#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cq8 s SER 2 N 0.00 5.21 -0.24 1.61 0.01 -1.26 -5.04 113.70 113.99 2cq8 s SER 2 Ca 0.00 0.76 -0.19 0.00 1.31 0.00 0.00 55.95 57.83 2cq8 s SER 2 Cb 0.00 -1.55 -0.02 0.00 0.21 0.00 0.00 66.02 64.66 2cq8 s SER 2 CO 0.00 -1.38 0.57 -0.55 0.41 0.00 0.00 173.24 172.29 2cq8 s SER 3 N -4.41 6.53 0.75 2.44 0.15 -1.26 -5.05 113.70 112.85 2cq8 s SER 3 Ca 0.58 0.64 -0.12 0.00 0.70 0.00 0.00 55.95 57.75 2cq8 s SER 3 Cb -0.11 -2.31 0.05 0.00 -1.71 0.00 0.00 66.02 61.94 2cq8 s SER 3 CO 0.47 -0.30 1.11 -0.83 1.20 0.00 0.00 173.24 174.90 2cq8 s GLY 4 N 1.42 1.90 0.03 9.45 0.00 -1.26 -5.06 107.32 113.81 2cq8 s GLY 4 Ca 0.24 0.46 0.02 0.00 0.00 0.00 0.00 44.72 45.44 2cq8 s GLY 4 CO 0.09 0.82 -0.08 -0.45 0.00 0.00 0.00 173.10 173.48 2cq8 s SER 5 N -2.91 0.91 -0.20 1.64 0.15 -1.26 -4.99 113.70 107.05 2cq8 s SER 5 Ca 0.65 -0.41 -0.07 0.00 0.70 0.00 0.00 55.95 56.82 2cq8 s SER 5 Cb -0.20 -0.01 0.03 0.00 -1.71 0.00 0.00 66.02 64.12 2cq8 s SER 5 CO 0.50 -0.09 0.13 -0.24 1.20 0.00 0.00 173.24 174.74 2cq8 n SER 6 N 1.93 -3.05 0.00 5.45 2.88 -1.26 -5.06 113.62 114.52 2cq8 n SER 6 Ca -0.19 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.50 2cq8 n SER 6 Cb 0.56 -4.59 0.00 0.00 -0.75 0.00 0.00 64.21 59.43 2cq8 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cq8 n GLY 7 N 1.10 1.20 3.93 0.46 0.00 -1.26 -5.14 105.19 105.47 2cq8 n GLY 7 Ca -0.22 -1.42 -0.26 0.00 0.00 0.00 0.00 46.02 44.12 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 -1.84 3.50 -0.20 1.61 -0.12 -1.26 -5.04 117.98 114.63 2cq8 s PHE 8 Ca 0.00 0.48 -0.17 0.00 -0.05 0.00 0.00 56.93 57.19 2cq8 s PHE 8 Cb 0.00 -1.99 -0.14 0.00 -0.63 0.00 0.00 43.02 40.26 2cq8 s PHE 8 CO 0.00 0.13 0.04 1.19 -0.05 0.00 0.00 175.22 176.52 2cq8 n PHE 9 N -1.46 0.87 -3.51 3.49 3.01 -1.26 -5.06 117.46 113.54 2cq8 n PHE 9 Ca -0.03 0.38 -0.09 0.00 1.01 0.00 0.00 57.45 58.71 2cq8 n PHE 9 Cb 0.55 -0.98 -0.03 0.00 -0.01 0.00 0.00 39.48 39.01 2cq8 n PHE 9 CO 0.00 0.00 0.00 -1.59 1.01 0.00 0.00 176.76 176.18 2cq8 s LYS 10 N -2.36 0.81 0.05 -1.08 -2.85 -1.26 -5.16 119.74 107.90 2cq8 s LYS 10 Ca -0.26 -0.21 0.00 0.00 -1.00 0.00 0.00 55.97 54.50 2cq8 s LYS 10 Cb 0.06 0.38 0.00 0.00 -2.06 0.00 0.00 37.83 36.20 2cq8 s LYS 10 CO 0.48 -0.34 0.00 0.41 0.10 0.00 0.00 175.35 176.00 2cq8 n GLY 11 N -0.04 -2.83 3.19 0.59 0.00 -1.26 -5.05 105.19 99.79 2cq8 n GLY 11 Ca -0.10 -1.31 -0.17 0.00 0.00 0.00 0.00 46.02 44.44 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 -3.79 1.25 -0.23 4.61 0.00 -1.26 -5.06 121.76 117.27 2cq8 s ALA 12 Ca 0.00 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 50.83 2cq8 s ALA 12 Cb 0.00 -0.05 0.06 0.00 0.00 0.00 0.00 23.12 23.12 2cq8 s ALA 12 CO 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 175.76 175.79 2cq8 s ALA 13 N -1.85 2.04 0.05 0.00 0.00 -1.26 -5.11 121.76 115.64 2cq8 s ALA 13 Ca 0.03 -1.40 -0.02 0.00 0.00 0.00 0.00 51.96 50.57 2cq8 s ALA 13 Cb -0.07 -1.44 -0.03 0.00 0.00 0.00 0.00 23.12 21.59 2cq8 s ALA 13 CO 0.02 -1.16 0.01 0.45 0.00 0.00 0.00 175.76 175.08 2cq8 s SER 14 N 1.36 0.38 0.39 0.00 0.15 -1.26 -5.13 113.70 109.59 2cq8 s SER 14 Ca -0.06 -0.83 -0.26 0.00 0.70 0.00 0.00 55.95 55.50 2cq8 s SER 14 Cb -0.19 0.21 -0.11 0.00 -1.71 0.00 0.00 66.02 64.22 2cq8 s SER 14 CO -0.06 -0.56 1.17 -1.54 1.20 0.00 0.00 173.24 173.45 2cq8 n SER 15 N 0.38 2.09 -4.14 5.45 3.41 -1.26 -5.00 113.62 114.54 2cq8 n SER 15 Ca -0.16 1.11 -0.21 0.00 -0.26 0.00 0.00 58.87 59.35 2cq8 n SER 15 Cb 0.60 -1.43 -0.14 0.00 -0.26 0.00 0.00 64.21 62.98 