#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cq8 n SER 2 N 0.00 2.28 -2.83 1.61 7.64 -1.26 -3.84 113.62 117.23 2cq8 n SER 2 Ca 0.00 -0.54 -0.03 0.00 1.01 0.00 0.00 58.87 59.31 2cq8 n SER 2 Cb 0.00 -1.58 -0.02 0.00 -1.01 0.00 0.00 64.21 61.59 2cq8 n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2cq8 n SER 3 N 16.03 -4.39 0.00 6.43 2.88 -1.26 -4.99 113.62 128.33 2cq8 n SER 3 Ca 0.38 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 59.06 2cq8 n SER 3 Cb 0.54 -3.79 0.00 0.00 -0.75 0.00 0.00 64.21 60.21 2cq8 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cq8 n GLY 4 N 1.76 0.14 3.36 0.46 0.00 -1.25 -5.09 105.19 104.57 2cq8 n GLY 4 Ca -0.19 -0.09 -0.46 0.00 0.00 0.00 0.00 46.02 45.29 2cq8 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cq8 s SER 5 N 0.00 6.62 0.00 1.61 0.15 -1.26 -3.30 113.70 117.52 2cq8 s SER 5 Ca 0.00 -2.31 0.30 0.00 0.70 0.00 0.00 55.95 54.64 2cq8 s SER 5 Cb 0.00 -2.27 1.57 0.00 -1.71 0.00 0.00 66.02 63.61 2cq8 s SER 5 CO 0.00 -0.78 2.05 -1.54 1.20 0.00 0.00 173.24 174.16 2cq8 n SER 6 N 5.00 0.36 0.00 5.45 3.41 -1.26 -4.96 113.62 121.63 2cq8 n SER 6 Ca 0.12 -0.90 0.00 0.00 -0.26 0.00 0.00 58.87 57.83 2cq8 n SER 6 Cb 0.46 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 2cq8 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cq8 n GLY 7 N 1.12 3.05 3.75 5.00 0.00 -1.26 -5.07 105.19 111.79 2cq8 n GLY 7 Ca 0.20 -1.33 -0.37 0.00 0.00 0.00 0.00 46.02 44.52 2cq8 n GLY 7 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2cq8 s PHE 8 N 0.00 2.35 0.09 1.61 -0.71 -1.26 -4.95 117.98 115.12 2cq8 s PHE 8 Ca 0.00 1.47 0.00 0.00 -1.04 0.00 0.00 56.93 57.36 2cq8 s PHE 8 Cb 0.00 -3.61 0.00 0.00 -1.21 0.00 0.00 43.02 38.20 2cq8 s PHE 8 CO 0.00 -2.49 0.00 1.19 -1.34 0.00 0.00 175.22 172.58 2cq8 n PHE 9 N -1.34 -0.68 0.13 3.49 3.72 -1.26 -5.08 117.46 116.44 2cq8 n PHE 9 Ca 0.12 0.12 0.00 0.00 -0.05 0.00 0.00 57.45 57.64 2cq8 n PHE 9 Cb 0.48 0.32 0.00 0.00 -0.94 0.00 0.00 39.48 39.34 2cq8 n PHE 9 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2cq8 n LYS 10 N -3.05 0.00 0.00 -1.08 4.76 -1.26 -5.14 118.16 112.39 2cq8 n LYS 10 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2cq8 n LYS 10 Cb 0.11 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.30 2cq8 n LYS 10 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2cq8 n GLY 11 N -1.43 1.09 3.10 0.72 0.00 -1.26 -5.01 105.19 102.39 2cq8 n GLY 11 Ca 0.00 -1.08 -0.11 0.00 0.00 0.00 0.00 46.02 44.83 2cq8 n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cq8 s ALA 12 N -2.00 0.69 -0.77 4.61 0.00 -1.26 -5.10 121.76 117.93 2cq8 s ALA 12 Ca 0.00 -1.00 -0.04 0.00 0.00 0.00 0.00 51.96 50.92 2cq8 s ALA 12 Cb 0.00 0.11 0.19 0.00 0.00 0.00 0.00 23.12 23.42 2cq8 s ALA 12 CO 0.00 -0.13 0.63 0.00 0.00 0.00 0.00 175.76 176.26 2cq8 s ALA 13 N -2.38 3.93 0.21 0.00 0.00 -1.26 -4.93 121.76 117.34 2cq8 s ALA 13 Ca -0.01 -3.52 0.00 0.00 0.00 0.00 0.00 51.96 48.43 2cq8 s ALA 13 Cb -0.03 -2.86 0.00 0.00 0.00 0.00 0.00 23.12 20.23 2cq8 s ALA 13 CO -0.02 -2.15 0.00 0.45 0.00 0.00 0.00 175.76 174.04 2cq8 n SER 14 N 3.07 -8.37 -4.09 0.00 2.88 -1.26 -5.05 113.62 100.79 2cq8 n SER 14 Ca 0.14 1.24 -0.15 0.00 -1.33 0.00 0.00 58.87 58.78 2cq8 n SER 14 Cb 0.39 -4.67 -0.12 0.00 -0.75 0.00 0.00 64.21 59.06 2cq8 n SER 14 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2cq8 s SER 15 N -0.65 1.12 -0.01 -3.46 1.04 -1.26 -5.15 113.70 105.34 2cq8 s SER 15 Ca 0.00 -0.54 0.03 0.00 0.48 0.00 0.00 55.95 55.92 2cq8 s SER 15 Cb 0.00 -0.00 -0.01 0.00 0.10 0.00 0.00 66.02 66.11 2cq8 s SER 15 CO 0.00 -0.14 -0.09 0.54 0.98 0.00 0.00 173.24 174.54 2cq8 s VAL 16 N -1.24 0.69 0.59 5.02 0.11 -1.26 -5.12 