.45 2cqy n SER 103 Ca -0.05 -0.41 -0.29 0.00 -1.33 0.00 0.00 58.87 56.79 2cqy n SER 103 Cb 0.18 -3.88 -0.12 0.00 -0.75 0.00 0.00 64.21 59.64 2cqy n SER 103 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2cqy s GLY 104 N -3.34 2.80 0.28 0.46 0.00 -1.26 -5.09 107.32 101.17 2cqy s GLY 104 Ca 0.38 -3.67 -0.29 0.00 0.00 0.00 0.00 44.72 41.14 2cqy s GLY 104 CO 0.54 1.06 1.24 2.56 0.00 0.00 0.00 173.10 178.51 2cqy s PRO 105 N -1.08 4.45 0.49 2.90 0.04 -1.26 -5.05 135.00 135.48 2cqy s PRO 105 Ca 0.22 2.05 0.07 0.00 0.04 0.00 0.00 61.00 63.39 2cqy s PRO 105 Cb -0.11 -3.14 0.07 0.00 0.04 0.00 0.00 34.50 31.36 2cqy s PRO 105 CO -0.11 -0.08 0.62 0.43 0.04 0.00 0.00 177.00 177.89 2cqy n SER 106 N 1.37 1.92 -4.08 6.66 7.64 -1.26 -5.06 113.62 120.79 2cqy n SER 106 Ca 0.01 -2.36 -0.36 0.00 1.01 0.00 0.00 58.87 57.17 2cqy n SER 106 Cb 0.43 -0.30 0.04 0.00 -1.01 0.00 0.00 64.21 63.37 2cqy n SER 106 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2cqy n SER 107 N -2.33 -5.25 0.00 6.43 7.64 -1.26 -5.31 113.62 113.54 2cqy n SER 107 Ca 0.11 0.28 0.00 0.00 1.01 0.00 0.00 58.87 60.28 2cqy n SER 107 Cb 0.51 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 2cqy n SER 107 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64