2cq8 n SER 15 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2cq8 s VAL 16 N -1.19 1.15 -0.11 -3.33 1.01 -1.26 -5.11 120.40 111.56 2cq8 s VAL 16 Ca 0.60 -0.89 -0.12 0.00 0.00 0.00 0.00 61.98 61.57 2cq8 s VAL 16 Cb -0.55 -1.01 -0.05 0.00 0.00 0.00 0.00 36.38 34.77 2cq8 s VAL 16 CO 0.59 0.11 0.27 -0.76 0.00 0.00 0.00 175.10 175.31 2cq8 s LEU 17 N -0.90 4.34 -0.29 3.92 1.43 -1.26 -5.06 118.68 120.86 2cq8 s LEU 17 Ca 0.03 0.59 -0.17 0.00 -1.03 0.00 0.00 54.13 53.55 2cq8 s LEU 17 Cb -0.07 -2.32 -0.02 0.00 0.03 0.00 0.00 46.19 43.80 2cq8 s LEU 17 CO 0.01 0.24 0.48 -1.83 0.23 0.00 0.00 176.35 175.48 2cq8 s GLU 18 N -0.32 3.92 1.16 1.70 -1.05 -1.26 -4.89 118.70 117.95 2cq8 s GLU 18 Ca 0.17 0.11 -0.16 0.00 -0.15 0.00 0.00 54.97 54.95 2cq8 s GLU 18 Cb -0.13 -3.70 0.20 0.00 -0.44 0.00 0.00 34.13 30.05 2cq8 s GLU 18 CO 0.06 -0.42 0.48 1.28 0.95 0.00 0.00 175.26 177.60 2cq8 n LEU 19 N 5.55 -2.03 -3.79 1.83 7.99 -1.26 -5.05 117.00 120.25 2cq8 n LEU 19 Ca -0.05 -0.16 -0.10 0.00 -0.01 0.00 0.00 56.01 55.69 2cq8 n LEU 19 Cb 0.50 -1.09 -0.05 0.00 -0.11 0.00 0.00 43.42 42.67 2cq8 n LEU 19 CO 0.41 -3.21 0.18 0.42 -1.51 0.00 0.00 177.39 173.68 2cq8 s THR 20 N -2.31 0.04 0.22 -5.08 -4.23 -1.26 -4.90 115.64 98.13 2cq8 s THR 20 Ca 0.62 -0.93 0.02 0.00 -1.18 0.00 0.00 61.69 60.22 2cq8 s THR 20 Cb -0.18 -1.61 0.30 0.00 1.34 0.00 0.00 72.50 72.35 2cq8 s THR 20 CO 0.66 -0.19 1.12 1.21 -0.54 0.00 0.00 174.62 176.88 2cq8 n GLU 21 N -0.29 -0.06 0.03 3.99 2.13 -1.26 0.25 120.64 125.43 2cq8 n GLU 21 Ca -0.10 1.07 -0.01 0.00 0.66 0.00 0.00 57.16 58.78 2cq8 n GLU 21 Cb 0.63 -1.71 -0.01 0.00 0.27 0.00 0.00 31.44 30.62 2cq8 n GLU 21 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2cq8 h ALA 22 N 1.43 -0.55 -0.77 4.31 0.00 -2.01 -3.04 119.26 118.63 2cq8 h ALA 22 Ca 0.44 -0.02 0.15 0.00 0.00 0.00 0.00 54.91 55.48 2cq8 h ALA 22 Cb 0.93 0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.62 2cq8 h ALA 22 CO -0.67 -0.55 -0.26 0.93 0.00 0.00 0.00 179.25 178.71 2cq8 h GLU 23 N -0.15 -0.04 -1.00 0.00 5.08 -1.20 0.17 114.58 117.44 2cq8 h GLU 23 Ca -0.01 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.49 2cq8 h GLU 23 Cb 0.07 0.01 -0.15 0.00 0.50 0.00 0.00 28.75 29.18 2cq8 h GLU 23 CO 0.02 -0.03 -0.43 -0.07 -1.00 0.00 0.00 179.01 177.50 2cq8 h LEU 24 N -0.04 -1.59 -0.89 1.33 4.07 0.33 2.14 115.31 120.66 2cq8 h LEU 24 Ca 0.34 0.32 0.24 0.00 0.08 0.00 0.00 57.88 58.85 2cq8 h LEU 24 Cb 0.58 0.80 -0.14 0.00 1.08 0.00 0.00 40.66 42.98 2cq8 h LEU 24 CO -0.81 -0.28 0.31 0.58 -1.08 0.00 0.00 178.44 177.17 2cq8 h VAL 25 N -0.00 0.37 0.03 1.22 2.07 -0.53 1.56 116.25 120.97 2cq8 h VAL 25 Ca 0.31 -0.10 -0.22 0.00 0.82 0.00 0.00 66.70 67.52 2cq8 h VAL 25 Cb 0.56 0.07 0.02 0.00 -1.52 0.00 0.00 31.29 30.41 2cq8 h VAL 25 CO -0.98 0.05 -0.86 0.74 0.02 0.00 0.00 177.57 176.54 2cq8 h THR 26 N 0.28 1.36 0.00 2.57 2.02 0.28 -1.89 112.91 117.53 2cq8 h THR 26 Ca 0.57 -2.23 -0.01 0.00 0.77 0.00 0.00 66.41 65.51 2cq8 h THR 26 Cb 1.13 2.59 -0.00 0.00 -1.74 0.00 0.00 68.15 70.13 2cq8 h THR 26 CO -0.61 0.67 -0.03 0.00 0.37 0.00 0.00 175.52 175.92 2cq8 h ALA 27 N 0.32 1.16 0.15 6.16 0.00 0.58 -0.94 119.26 126.70 2cq8 h ALA 27 Ca -0.12 -0.03 -0.34 0.00 0.00 0.00 0.00 54.91 54.43 2cq8 h ALA 27 Cb 1.56 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.34 2cq8 h ALA 27 CO 0.17 0.03 -1.70 0.93 0.00 0.00 0.00 179.25 178.68 2cq8 h GLU 28 N 0.00 0.32 -0.75 0.00 4.39 0.21 -2.97 114.58 115.79 2cq8 h GLU 28 Ca -0.00 -0.55 -0.04 0.00 0.34 0.00 0.00 59.36 59.11 2cq8 h GLU 28 Cb 0.16 