120.40 119.18 2cq8 s VAL 16 Ca -0.06 -0.37 -0.00 0.00 -2.93 0.00 0.00 61.98 58.61 2cq8 s VAL 16 Cb -0.09 -0.58 0.05 0.00 -1.53 0.00 0.00 36.38 34.22 2cq8 s VAL 16 CO 0.01 0.20 0.84 -0.76 -3.33 0.00 0.00 175.10 172.05 2cq8 s LEU 17 N -0.19 3.16 -0.15 2.54 1.43 -1.26 -5.09 118.68 119.12 2cq8 s LEU 17 Ca 0.03 0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.19 2cq8 s LEU 17 Cb -0.04 -2.84 0.01 0.00 0.03 0.00 0.00 46.19 43.35 2cq8 s LEU 17 CO -0.00 -1.29 -0.19 -0.70 0.23 0.00 0.00 176.35 174.40 2cq8 s GLU 18 N -4.88 3.10 1.47 1.70 2.12 -1.26 -5.04 118.70 115.90 2cq8 s GLU 18 Ca 0.59 -0.81 -0.24 0.00 0.36 0.00 0.00 54.97 54.87 2cq8 s GLU 18 Cb -0.10 -2.54 0.38 0.00 0.26 0.00 0.00 34.13 32.13 2cq8 s GLU 18 CO 0.40 -0.04 0.90 -0.51 -0.54 0.00 0.00 175.26 175.47 2cq8 s LEU 19 N 0.91 -1.47 0.00 2.70 2.01 -1.26 -5.07 118.68 116.50 2cq8 s LEU 19 Ca -0.04 0.80 0.00 0.00 0.01 0.00 0.00 54.13 54.90 2cq8 s LEU 19 Cb -0.15 -2.15 0.00 0.00 0.01 0.00 0.00 46.19 43.90 2cq8 s LEU 19 CO -0.03 -5.61 0.00 0.35 1.01 0.00 0.00 176.35 172.07 2cq8 n THR 20 N -5.79 0.00 -0.05 5.49 -2.24 -1.26 -4.91 114.28 105.51 2cq8 n THR 20 Ca 0.14 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.75 2cq8 n THR 20 Cb 0.61 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.78 2cq8 n THR 20 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2cq8 h GLU 21 N 0.00 0.84 0.00 -0.78 4.81 -1.99 -2.57 114.58 114.88 2cq8 h GLU 21 Ca 0.00 -0.62 -0.01 0.00 -0.13 0.00 0.00 59.36 58.61 2cq8 h GLU 21 Cb 0.00 0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 2cq8 h GLU 21 CO 0.00 1.24 -0.30 0.00 -0.73 0.00 0.00 179.01 179.21 2cq8 h ALA 22 N 0.61 0.01 -0.98 2.92 0.00 -2.00 -3.33 119.26 116.48 2cq8 h ALA 22 Ca -0.02 -0.31 0.17 0.00 0.00 0.00 0.00 54.91 54.75 2cq8 h ALA 22 Cb 1.30 0.29 -0.17 0.00 0.00 0.00 0.00 17.79 19.21 2cq8 h ALA 22 CO 0.14 0.29 -0.32 0.39 0.00 0.00 0.00 179.25 179.76 2cq8 n GLU 23 N -4.68 -0.16 -0.23 0.00 1.02 -1.26 0.59 120.64 115.92 2cq8 n GLU 23 Ca -0.05 1.52 -0.07 0.00 -0.02 0.00 0.00 57.16 58.55 2cq8 n GLU 23 Cb 0.16 -2.26 -0.01 0.00 -0.02 0.00 0.00 31.44 29.31 2cq8 n GLU 23 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2cq8 h LEU 24 N 0.00 -1.39 -0.59 -4.62 3.38 -1.63 1.27 115.31 111.74 2cq8 h LEU 24 Ca 0.40 0.25 0.12 0.00 0.09 0.00 0.00 57.88 58.74 2cq8 h LEU 24 Cb 0.65 0.66 -0.09 0.00 0.09 0.00 0.00 40.66 41.96 2cq8 h LEU 24 CO -0.99 -0.32 0.07 0.58 0.09 0.00 0.00 178.44 177.87 2cq8 h VAL 25 N -0.18 0.59 -0.47 1.22 2.07 0.04 0.13 116.25 119.64 2cq8 h VAL 25 Ca 0.21 -0.06 -0.02 0.00 0.82 0.00 0.00 66.70 67.65 2cq8 h VAL 25 Cb 0.56 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 2cq8 h VAL 25 CO -0.72 0.03 0.23 0.74 0.02 0.00 0.00 177.57 177.87 2cq8 h THR 26 N 0.19 1.19 -0.17 2.57 2.02 0.86 -0.45 112.91 119.12 2cq8 h THR 26 Ca 0.31 -0.52 0.05 0.00 0.77 0.00 0.00 66.41 67.01 2cq8 h THR 26 Cb 0.48 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 2cq8 h THR 26 CO -0.45 0.20 0.14 0.00 0.37 0.00 0.00 175.52 175.79 2cq8 h ALA 27 N 1.07 1.96 0.17 6.16 0.00 0.33 0.37 119.26 129.32 2cq8 h ALA 27 Ca 0.16 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.76 2cq8 h ALA 27 Cb 0.12 0.01 0.02 0.00 0.00 0.00 0.00 17.79 17.94 2cq8 h ALA 27 CO -0.02 -0.23 -1.32 0.93 0.00 0.00 0.00 179.25 178.61 2cq8 h GLU 28 N 0.00 0.47 -0.57 0.00 4.39 0.34 -2.35 114.58 116.85 2cq8 h GLU 28 Ca 0.08 -0.73 -0.02 0.00 0.34 0.00 0.00 59.36 59.03 2cq8 h GLU 28 Cb 0.36 0.26 -0.03 0.00 -0.10 0.00 0.00 28.75 29.25 2cq8 h GLU 28 CO -0.00 1.34 0.30 0.00 -1.16 0.00 0.00 179.01 179.48 2cq8 h ALA 29 N 0.36 0.73 -0.27 3.43 0.00 0.57 -2.17 119.26 121.92 2cq8 h ALA 29 Ca -0.19 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 2cq8 h ALA 29 Cb 2.01 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.56 2cq8 h ALA 29 CO 0.24 0.27 0.04 0.28 0.00 0.00 0.00 179.25 180.08 2cq8 h VAL 30 N 0.77 1.23 -1.03 0.00 2.07 -1.18 -2.59 116.25 115.52 2cq8 h VAL 30 Ca 0.20 -0.78 0.26 0.00 0.82 0.00 0.00 66.70 67.19 2cq8 h VAL 30 Cb 0.08 1.23 -0.11 0.00 -1.52 0.00 0.00 31.29 30.97 2cq8 h VAL 30 CO -0.03 0.25 0.64 -0.09 0.02 0.00 0.00 177.57 178.36 2cq8 h ARG 31 N 0.25 0.47 -0.15 1.57 2.43 -1.05 1.13 114.38 119.04 2cq8 h ARG 31 Ca 0.08 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.18 2cq8 h ARG 31 Cb 0.33 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 2cq8 h ARG 31 CO 0.01 0.31 -0.08 1.03 -1.51 0.00 0.00 179.97 179.73 2cq8 h SER 32 N 0.49 0.21 -0.30 -3.80 0.87 -1.00 -1.46 113.55 108.55 2cq8 h SER 32 Ca 0.62 -0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 61.13 2cq8 h SER 32 Cb 1.37 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 63.26 2cq8 h SER 32 CO -0.38 0.32 0.14 0.58 -0.53 0.00 0.00 176.83 176.96 2cq8 h VAL 33 N 0.22 1.16 0.74 2.23 2.07 0.14 0.64 116.25 123.45 2cq8 h VAL 33 Ca 0.05 -0.46 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 2cq8 h VAL 33 Cb 0.29 0.91 0.01 0.00 -1.52 0.00 0.00 31.29 30.98 2cq8 h VAL 33 CO 0.01 0.16 -0.35 -0.50 0.02 0.00 0.00 177.57 176.91 2cq8 h TRP 34 N 0.35 -0.92 -0.11 1.57 4.06 -1.05 0.19 115.95 120.04 2cq8 h TRP 34 Ca 0.10 -0.02 0.04 0.00 2.06 0.00 0.00 58.89 61.07 2cq8 h TRP 34 Cb 0.13 0.30 -0.06 0.00 -1.00 0.00 0.00 29.16 28.53 2cq8 h TRP 34 CO -0.02 -0.56 -0.36 1.96 -3.56 0.00 0.00 178.44 175.91 2cq8 h GLN 35 N -1.04 -0.43 -0.83 0.49 1.08 -1.17 1.41 115.11 114.63 2cq8 h GLN 35 Ca -0.10 0.03 0.17 0.00 -1.45 0.00 0.00 58.65 57.30 2cq8 h GLN 35 Cb 0.77 0.10 -0.06 0.00 -0.05 0.00 0.00 27.48 28.24 2cq8 h GLN 35 CO 0.17 -0.29 0.55 0.00 -0.95 0.00 0.00 178.83 178.31 2cq8 h ARG 36 N -0.45 0.43 0.13 1.46 3.08 0.39 -2.74 114.38 116.69 2cq8 h ARG 36 Ca 0.08 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2cq8 h ARG 36 Cb 0.58 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.54 2cq8 h ARG 36 CO -0.36 0.28 -0.06 0.82 -1.07 0.00 0.00 179.97 179.58 2cq8 h ILE 37 N 0.44 0.00 -3.20 2.04 2.04 0.20 -3.42 117.51 115.61 2cq8 h ILE 37 Ca 0.42 -0.43 -0.57 0.00 1.00 0.00 0.00 64.86 65.28 2cq8 h ILE 37 Cb 0.96 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.99 2cq8 h ILE 37 CO -0.15 0.00 0.99 -0.76 0.00 0.00 0.00 178.15 178.23 2cq8 s LEU 38 N -6.71 3.81 -0.01 1.44 1.43 0.46 -4.93 118.68 114.18 2cq8 s LEU 38 Ca -0.03 1.10 -0.01 0.00 -1.03 0.00 0.00 54.13 54.16 2cq8 s LEU 38 Cb 0.00 -3.54 -0.01 0.00 0.03 0.00 0.00 46.19 42.68 2cq8 s LEU 38 CO 0.08 -1.16 0.26 1.55 0.23 0.00 0.00 176.35 177.31 2cq8 h PRO 39 N 9.57 -0.04 -1.00 1.29 0.13 -1.83 -3.31 132.00 136.81 2cq8 h PRO 39 Ca -0.26 0.00 0.37 0.00 -0.87 0.00 0.00 66.00 65.25 2cq8 h PRO 39 Cb 1.10 0.01 -0.17 0.00 0.13 0.00 0.00 31.00 32.06 2cq8 h PRO 39 CO 1.05 -0.02 0.49 0.87 -0.23 0.00 0.00 178.00 180.16 2cq8 h LYS 40 N -0.12 0.09 -6.29 0.86 1.57 -1.92 -3.37 116.57 107.39 2cq8 h LYS 40 Ca -0.00 -0.01 -0.55 0.00 -1.87 0.00 0.00 60.65 58.22 2cq8 h LYS 40 Cb 0.03 -0.02 0.02 0.00 0.08 0.00 0.00 32.23 32.33 2cq8 h LYS 40 CO 0.01 0.06 1.27 0.28 -0.57 0.00 0.00 179.45 180.50 2cq8 n VAL 41 N -5.22 0.69 0.02 0.50 0.31 -1.25 -4.83 118.33 108.55 2cq8 n VAL 41 Ca 0.35 -0.19 0.01 0.00 -0.01 0.00 0.00 64.34 64.50 2cq8 n VAL 41 Cb 1.14 -2.33 -0.09 0.00 -0.91 0.00 0.00 33.84 31.66 2cq8 n VAL 41 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2cq8 n LEU 42 N 8.16 0.69 -3.90 7.52 4.77 -1.26 -4.91 117.00 128.06 2cq8 n LEU 42 Ca 0.22 0.30 -0.11 0.00 -0.03 0.00 