0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 28.98 2cq8 h GLU 28 CO 0.00 1.21 0.32 0.00 -1.16 0.00 0.00 179.01 179.39 2cq8 h ALA 29 N 0.27 1.16 -0.33 3.43 0.00 -0.45 -1.88 119.26 121.46 2cq8 h ALA 29 Ca -0.32 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 2cq8 h ALA 29 Cb 2.07 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 19.55 2cq8 h ALA 29 CO 0.16 0.62 -0.09 0.28 0.00 0.00 0.00 179.25 180.22 2cq8 h VAL 30 N 1.08 1.28 -0.97 0.00 2.07 -1.33 -2.79 116.25 115.59 2cq8 h VAL 30 Ca 0.25 -1.15 0.14 0.00 0.82 0.00 0.00 66.70 66.76 2cq8 h VAL 30 Cb 0.17 1.35 -0.08 0.00 -1.52 0.00 0.00 31.29 31.20 2cq8 h VAL 30 CO -0.03 0.37 0.61 -0.09 0.02 0.00 0.00 177.57 178.46 2cq8 h ARG 31 N 0.43 0.82 -0.14 1.57 2.43 -1.26 0.34 114.38 118.56 2cq8 h ARG 31 Ca 0.08 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.15 2cq8 h ARG 31 Cb 0.59 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 2cq8 h ARG 31 CO 0.03 0.54 -0.15 1.03 -1.51 0.00 0.00 179.97 179.92 2cq8 h SER 32 N 0.85 0.21 -0.28 -3.80 0.87 -1.10 -0.89 113.55 109.42 2cq8 h SER 32 Ca 0.50 -0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 61.00 2cq8 h SER 32 Cb 0.65 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.55 2cq8 h SER 32 CO -0.27 0.39 0.13 0.58 -0.53 0.00 0.00 176.83 177.13 2cq8 h VAL 33 N 0.21 1.16 0.40 2.23 2.07 -0.13 0.78 116.25 122.97 2cq8 h VAL 33 Ca 0.04 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 2cq8 h VAL 33 Cb 0.40 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 2cq8 h VAL 33 CO 0.02 0.16 -0.19 -0.50 0.02 0.00 0.00 177.57 177.08 2cq8 h TRP 34 N 0.31 -0.49 0.10 1.57 4.06 -0.98 0.50 115.95 121.02 2cq8 h TRP 34 Ca 0.10 -0.01 0.02 0.00 2.06 0.00 0.00 58.89 61.05 2cq8 h TRP 34 Cb 0.14 0.16 -0.05 0.00 -1.00 0.00 0.00 29.16 28.41 2cq8 h TRP 34 CO -0.02 -0.23 -0.41 1.96 -3.56 0.00 0.00 178.44 176.19 2cq8 h GLN 35 N -0.68 -0.61 -0.76 0.49 1.08 -1.03 1.18 115.11 114.77 2cq8 h GLN 35 Ca -0.05 0.04 0.16 0.00 -1.45 0.00 0.00 58.65 57.35 2cq8 h GLN 35 Cb 0.49 0.14 -0.11 0.00 -0.05 0.00 0.00 27.48 27.95 2cq8 h GLN 35 CO 0.09 -0.41 0.25 0.00 -0.95 0.00 0.00 178.83 177.82 2cq8 h ARG 36 N -0.63 0.34 0.00 1.46 3.08 0.63 -3.00 114.38 116.27 2cq8 h ARG 36 Ca 0.03 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2cq8 h ARG 36 Cb 0.67 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.64 2cq8 h ARG 36 CO -0.25 0.23 0.00 -0.89 -1.07 0.00 0.00 179.97 177.99 2cq8 n ILE 37 N -5.08 0.00 -1.86 2.04 5.41 0.16 -4.58 119.36 115.45 2cq8 n ILE 37 Ca 0.15 0.97 -0.43 0.00 1.00 0.00 0.00 62.75 64.45 2cq8 n ILE 37 Cb 0.46 -1.89 -0.03 0.00 -0.71 0.00 0.00 39.64 37.48 2cq8 n ILE 37 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2cq8 s LEU 38 N -3.38 3.68 0.00 1.39 1.43 0.40 -4.89 118.68 117.30 2cq8 s LEU 38 Ca 0.00 1.73 0.00 0.00 -1.03 0.00 0.00 54.13 54.83 2cq8 s LEU 38 Cb 0.00 -3.52 0.00 0.00 0.03 0.00 0.00 46.19 42.70 2cq8 s LEU 38 CO 0.00 -1.61 0.25 -0.81 0.23 0.00 0.00 176.35 174.40 2cq8 n PRO 39 N 8.26 0.00 -0.32 1.29 -0.04 -1.26 -3.83 135.00 139.10 2cq8 n PRO 39 Ca 0.24 0.49 0.24 0.00 -0.04 0.00 0.00 63.50 64.43 2cq8 n PRO 39 Cb 0.45 -1.11 0.46 0.00 -0.04 0.00 0.00 33.50 33.26 2cq8 n PRO 39 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2cq8 n LYS 40 N -1.96 -0.07 -1.61 0.54 4.01 -1.26 -4.15 118.16 113.67 2cq8 n LYS 40 Ca 0.00 1.39 -0.45 0.00 -0.51 0.00 0.00 58.31 58.73 2cq8 n LYS 40 Cb 0.00 -2.37 -0.04 0.00 -0.51 0.00 0.00 35.03 32.11 2cq8 n LYS 40 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 2cq8 n VAL 41 N -5.30 0.48 -0.03 -0.18 0.31 -1.25 -4.81 118.33 107.55 2cq8 n VAL 41 Ca 0.31 -0.28 -0.12 0.00 -0.01 0.00 0.00 64.34 64.24 2cq8 n VAL 41 Cb 1.05 -2.23 -0.14 0.00 -0.91 0.00 0.00 33.84 31.61 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 9.31 1.30 -3.96 7.52 4.32 -1.26 -4.90 117.00 129.33 2cq8 n LEU 42 Ca 0.27 0.28 -0.16 0.00 -0.02 0.00 0.00 56.01 56.39 2cq8 n LEU 42 Cb 0.37 -0.16 -0.14 0.00 -1.62 0.00 0.00 43.42 41.87 2cq8 n LEU 42 CO 0.70 0.55 -0.40 -0.70 -1.22 0.00 0.00 177.39 176.31 2cq8 s GLU 43 N -2.57 0.41 -0.34 3.23 2.12 -1.26 -5.07 118.70 115.22 2cq8 s GLU 43 Ca -0.11 -0.20 -0.02 0.00 0.36 0.00 0.00 54.97 54.99 2cq8 s GLU 43 Cb 0.07 -0.39 0.07 0.00 0.26 0.00 0.00 34.13 34.15 2cq8 s GLU 43 CO 0.80 0.11 0.07 0.08 -0.54 0.00 0.00 175.26 175.78 2cq8 s VAL 44 N -0.17 3.10 0.13 3.70 1.01 -1.26 -4.99 120.40 121.91 2cq8 s VAL 44 Ca 0.01 -1.62 0.02 0.00 0.00 0.00 0.00 61.98 60.40 2cq8 s VAL 44 Cb -0.02 -2.91 0.02 0.00 0.00 0.00 0.00 36.38 33.47 2cq8 s VAL 44 CO -0.00 -0.32 0.18 -1.84 0.00 0.00 0.00 175.10 173.12 2cq8 n GLU 45 N 4.61 0.90 0.05 2.72 0.00 -1.26 -4.96 120.64 122.70 2cq8 n GLU 45 Ca -0.09 -0.68 0.13 0.00 0.00 0.00 0.00 57.16 56.52 2cq8 n GLU 45 Cb 0.43 -0.06 0.50 0.00 0.00 0.00 0.00 31.44 32.31 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 -2.86 0.42 -0.63 -1.84 9.92 -1.26 -2.66 116.55 117.64 2cq8 n ASP 46 Ca 0.04 0.53 0.11 0.00 -0.53 0.00 0.00 54.79 54.93 2cq8 n ASP 46 Cb 0.13 -0.63 0.03 0.00 -0.64 0.00 0.00 41.12 40.01 2cq8 n ASP 46 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2cq8 n SER 47 N -1.89 2.30 -4.64 -2.24 7.64 -1.26 -2.65 113.62 110.88 2cq8 n SER 47 Ca 0.06 -1.65 -0.43 0.00 1.01 0.00 0.00 58.87 57.86 2cq8 n SER 47 Cb 0.39 0.30 -0.02 0.00 -1.01 0.00 0.00 64.21 63.86 2cq8 n SER 47 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2cq8 s THR 48 N -2.17 4.03 -0.17 0.44 2.01 -1.09 -4.91 115.64 113.77 2cq8 s THR 48 Ca 0.21 1.18 -0.23 0.00 0.31 0.00 0.00 61.69 63.16 2cq8 s THR 48 Cb 0.18 -3.99 -0.02 0.00 0.01 0.00 0.00 72.50 68.68 2cq8 s THR 48 CO 0.44 -0.35 0.74 -0.62 -0.69 0.00 0.00 174.62 174.14 2cq8 s ASP 49 N 3.03 6.85 0.63 3.53 -1.08 -1.26 -1.59 116.67 126.78 2cq8 s ASP 49 Ca 0.60 1.04 0.29 0.00 -0.52 0.00 0.00 52.55 53.96 2cq8 s ASP 49 Cb -0.20 -2.41 1.52 0.00 -1.46 0.00 0.00 42.92 40.37 2cq8 s ASP 49 CO 0.23 -0.33 1.89 0.15 0.52 0.00 0.00 175.17 177.64 2cq8 h PHE 50 N 7.35 0.00 0.00 -5.34 3.57 0.18 -0.56 116.94 122.14 2cq8 h PHE 50 Ca -0.31 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.19 2cq8 h PHE 50 Cb 1.14 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.88 2cq8 h PHE 50 CO 0.71 0.00 -0.27 1.19 -2.23 0.00 0.00 178.31 177.71 2cq8 n PHE 51 N -3.27 0.36 -0.54 0.41 3.72 -1.26 -2.74 117.46 114.14 2cq8 n PHE 51 Ca 0.03 0.15 0.43 0.00 -0.05 0.00 0.00 57.45 58.02 2cq8 n PHE 51 Cb 0.52 -0.44 0.71 0.00 -0.94 0.00 0.00 39.48 39.32 2cq8 n PHE 51 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2cq8 n LYS 52 N -3.34 -0.02 0.00 -1.08 5.02 -1.08 -0.44 118.16 117.22 2cq8 n LYS 52 Ca -0.04 1.17 0.00 0.00 -2.02 0.00 0.00 58.31 57.42 2cq8 n LYS 52 Cb 0.14 -2.42 0.00 0.00 -0.02 0.00 0.00 35.03 32.73 2cq8 n LYS 52 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2cq8 n SER 53 N -4.41 0.00 0.00 4.39 7.64 -0.24 -4.92 113.62 116.08 2cq8 n SER 53 Ca 0.41 0.96 0.00 0.00 1.01 0.00 0.00 58.87 61.24 2cq8 n SER 53 Cb 1.68 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 64.42 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 -0.96 0.00 3.73 0.23 0.00 0.42 -4.89 105.19 103.72 2cq8 n GLY 54 