0.00 56.01 56.39 2cq8 n LEU 42 Cb 0.40 0.10 -0.11 0.00 -2.33 0.00 0.00 43.42 41.49 2cq8 n LEU 42 CO 0.68 0.13 -0.24 -1.83 -1.33 0.00 0.00 177.39 174.81 2cq8 s GLU 43 N -2.98 0.39 -0.66 3.23 -1.05 -1.26 -5.08 118.70 111.29 2cq8 s GLU 43 Ca -0.04 -0.41 0.05 0.00 -0.15 0.00 0.00 54.97 54.42 2cq8 s GLU 43 Cb 0.09 0.16 0.17 0.00 -0.44 0.00 0.00 34.13 34.10 2cq8 s GLU 43 CO 0.82 -0.08 0.46 0.08 0.95 0.00 0.00 175.26 177.48 2cq8 s VAL 44 N -1.25 2.57 0.96 1.83 1.01 -1.26 -4.98 120.40 119.29 2cq8 s VAL 44 Ca -0.13 -4.00 -0.16 0.00 0.00 0.00 0.00 61.98 57.68 2cq8 s VAL 44 Cb -0.08 -2.70 0.24 0.00 0.00 0.00 0.00 36.38 33.84 2cq8 s VAL 44 CO 0.01 -1.01 0.91 -1.84 0.00 0.00 0.00 175.10 173.17 2cq8 n GLU 45 N 2.18 -2.49 0.00 2.72 0.00 -1.26 -4.87 120.64 116.92 2cq8 n GLU 45 Ca 0.19 -1.45 0.14 0.00 0.00 0.00 0.00 57.16 56.04 2cq8 n GLU 45 Cb 0.36 -1.29 0.70 0.00 0.00 0.00 0.00 31.44 31.20 2cq8 n GLU 45 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2cq8 n ASP 46 N -4.39 0.00 -0.03 -1.84 8.00 -1.26 -2.55 116.55 114.48 2cq8 n ASP 46 Ca 0.12 0.03 0.06 0.00 0.71 0.00 0.00 54.79 55.71 2cq8 n ASP 46 Cb 0.47 -0.34 -0.07 0.00 -0.02 0.00 0.00 41.12 41.17 2cq8 n ASP 46 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2cq8 n SER 47 N -1.34 0.71 -4.67 -2.24 2.88 -1.26 -0.40 113.62 107.30 2cq8 n SER 47 Ca 0.12 -0.86 -0.42 0.00 -1.33 0.00 0.00 58.87 56.38 2cq8 n SER 47 Cb 0.25 0.94 -0.03 0.00 -0.75 0.00 0.00 64.21 64.63 2cq8 n SER 47 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2cq8 s THR 48 N -2.19 3.35 -0.04 2.46 2.01 -1.06 -4.80 115.64 115.38 2cq8 s THR 48 Ca 0.06 0.57 -0.26 0.00 0.31 0.00 0.00 61.69 62.37 2cq8 s THR 48 Cb 0.10 -3.37 -0.03 0.00 0.01 0.00 0.00 72.50 69.21 2cq8 s THR 48 CO 0.52 -0.03 0.81 -0.62 -0.69 0.00 0.00 174.62 174.61 2cq8 s ASP 49 N 3.12 7.13 0.52 3.53 2.15 -1.26 -0.97 116.67 130.89 2cq8 s ASP 49 Ca 0.75 1.37 0.34 0.00 0.43 0.00 0.00 52.55 55.44 2cq8 s ASP 49 Cb -0.36 -2.47 1.58 0.00 -0.30 0.00 0.00 42.92 41.37 2cq8 s ASP 49 CO 0.32 -0.18 2.03 0.15 -0.17 0.00 0.00 175.17 177.31 2cq8 h PHE 50 N 6.79 0.00 0.00 -5.34 3.57 0.13 -2.37 116.94 119.72 2cq8 h PHE 50 Ca -0.41 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.09 2cq8 h PHE 50 Cb 1.20 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.94 2cq8 h PHE 50 CO 0.66 0.00 -0.27 1.19 -2.23 0.00 0.00 178.31 177.66 2cq8 n PHE 51 N -2.90 0.26 -0.34 0.41 3.72 -1.26 -3.26 117.46 114.09 2cq8 n PHE 51 Ca -0.00 0.11 0.20 0.00 -0.05 0.00 0.00 57.45 57.71 2cq8 n PHE 51 Cb 0.21 -0.38 0.38 0.00 -0.94 0.00 0.00 39.48 38.75 2cq8 n PHE 51 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2cq8 h LYS 52 N -0.41 0.00 0.00 -1.08 6.56 -1.94 -1.91 116.57 117.79 2cq8 h LYS 52 Ca 0.00 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2cq8 h LYS 52 Cb 0.27 -0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.93 2cq8 h LYS 52 CO 0.00 0.00 0.00 0.43 -2.06 0.00 0.00 179.45 177.82 2cq8 n SER 53 N -5.43 0.00 0.00 0.86 7.64 -0.89 -4.83 113.62 110.96 2cq8 n SER 53 Ca 0.28 0.46 0.00 0.00 1.01 0.00 0.00 58.87 60.62 2cq8 n SER 53 Cb 0.92 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.12 2cq8 n SER 53 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cq8 n GLY 54 N -0.86 0.00 3.83 0.23 0.00 -0.72 -4.97 105.19 102.70 2cq8 n GLY 54 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2cq8 n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cq8 s ALA 55 N 0.00 3.53 0.00 4.61 0.00 -1.20 -4.94 121.76 123.76 2cq8 s ALA 55 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 51.96 51.93 2cq8 s ALA 55 Cb 0.00 -2.62 0.00 0.00 0.00 0.00 0.00 23.12 20.50 2cq8 s ALA 55 CO 0.00 0.41 0.00 0.00 0.00 0.00 0.00 175.76 176.17 2cq8 n ALA 56 N 0.83 0.00 0.25 0.00 0.00 -1.26 -4.88 120.51 115.45 2cq8 n ALA 56 Ca -0.05 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.54 2cq8 n ALA 56 Cb 0.51 0.00 0.50 0.00 0.00 0.00 0.00 19.45 20.46 2cq8 n ALA 56 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2cq8 h SER 57 N 0.00 0.00 0.44 0.00 0.87 -2.01 -2.91 113.55 109.94 2cq8 h SER 57 Ca 0.00 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.25 2cq8 h SER 57 Cb 0.00 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2cq8 h SER 57 CO 0.00 0.04 -1.53 -0.37 -0.53 0.00 0.00 176.83 174.43 2cq8 h VAL 58 N 0.00 1.15 -0.59 2.23 -1.51 -1.99 -3.28 116.25 112.25 2cq8 h VAL 58 Ca -0.00 -2.79 0.08 0.00 -1.23 0.00 0.00 66.70 62.77 2cq8 h VAL 58 Cb 0.70 2.76 -0.04 0.00 -2.13 0.00 0.00 31.29 32.59 2cq8 h VAL 58 CO 0.01 0.82 0.40 0.44 -1.23 0.00 0.00 177.57 178.00 2cq8 h ASP 59 N 0.07 0.42 0.52 4.19 5.19 -1.88 1.82 116.42 126.75 2cq8 h ASP 59 Ca -0.24 0.01 -0.03 0.00 -0.62 0.00 0.00 57.03 56.15 2cq8 h ASP 59 Cb 2.02 -0.08 0.01 0.00 0.18 0.00 0.00 39.33 41.45 2cq8 h ASP 59 CO 0.16 0.26 -0.25 0.58 -3.12 0.00 0.00 179.24 176.87 2cq8 h VAL 60 N 0.47 0.46 -0.38 -1.35 2.07 -1.60 1.21 116.25 117.13 2cq8 h VAL 60 Ca 0.27 -0.19 -0.12 0.00 0.82 0.00 0.00 66.70 67.47 2cq8 h VAL 60 Cb 0.44 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 2cq8 h VAL 60 CO -0.08 0.03 -0.25 0.58 0.02 0.00 0.00 177.57 177.87 2cq8 h VAL 61 N -0.83 1.27 -0.62 2.57 2.07 -1.42 -0.87 116.25 118.44 2cq8 h VAL 61 Ca -0.07 -1.38 -0.06 0.00 0.82 0.00 0.00 66.70 66.02 2cq8 h VAL 61 Cb 0.59 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 2cq8 h VAL 61 CO 0.12 0.46 0.17 -0.09 0.02 0.00 0.00 177.57 178.24 2cq8 h ARG 62 N 0.66 0.98 0.54 1.57 2.43 0.29 0.44 114.38 121.30 2cq8 h ARG 62 Ca 0.09 -0.23 -0.03 0.00 -0.81 0.00 0.00 59.98 59.00 2cq8 h ARG 62 Cb 0.77 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 30.19 2cq8 h ARG 62 CO 0.06 0.88 -0.26 1.25 -1.51 0.00 0.00 179.97 180.39 2cq8 h LEU 63 N 0.90 -0.62 -0.99 3.80 5.85 0.17 0.20 115.31 124.62 2cq8 h LEU 63 Ca 0.20 -0.05 0.10 0.00 0.84 0.00 0.00 57.88 58.97 2cq8 h LEU 63 Cb 0.33 0.16 -0.08 0.00 0.37 0.00 0.00 40.66 41.44 2cq8 h LEU 63 CO -0.00 -0.28 0.62 0.58 -0.34 0.00 0.00 178.44 179.02 2cq8 h VAL 64 N -0.98 0.96 -0.73 1.05 2.07 -1.11 0.13 116.25 117.63 2cq8 h VAL 64 Ca -0.07 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.05 2cq8 h VAL 64 Cb 0.63 -0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 2cq8 h VAL 64 CO 0.12 0.19 0.27 -0.33 0.02 0.00 0.00 177.57 177.84 2cq8 h GLU 65 N 1.02 1.11 0.49 1.57 4.39 0.04 0.45 114.58 123.66 2cq8 h GLU 65 Ca 0.47 -0.21 -0.02 0.00 0.34 0.00 0.00 59.36 59.93 2cq8 h GLU 65 Cb 0.39 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 2cq8 h GLU 65 CO -0.24 0.93 -0.24 0.93 -1.16 0.00 0.00 179.01 179.23 2cq8 h GLU 66 N 1.07 -0.63 -0.04 2.33 5.08 0.14 -2.35 114.58 120.17 2cq8 h GLU 66 Ca 0.24 0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.66 2cq8 h GLU 66 Cb 0.24 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 2cq8 h GLU 66 CO -0.02 -0.34 0.08 0.28 -1.00 0.00 0.00 179.01 178.01 2cq8 h VAL 67 N -0.87 0.26 -0.55 3.13 2.07 -0.77 0.28 116.25 119.79 2cq8 h VAL 67 Ca -0.07 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.41 2cq8 h VAL 67 Cb 0.59 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 2cq8 h VAL 67 CO 0.11 0.00 0.19 0.11 0.02 0.00 0.00 177.57 178.00 2cq8 h LYS 68 N 0.00 0.84 0.00 1.57 1.57 -0.36 -1.77 116.57 118.42 2cq8 h LYS 68 Ca 0.02 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 2cq8 h LYS 68 Cb 0.18 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 2cq8 h LYS 68 CO -0.00 0.76 -0.22 0.93 -0.57 0.00 0.00 179.45 180.35 2cq8 h GLU 69 N 0.76 0.00 0.02 3.15 4.39 -0.69 1.91 114.58 124.12 2cq8 h GLU 69 Ca 0.18 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.88 2cq8 h GLU 69 Cb 0.