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 3.56 0.75 4.61 0.00 -1.11 -4.92 121.76 124.65 2cq8 s ALA 55 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 51.96 51.60 2cq8 s ALA 55 Cb 0.00 -2.47 0.00 0.00 0.00 0.00 0.00 23.12 20.65 2cq8 s ALA 55 CO 0.00 0.08 0.00 0.00 0.00 0.00 0.00 175.76 175.84 2cq8 n ALA 56 N 3.53 0.00 0.54 0.00 0.00 -1.26 -4.79 120.51 118.52 2cq8 n ALA 56 Ca -0.10 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.46 2cq8 n ALA 56 Cb 0.52 0.00 0.30 0.00 0.00 0.00 0.00 19.45 20.27 2cq8 n ALA 56 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2cq8 h SER 57 N 0.00 0.00 0.36 0.00 0.02 -2.02 -3.24 113.55 108.68 2cq8 h SER 57 Ca 0.00 -0.05 -0.32 0.00 -0.84 0.00 0.00 61.79 60.58 2cq8 h SER 57 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 2cq8 h SER 57 CO 0.00 0.03 -1.65 -0.37 -1.14 0.00 0.00 176.83 173.70 2cq8 h VAL 58 N 0.00 1.02 -0.63 2.27 -1.51 -2.01 -3.31 116.25 112.09 2cq8 h VAL 58 Ca 0.00 -2.68 0.08 0.00 -1.23 0.00 0.00 66.70 62.88 2cq8 h VAL 58 Cb 0.78 2.70 -0.04 0.00 -2.13 0.00 0.00 31.29 32.60 2cq8 h VAL 58 CO 0.00 0.81 0.42 0.44 -1.23 0.00 0.00 177.57 178.00 2cq8 h ASP 59 N 0.07 0.46 -0.23 4.19 5.19 -1.91 0.13 116.42 124.32 2cq8 h ASP 59 Ca -0.29 0.01 0.05 0.00 -0.62 0.00 0.00 57.03 56.18 2cq8 h ASP 59 Cb 2.03 -0.09 -0.05 0.00 0.18 0.00 0.00 39.33 41.40 2cq8 h ASP 59 CO 0.15 0.29 -0.12 0.58 -3.12 0.00 0.00 179.24 177.02 2cq8 h VAL 60 N 0.52 0.63 -0.20 -1.35 2.07 -1.64 1.35 116.25 117.63 2cq8 h VAL 60 Ca 0.28 0.00 -0.14 0.00 0.82 0.00 0.00 66.70 67.66 2cq8 h VAL 60 Cb 0.43 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 2cq8 h VAL 60 CO -0.09 0.00 -0.46 0.58 0.02 0.00 0.00 177.57 177.62 2cq8 h VAL 61 N -0.09 1.31 0.68 2.57 2.07 -1.36 -1.73 116.25 119.70 2cq8 h VAL 61 Ca 0.12 -1.66 -0.03 0.00 0.82 0.00 0.00 66.70 65.95 2cq8 h VAL 61 Cb 0.28 1.66 0.01 0.00 -1.52 0.00 0.00 31.29 31.71 2cq8 h VAL 61 CO -0.29 0.52 -0.33 -0.09 0.02 0.00 0.00 177.57 177.40 2cq8 h ARG 62 N 0.42 -0.89 -0.32 1.57 2.43 0.54 1.44 114.38 119.57 2cq8 h ARG 62 Ca 0.03 0.06 0.06 0.00 -0.81 0.00 0.00 59.98 59.32 2cq8 h ARG 62 Cb 0.97 0.20 -0.06 0.00 -0.42 0.00 0.00 29.97 30.66 2cq8 h ARG 62 CO 0.09 -0.56 -0.08 1.25 -1.51 0.00 0.00 179.97 179.15 2cq8 h LEU 63 N -1.04 -0.30 -0.27 3.80 5.85 0.17 1.62 115.31 125.15 2cq8 h LEU 63 Ca -0.09 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 2cq8 h LEU 63 Cb 0.73 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 2cq8 h LEU 63 CO 0.15 -0.11 0.15 0.58 -0.34 0.00 0.00 178.44 178.87 2cq8 h VAL 64 N -0.00 1.12 -0.88 1.05 2.07 -1.23 0.20 116.25 118.58 2cq8 h VAL 64 Ca 0.15 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 2cq8 h VAL 64 Cb 0.23 0.85 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 2cq8 h VAL 64 CO -0.33 0.12 0.54 -0.33 0.02 0.00 0.00 177.57 177.59 2cq8 h GLU 65 N 0.32 1.19 0.70 1.57 4.39 0.30 0.70 114.58 123.76 2cq8 h GLU 65 Ca 0.09 -0.10 -0.03 0.00 0.34 0.00 0.00 59.36 59.65 2cq8 h GLU 65 Cb 0.06 -0.25 0.01 0.00 -0.10 0.00 0.00 28.75 28.47 2cq8 h GLU 65 CO -0.02 0.83 -0.34 0.93 -1.16 0.00 0.00 179.01 179.26 2cq8 h GLU 66 N 1.21 -0.91 -0.02 2.33 5.08 0.28 -1.78 114.58 120.77 2cq8 h GLU 66 Ca 0.32 0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.74 2cq8 h GLU 66 Cb -0.06 0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 2cq8 h GLU 66 CO -0.06 -0.59 0.05 0.28 -1.00 0.00 0.00 179.01 177.68 2cq8 h VAL 67 N -1.00 0.20 -0.63 3.13 2.07 -0.80 0.12 116.25 119.34 2cq8 h VAL 67 Ca -0.10 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 2cq8 h VAL 67 Cb 0.74 