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 2cq8 h GLU 69 CO -0.01 0.22 -0.01 -0.07 -1.16 0.00 0.00 179.01 177.98 2cq8 h LEU 70 N 0.00 -0.02 -1.25 1.33 3.38 -1.04 -2.80 115.31 114.91 2cq8 h LEU 70 Ca -0.00 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2cq8 h LEU 70 Cb 0.65 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.41 2cq8 h LEU 70 CO 0.03 0.23 -0.07 0.00 0.09 0.00 0.00 178.44 178.71 2cq8 n ASP 72 N 0.47 -7.29 -0.05 0.00 2.03 0.41 -4.40 116.55 107.71 2cq8 n ASP 72 Ca 0.16 -0.18 0.00 0.00 0.52 0.00 0.00 54.79 55.28 2cq8 n ASP 72 Cb 0.45 -5.07 0.00 0.00 -0.72 0.00 0.00 41.12 35.78 2cq8 n ASP 72 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2cq8 n GLY 73 N -1.63 0.99 3.72 0.27 0.00 0.55 -4.96 105.19 104.13 2cq8 n GLY 73 Ca -0.01 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 2cq8 n GLY 73 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2cq8 n LEU 74 N -0.05 3.94 -3.26 0.99 7.94 -1.10 -4.83 117.00 120.62 2cq8 n LEU 74 Ca 0.00 1.19 -0.38 0.00 -1.11 0.00 0.00 56.01 55.71 2cq8 n LEU 74 Cb 0.05 -1.53 -0.03 0.00 0.53 0.00 0.00 43.42 42.44 2cq8 n LEU 74 CO 0.00 -0.19 3.33 -1.84 -1.11 0.00 0.00 177.39 177.57 2cq8 n GLU 75 N 1.13 3.67 -4.68 1.96 0.28 -1.26 -4.81 120.64 116.93 2cq8 n GLU 75 Ca 0.06 -2.19 -0.33 0.00 -0.16 0.00 0.00 57.16 54.54 2cq8 n GLU 75 Cb 0.36 -2.76 -0.13 0.00 1.43 0.00 0.00 31.44 30.33 2cq8 n GLU 75 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 2cq8 s LEU 76 N 0.10 2.92 0.20 -1.84 2.96 -1.26 -5.07 118.68 116.69 2cq8 s LEU 76 Ca 0.69 -0.22 0.11 0.00 -0.22 0.00 0.00 54.13 54.50 2cq8 s LEU 76 Cb 0.19 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 45.17 2cq8 s LEU 76 CO -0.06 0.22 -0.22 -1.83 -1.32 0.00 0.00 176.35 173.14 2cq8 s GLU 77 N 0.05 1.59 0.47 1.98 -1.05 -1.26 -4.93 118.70 115.55 2cq8 s GLU 77 Ca -0.03 -1.53 0.32 0.00 -0.15 0.00 0.00 54.97 53.58 2cq8 s GLU 77 Cb -0.14 -1.87 1.42 0.00 -0.44 0.00 0.00 34.13 33.11 2cq8 s GLU 77 CO 0.04 0.40 1.70 -0.91 0.95 0.00 0.00 175.26 177.44 2cq8 h ASN 78 N 3.07 0.19 -0.17 0.83 2.35 -1.98 0.78 115.58 120.65 2cq8 h ASN 78 Ca -0.46 0.07 0.01 0.00 -0.55 0.00 0.00 56.30 55.37 2cq8 h ASN 78 Cb 1.21 0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.61 2cq8 h ASN 78 CO 0.50 -0.04 0.08 -0.33 -1.65 0.00 0.00 177.43 175.99 2cq8 h GLU 79 N 0.13 0.18 -0.79 0.81 5.08 -1.97 -0.70 114.58 117.30 2cq8 h GLU 79 Ca 0.71 -0.01 0.18 0.00 -1.00 0.00 0.00 59.36 59.24 2cq8 h GLU 79 Cb 2.39 -0.04 -0.12 0.00 0.50 0.00 0.00 28.75 31.49 2cq8 h GLU 79 CO -0.22 0.12 0.23 -0.44 -1.00 0.00 0.00 179.01 177.70 2cq8 h ASP 80 N 0.18 0.07 -0.27 1.42 3.32 0.20 0.30 116.42 121.65 2cq8 h ASP 80 Ca 0.07 0.15 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 2cq8 h ASP 80 Cb 0.01 0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 2cq8 h ASP 80 CO -0.04 -0.04 0.10 0.58 -1.72 0.00 0.00 179.24 178.11 2cq8 h VAL 81 N 0.29 1.19 0.00 -1.35 2.07 -1.24 0.16 116.25 117.37 2cq8 h VAL 81 Ca 0.46 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 67.40 2cq8 h VAL 81 Cb 0.83 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 2cq8 h VAL 81 CO -0.54 0.20 0.00 -1.22 0.02 0.00 0.00 177.57 176.03 2cq8 n TYR 82 N -4.74 0.51 -0.09 1.57 4.01 0.81 -1.86 117.16 117.38 2cq8 n TYR 82 Ca -0.03 0.26 -0.22 0.00 -0.16 0.00 0.00 57.90 57.75 2cq8 n TYR 82 Cb 0.15 -0.92 -0.12 0.00 -0.31 0.00 0.00 39.34 38.14 2cq8 n TYR 82 CO 0.00 0.00 0.00 -0.12 -0.46 0.00 0.00 176.86 176.28 2cq8 n MET 83 N -2.02 