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 2cq8 h VAL 67 CO 0.16 0.00 0.25 0.11 0.02 0.00 0.00 177.57 178.11 2cq8 h LYS 68 N 0.00 0.94 0.00 1.57 6.56 0.02 -1.74 116.57 123.92 2cq8 h LYS 68 Ca 0.01 -0.17 -0.06 0.00 -1.06 0.00 0.00 60.65 59.36 2cq8 h LYS 68 Cb 0.10 -0.15 -0.01 0.00 -0.57 0.00 0.00 32.23 31.60 2cq8 h LYS 68 CO -0.00 0.80 -0.29 0.93 -2.06 0.00 0.00 179.45 178.83 2cq8 h GLU 69 N 0.88 0.00 0.12 3.15 4.39 -0.64 1.88 114.58 124.36 2cq8 h GLU 69 Ca 0.21 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.90 2cq8 h GLU 69 Cb 0.21 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.86 2cq8 h GLU 69 CO -0.02 0.29 -0.06 -0.07 -1.16 0.00 0.00 179.01 178.00 2cq8 h LEU 70 N 0.00 -0.13 -1.00 1.33 3.38 -1.08 -2.68 115.31 115.13 2cq8 h LEU 70 Ca -0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2cq8 h LEU 70 Cb 0.75 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2cq8 h LEU 70 CO 0.04 -0.00 -0.24 0.00 0.09 0.00 0.00 178.44 178.32 2cq8 n ASP 72 N 0.06 -6.87 0.00 0.00 2.03 0.45 -4.45 116.55 107.77 2cq8 n ASP 72 Ca 0.13 -0.22 0.00 0.00 0.52 0.00 0.00 54.79 55.22 2cq8 n ASP 72 Cb 0.43 -4.79 0.00 0.00 -0.72 0.00 0.00 41.12 36.04 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 -1.57 1.04 3.73 0.27 0.00 0.53 -4.96 105.19 104.24 2cq8 n GLY 73 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 0.00 4.08 -3.41 0.99 7.94 -1.14 -4.82 117.00 120.63 2cq8 n LEU 74 Ca 0.00 1.20 -0.37 0.00 -1.11 0.00 0.00 56.01 55.73 2cq8 n LEU 74 Cb 0.00 -1.55 -0.02 0.00 0.53 0.00 0.00 43.42 42.38 2cq8 n LEU 74 CO 0.00 -0.15 2.96 -0.62 -1.11 0.00 0.00 177.39 178.47 2cq8 n GLU 75 N 0.88 3.06 -4.16 1.96 1.02 -1.26 -4.83 120.64 117.30 2cq8 n GLU 75 Ca 0.05 -2.14 -0.30 0.00 -0.02 0.00 0.00 57.16 54.74 2cq8 n GLU 75 Cb 0.37 -2.87 -0.08 0.00 -0.02 0.00 0.00 31.44 28.83 2cq8 n GLU 75 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2cq8 s LEU 76 N 0.73 3.37 0.05 -4.62 2.96 -1.26 -5.05 118.68 114.86 2cq8 s LEU 76 Ca 0.58 -0.21 0.01 0.00 -0.22 0.00 0.00 54.13 54.29 2cq8 s LEU 76 Cb 0.15 -2.10 -0.03 0.00 0.50 0.00 0.00 46.19 44.71 2cq8 s LEU 76 CO -0.05 0.18 -0.06 -1.83 -1.32 0.00 0.00 176.35 173.27 2cq8 s GLU 77 N -2.23 0.58 0.52 1.98 -1.05 -1.26 -5.01 118.70 112.22 2cq8 s GLU 77 Ca 0.24 -0.94 0.35 0.00 -0.15 0.00 0.00 54.97 54.47 2cq8 s GLU 77 Cb -0.12 -0.13 1.49 0.00 -0.44 0.00 0.00 34.13 34.94 2cq8 s GLU 77 CO 0.17 -0.01 1.77 -0.91 0.95 0.00 0.00 175.26 177.23 2cq8 h ASN 78 N 3.94 0.08 -0.06 0.83 2.35 -2.00 0.49 115.58 121.21 2cq8 h ASN 78 Ca -0.35 0.02 0.01 0.00 -0.55 0.00 0.00 56.30 55.43 2cq8 h ASN 78 Cb 1.19 0.01 -0.01 0.00 0.05 0.00 0.00 38.32 39.56 2cq8 h ASN 78 CO 0.50 0.00 0.01 -0.33 -1.65 0.00 0.00 177.43 175.97 2cq8 h GLU 79 N 0.06 0.04 -0.52 0.81 4.39 -1.98 -1.20 114.58 116.18 2cq8 h GLU 79 Ca 0.61 -0.00 0.10 0.00 0.34 0.00 0.00 59.36 60.41 2cq8 h GLU 79 Cb 2.29 -0.01 -0.10 0.00 -0.10 0.00 0.00 28.75 30.82 2cq8 h GLU 79 CO -0.07 0.02 -0.20 -0.44 -1.16 0.00 0.00 179.01 177.17 2cq8 h ASP 80 N 0.04 -0.69 -0.69 1.42 3.32 -0.42 0.90 116.42 120.30 2cq8 h ASP 80 Ca 0.03 0.18 0.07 0.00 0.02 0.00 0.00 57.03 57.33 2cq8 h ASP 80 Cb 0.02 0.40 -0.06 0.00 0.22 0.00 0.00 39.33 39.91 2cq8 h ASP 80 CO -0.04 -0.23 0.37 0.58 -1.72 0.00 0.00 179.24 178.20 2cq8 h VAL 81 N -0.07 0.92 0.00 -1.35 2.07 -1.35 0.99 116.25 117.46 2cq8 h VAL 81 Ca 0.25 -0.23 -0.04 0.00 0.82 0.00 0.00 66.70 67.50 2cq8 h VAL 81 Cb 0.45 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 2cq8 h VAL 81 CO -0.58 0.12 -0.17 1.88 0.02 0.00 0.00 177.57 178.84 2cq8 h TYR 82 