0.65 -3.88 -0.72 1.56 0.21 -4.75 117.12 108.17 2cq8 n MET 83 Ca -0.01 0.30 -0.32 0.00 -0.27 0.00 0.00 57.70 57.40 2cq8 n MET 83 Cb 0.04 -1.62 -0.13 0.00 2.15 0.00 0.00 33.22 33.67 2cq8 n MET 83 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2cq8 s ALA 84 N -2.50 3.35 0.07 -5.12 0.00 -0.07 -4.91 121.76 112.58 2cq8 s ALA 84 Ca -0.31 -3.16 -0.09 0.00 0.00 0.00 0.00 51.96 48.40 2cq8 s ALA 84 Cb 0.09 -2.31 -0.28 0.00 0.00 0.00 0.00 23.12 20.62 2cq8 s ALA 84 CO 0.63 -2.00 1.12 0.66 0.00 0.00 0.00 175.76 176.16 2cq8 h SER 85 N 6.85 0.63 -3.47 0.00 4.64 -1.84 -3.39 113.55 116.97 2cq8 h SER 85 Ca -0.06 -0.63 -0.53 0.00 -0.47 0.00 0.00 61.79 60.09 2cq8 h SER 85 Cb 0.93 -0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 62.79 2cq8 h SER 85 CO 0.68 1.48 0.29 0.42 -0.87 0.00 0.00 176.83 178.83 2cq8 s THR 86 N -2.77 4.72 0.14 2.95 -4.23 -1.26 0.17 115.64 115.36 2cq8 s THR 86 Ca -0.06 1.90 -0.32 0.00 -1.18 0.00 0.00 61.69 62.03 2cq8 s THR 86 Cb 0.06 -4.24 -0.09 0.00 1.34 0.00 0.00 72.50 69.57 2cq8 s THR 86 CO 0.91 0.27 1.55 0.15 -0.54 0.00 0.00 174.62 176.96 2cq8 h PHE 87 N 6.08 -1.75 -0.97 3.99 3.57 -1.21 0.35 116.94 127.01 2cq8 h PHE 87 Ca -0.42 0.10 0.13 0.00 3.53 0.00 0.00 57.97 61.31 2cq8 h PHE 87 Cb 1.21 0.85 -0.14 0.00 2.79 0.00 0.00 35.95 40.65 2cq8 h PHE 87 CO 0.66 -0.45 -0.43 0.41 -2.23 0.00 0.00 178.31 176.27 2cq8 n GLY 88 N -1.34 -2.14 0.10 2.40 0.00 0.46 0.15 105.19 104.83 2cq8 n GLY 88 Ca -0.01 1.10 -0.13 0.00 0.00 0.00 0.00 46.02 46.98 2cq8 n GLY 88 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2cq8 h ASP 89 N 0.00 -0.14 0.15 1.61 1.82 -1.28 -2.52 116.42 116.07 2cq8 h ASP 89 Ca 0.28 -0.04 0.01 0.00 -0.39 0.00 0.00 57.03 56.89 2cq8 h ASP 89 Cb 0.53 0.04 -0.04 0.00 0.68 0.00 0.00 39.33 40.53 2cq8 h ASP 89 CO -0.94 -0.05 -0.48 0.15 -1.61 0.00 0.00 179.24 176.31 2cq8 h PHE 90 N -0.22 -1.39 -1.00 0.28 3.57 0.36 -1.80 116.94 116.74 2cq8 h PHE 90 Ca -0.02 0.03 0.15 0.00 3.53 0.00 0.00 57.97 61.67 2cq8 h PHE 90 Cb 0.17 0.59 -0.16 0.00 2.79 0.00 0.00 35.95 39.34 2cq8 h PHE 90 CO -0.05 -0.55 -0.40 0.82 -2.23 0.00 0.00 178.31 175.90 2cq8 h ILE 91 N -0.72 0.00 -0.61 1.41 1.08 0.14 1.03 117.51 119.84 2cq8 h ILE 91 Ca -0.01 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.58 2cq8 h ILE 91 Cb 0.71 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 34.35 2cq8 h ILE 91 CO -0.24 0.00 -0.10 1.56 -0.69 0.00 0.00 178.15 178.68 2cq8 h GLN 92 N -0.00 0.03 -0.18 2.37 1.08 -0.93 1.10 115.11 118.59 2cq8 h GLN 92 Ca 0.34 -0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.53 2cq8 h GLN 92 Cb 0.59 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.01 2cq8 h GLN 92 CO -0.99 0.02 0.08 1.25 -0.95 0.00 0.00 178.83 178.24 2cq8 h LEU 93 N 0.03 0.24 0.44 1.46 6.46 0.16 -1.18 115.31 122.93 2cq8 h LEU 93 Ca 0.30 -0.13 -0.01 0.00 -0.12 0.00 0.00 57.88 57.92 2cq8 h LEU 93 Cb 0.48 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 40.32 2cq8 h LEU 93 CO -0.59 0.30 -0.43 0.25 -0.62 0.00 0.00 178.44 177.35 2cq8 h LEU 94 N 0.15 -1.15 -0.73 2.25 5.85 0.22 -1.37 115.31 120.52 2cq8 h LEU 94 Ca 0.06 0.09 0.15 0.00 0.84 0.00 0.00 57.88 59.02 2cq8 h LEU 94 Cb 0.13 0.38 -0.14 0.00 0.37 0.00 0.00 40.66 41.41 2cq8 h LEU 94 CO -0.01 -0.58 -0.19 0.58 -0.34 0.00 0.00 178.44 177.90 2cq8 h VAL 95 N -0.88 0.27 -0.81 1.05 2.07 0.12 1.18 116.25 119.26 2cq8 h VAL 95 Ca -0.04 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.63 2cq8 h VAL 95 Cb 0.77 0.27 -0.10 0.00 -1.52 0.00 0.00 31.29 30.71 2cq8 h VAL 95 CO -0.05 0.00 0.36 0.03 0.02 0.00 0.00 177.57 177.92 2cq8 h ARG 96 N -0.00 0.48 0.04 1.57 3.08 -0.58 1.12 114.38 120.09 2cq8 h ARG 96 Ca 0.35 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.37 