N 0.66 0.00 0.15 1.57 0.05 0.77 -2.85 116.97 117.31 2cq8 h TYR 82 Ca 0.32 0.00 -0.28 0.00 0.05 0.00 0.00 58.73 58.82 2cq8 h TYR 82 Cb 0.25 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.00 2cq8 h TYR 82 CO -0.09 0.17 -1.38 0.52 -1.05 0.00 0.00 178.16 176.34 2cq8 h MET 83 N 0.00 0.31 -3.23 4.88 2.86 0.35 -3.41 114.93 116.69 2cq8 h MET 83 Ca -0.00 -0.53 -0.64 0.00 -2.06 0.00 0.00 59.70 56.47 2cq8 h MET 83 Cb 0.53 0.20 -0.41 0.00 0.06 0.00 0.00 31.60 31.97 2cq8 h MET 83 CO 0.02 1.25 -0.55 0.00 1.06 0.00 0.00 176.91 178.70 2cq8 s ALA 84 N -2.50 3.67 0.19 6.32 0.00 0.31 -4.89 121.76 124.86 2cq8 s ALA 84 Ca -0.17 -3.62 -0.02 0.00 0.00 0.00 0.00 51.96 48.15 2cq8 s ALA 84 Cb 0.04 -2.24 0.10 0.00 0.00 0.00 0.00 23.12 21.02 2cq8 s ALA 84 CO 0.81 -2.08 1.47 0.66 0.00 0.00 0.00 175.76 176.62 2cq8 h SER 85 N 5.90 0.51 -3.71 0.00 4.64 -1.75 -3.39 113.55 115.75 2cq8 h SER 85 Ca 0.06 -0.31 -0.50 0.00 -0.47 0.00 0.00 61.79 60.58 2cq8 h SER 85 Cb 0.81 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.73 2cq8 h SER 85 CO 0.72 1.03 0.22 0.42 -0.87 0.00 0.00 176.83 178.35 2cq8 s THR 86 N -3.77 4.39 0.10 2.95 -4.23 -1.26 0.19 115.64 114.01 2cq8 s THR 86 Ca -0.06 1.56 -0.29 0.00 -1.18 0.00 0.00 61.69 61.72 2cq8 s THR 86 Cb 0.11 -3.95 -0.13 0.00 1.34 0.00 0.00 72.50 69.87 2cq8 s THR 86 CO 0.84 0.20 1.63 0.15 -0.54 0.00 0.00 174.62 176.90 2cq8 h PHE 87 N 3.37 -0.77 -0.78 3.99 3.57 -1.47 0.20 116.94 125.06 2cq8 h PHE 87 Ca -0.47 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.12 2cq8 h PHE 87 Cb 1.19 0.29 -0.12 0.00 2.79 0.00 0.00 35.95 40.11 2cq8 h PHE 87 CO 0.63 -0.42 -0.51 0.78 -2.23 0.00 0.00 178.31 176.55 2cq8 h GLY 88 N -0.62 -0.63 0.98 2.40 0.00 -1.67 1.29 103.07 104.82 2cq8 h GLY 88 Ca -0.02 0.68 -0.01 0.00 0.00 0.00 0.00 47.33 47.99 2cq8 h GLY 88 CO -0.04 -0.07 -0.08 -1.80 0.00 0.00 0.00 176.54 174.55 2cq8 h ASP 89 N -0.13 -0.19 -0.01 0.19 1.82 -1.73 -2.63 116.42 113.75 2cq8 h ASP 89 Ca 0.18 0.01 0.02 0.00 -0.39 0.00 0.00 57.03 56.85 2cq8 h ASP 89 Cb 0.51 0.05 -0.06 0.00 0.68 0.00 0.00 39.33 40.52 2cq8 h ASP 89 CO -0.82 -0.13 -0.51 0.15 -1.61 0.00 0.00 179.24 176.32 2cq8 h PHE 90 N -0.21 -1.49 -0.98 0.28 3.57 0.15 -1.80 116.94 116.46 2cq8 h PHE 90 Ca -0.02 0.05 0.12 0.00 3.53 0.00 0.00 57.97 61.66 2cq8 h PHE 90 Cb 0.17 0.65 -0.14 0.00 2.79 0.00 0.00 35.95 39.42 2cq8 h PHE 90 CO -0.07 -0.56 -0.47 0.82 -2.23 0.00 0.00 178.31 175.79 2cq8 h ILE 91 N -0.65 0.00 -0.65 1.41 1.08 0.17 0.90 117.51 119.77 2cq8 h ILE 91 Ca 0.02 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.62 2cq8 h ILE 91 Cb 0.71 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 34.34 2cq8 h ILE 91 CO -0.36 0.00 -0.15 1.56 -0.69 0.00 0.00 178.15 178.51 2cq8 h GLN 92 N -0.01 0.01 -0.29 2.37 7.50 -0.98 1.38 115.11 125.08 2cq8 h GLN 92 Ca 0.26 -0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.40 2cq8 h GLN 92 Cb 0.52 -0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.03 2cq8 h GLN 92 CO -0.96 0.00 0.15 1.25 -1.50 0.00 0.00 178.83 177.78 2cq8 h LEU 93 N 0.01 0.37 0.81 1.46 6.46 0.12 -1.16 115.31 123.38 2cq8 h LEU 93 Ca 0.32 -0.11 -0.04 0.00 -0.12 0.00 0.00 57.88 57.93 2cq8 h LEU 93 Cb 0.48 -0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 40.32 2cq8 h LEU 93 CO -0.66 0.38 -0.48 0.25 -0.62 0.00 0.00 178.44 177.30 2cq8 h LEU 94 N 0.34 -1.21 -0.96 2.25 5.85 0.32 0.16 115.31 122.05 2cq8 h LEU 94 Ca 0.10 0.07 0.30 0.00 0.84 0.00 0.00 57.88 59.18 2cq8 h LEU 94 Cb 0.10 0.35 -0.15 0.00 0.37 0.00 0.00 40.66 41.33 2cq8 h LEU 94 CO -0.01 -0.75 0.43 0.58 -0.34 