2cq8 h ARG 96 Cb 0.53 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.48 2cq8 h ARG 96 CO -0.75 0.32 -0.02 0.87 -1.07 0.00 0.00 179.97 179.32 2cq8 h LYS 97 N 0.50 -0.05 -0.74 0.04 1.57 0.14 -2.17 116.57 115.86 2cq8 h LYS 97 Ca 0.45 0.00 0.13 0.00 -1.87 0.00 0.00 60.65 59.37 2cq8 h LYS 97 Cb 0.70 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.93 2cq8 h LYS 97 CO -0.41 0.51 0.30 -0.07 -0.57 0.00 0.00 179.45 179.22 2cq8 h LEU 98 N -0.66 0.29 -0.24 2.94 3.38 0.20 -0.22 115.31 121.01 2cq8 h LEU 98 Ca -0.01 0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.07 2cq8 h LEU 98 Cb 0.59 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 2cq8 h LEU 98 CO 0.01 0.12 0.14 0.03 0.09 0.00 0.00 178.44 178.83 2cq8 h ARG 99 N 0.46 0.28 -4.35 1.13 3.08 0.13 -3.37 114.38 111.74 2cq8 h ARG 99 Ca 0.40 -0.02 -0.65 0.00 0.07 0.00 0.00 59.98 59.79 2cq8 h ARG 99 Cb 0.59 -0.06 -0.40 0.00 0.08 0.00 0.00 29.97 30.17 2cq8 h ARG 99 CO -0.39 0.19 -0.71 0.20 -1.07 0.00 0.00 179.97 178.19 2cq8 s GLY 100 N -2.43 1.89 -0.06 0.04 0.00 -0.13 -4.81 107.32 101.83 2cq8 s GLY 100 Ca -0.13 -2.52 0.02 0.00 0.00 0.00 0.00 44.72 42.09 2cq8 s GLY 100 CO 0.70 1.05 0.60 1.34 0.00 0.00 0.00 173.10 176.78 2cq8 n ASP 101 N 4.17 -0.45 -3.58 1.64 2.03 -0.98 -4.54 116.55 114.84 2cq8 n ASP 101 Ca 0.04 -1.06 -0.05 0.00 0.52 0.00 0.00 54.79 54.24 2cq8 n ASP 101 Cb 0.41 0.18 -0.02 0.00 -0.72 0.00 0.00 41.12 40.96 2cq8 n ASP 101 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2cq8 s ASP 102 N -0.40 -0.18 0.06 1.67 -1.08 -1.26 -5.00 116.67 110.48 2cq8 s ASP 102 Ca 0.01 -0.00 0.02 0.00 -0.52 0.00 0.00 52.55 52.06 2cq8 s ASP 102 Cb 0.07 0.19 -0.04 0.00 -1.46 0.00 0.00 42.92 41.69 2cq8 s ASP 102 CO -0.02 -0.31 0.11 -1.83 0.52 0.00 0.00 175.17 173.64 2cq8 s GLU 103 N -2.56 3.05 -0.29 4.34 -1.05 -1.26 -4.78 118.70 116.15 2cq8 s GLU 103 Ca 0.09 -0.59 -0.05 0.00 -0.15 0.00 0.00 54.97 54.26 2cq8 s GLU 103 Cb -0.01 -2.83 0.01 0.00 -0.44 0.00 0.00 34.13 30.86 2cq8 s GLU 103 CO -0.05 0.59 0.20 0.39 0.95 0.00 0.00 175.26 177.34 2cq8 n GLU 104 N 0.58 -2.40 -3.88 -4.83 4.71 -1.26 -5.02 120.64 108.54 2cq8 n GLU 104 Ca -0.09 2.10 -0.30 0.00 -0.01 0.00 0.00 57.16 58.86 2cq8 n GLU 104 Cb 0.52 -4.62 -0.15 0.00 -1.01 0.00 0.00 31.44 26.17 2cq8 n GLU 104 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 2cq8 s SER 105 N -1.71 4.37 0.00 1.62 1.04 -1.26 -5.07 113.70 112.68 2cq8 s SER 105 Ca 0.08 -1.86 0.00 0.00 0.48 0.00 0.00 55.95 54.66 2cq8 s SER 105 Cb -0.02 -1.23 0.00 0.00 0.10 0.00 0.00 66.02 64.86 2cq8 s SER 105 CO 0.62 -0.39 0.00 0.61 0.98 0.00 0.00 173.24 175.06 2cq8 n GLY 106 N 4.56 -2.15 0.12 7.32 0.00 -1.26 -4.65 105.19 109.13 2cq8 n GLY 106 Ca 0.00 -1.65 -0.09 0.00 0.00 0.00 0.00 46.02 44.28 2cq8 n GLY 106 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cq8 h PRO 107 N 0.00 -0.17 -3.38 1.61 0.13 -2.06 -3.50 132.00 124.64 2cq8 h PRO 107 Ca 0.00 0.01 0.37 0.00 -0.87 0.00 0.00 66.00 65.51 2cq8 h PRO 107 Cb 0.00 0.04 -0.14 0.00 0.13 0.00 0.00 31.00 31.02 2cq8 h PRO 107 CO 0.00 0.26 -0.89 0.45 -0.23 0.00 0.00 178.00 177.59 2cq8 n SER 108 N -4.87 -8.66 -3.39 1.44 2.88 -1.26 -4.99 113.62 94.77 2cq8 n SER 108 Ca -0.07 1.01 0.02 0.00 -1.33 0.00 0.00 58.87 58.50 2cq8 n SER 108 Cb 0.25 -4.69 -0.04 0.00 -0.75 0.00 0.00 64.21 58.99 2cq8 n SER 108 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2cq8 s SER 109 N -7.18 -0.68 0.00 -3.46 0.15 -1.26 -5.21 113.70 96.06 2cq8 s SER 109 Ca 0.00 0.84 0.00 0.00 0.70 0.00 0.00 55.95 57.49 2cq8 s SER 109 Cb 0.00 1.74 0.00 0.00 -1.71 0.00 0.00 66.02 66.05 2cq8 s SER 109 CO 0.00 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 174.92