0.00 0.00 178.44 178.35 2cq8 h VAL 95 N -1.20 0.27 0.25 1.05 2.07 0.18 1.13 116.25 120.00 2cq8 h VAL 95 Ca -0.11 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 2cq8 h VAL 95 Cb 0.96 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 2cq8 h VAL 95 CO 0.12 0.05 -0.12 0.03 0.02 0.00 0.00 177.57 177.66 2cq8 h ARG 96 N 0.25 -0.33 -0.49 1.57 3.08 -0.49 0.68 114.38 118.65 2cq8 h ARG 96 Ca 0.68 0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.75 2cq8 h ARG 96 Cb 1.51 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.61 2cq8 h ARG 96 CO -0.65 -0.15 0.31 0.87 -1.07 0.00 0.00 179.97 179.27 2cq8 h LYS 97 N -0.43 0.66 0.43 0.04 1.57 0.18 0.26 116.57 119.28 2cq8 h LYS 97 Ca -0.03 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 2cq8 h LYS 97 Cb 0.32 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.49 2cq8 h LYS 97 CO 0.06 0.47 -0.23 -0.07 -0.57 0.00 0.00 179.45 179.10 2cq8 h LEU 98 N 0.66 -0.57 -0.45 2.94 3.38 0.13 -2.78 115.31 118.61 2cq8 h LEU 98 Ca 0.18 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.25 2cq8 h LEU 98 Cb -0.03 0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.82 2cq8 h LEU 98 CO -0.03 -0.38 0.08 0.03 0.09 0.00 0.00 178.44 178.22 2cq8 h ARG 99 N -0.62 0.20 0.00 1.13 3.08 0.64 -3.46 114.38 115.35 2cq8 h ARG 99 Ca -0.05 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2cq8 h ARG 99 Cb 0.49 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.50 2cq8 h ARG 99 CO 0.07 0.13 0.00 0.41 -1.07 0.00 0.00 179.97 179.51 2cq8 n GLY 100 N -1.27 2.61 3.51 0.04 0.00 0.89 -5.08 105.19 105.90 2cq8 n GLY 100 Ca 0.04 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 2cq8 n GLY 100 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2cq8 n ASP 101 N 0.00 -1.09 -4.26 1.61 2.03 -1.18 -4.86 116.55 108.79 2cq8 n ASP 101 Ca 0.00 0.12 -0.26 0.00 0.52 0.00 0.00 54.79 55.17 2cq8 n ASP 101 Cb 0.00 -1.30 -0.14 0.00 -0.72 0.00 0.00 41.12 38.96 2cq8 n ASP 101 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 2cq8 s ASP 102 N -2.38 2.55 0.42 1.67 1.01 -1.26 -5.08 116.67 113.59 2cq8 s ASP 102 Ca 0.65 -0.52 -0.23 0.00 0.71 0.00 0.00 52.55 53.16 2cq8 s ASP 102 Cb -0.22 -0.22 -0.09 0.00 1.01 0.00 0.00 42.92 43.40 2cq8 s ASP 102 CO 0.63 0.17 1.03 -0.70 0.21 0.00 0.00 175.17 176.51 2cq8 s GLU 103 N -1.15 4.12 0.09 8.23 2.12 -1.26 -5.06 118.70 125.79 2cq8 s GLU 103 Ca 0.08 1.43 0.02 0.00 0.36 0.00 0.00 54.97 56.86 2cq8 s GLU 103 Cb -0.09 -2.43 -0.04 0.00 0.26 0.00 0.00 34.13 31.83 2cq8 s GLU 103 CO 0.02 -0.16 -0.07 -2.00 -0.54 0.00 0.00 175.26 172.50 2cq8 s GLU 104 N -2.69 0.81 0.19 4.30 2.12 -1.26 -5.11 118.70 117.06 2cq8 s GLU 104 Ca 0.60 -1.25 -0.31 0.00 0.36 0.00 0.00 54.97 54.36 2cq8 s GLU 104 Cb -0.19 -0.27 -0.16 0.00 0.26 0.00 0.00 34.13 33.77 2cq8 s GLU 104 CO 0.24 0.00 1.02 0.45 -0.54 0.00 0.00 175.26 176.43 2cq8 n SER 105 N 0.20 0.81 -0.36 -1.70 2.88 -1.26 -4.98 113.62 109.22 2cq8 n SER 105 Ca -0.14 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.55 2cq8 n SER 105 Cb 0.60 -1.17 0.00 0.00 -0.75 0.00 0.00 64.21 62.89 2cq8 n SER 105 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cq8 n GLY 106 N 1.80 1.61 3.73 0.46 0.00 -1.26 -5.06 105.19 106.47 2cq8 n GLY 106 Ca 0.15 -1.98 -0.41 0.00 0.00 0.00 0.00 46.02 43.78 2cq8 n GLY 106 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cq8 s PRO 107 N 2.73 4.56 0.06 1.61 0.04 -1.26 -4.67 135.00 138.07 2cq8 s PRO 107 Ca 0.00 1.74 0.00 0.00 0.04 0.00 0.00 61.00 62.78 2cq8 s PRO 107 Cb 0.00 -3.29 0.00 0.00 0.04 0.00 0.00 34.50 31.25 2cq8 s PRO 107 CO 0.00 0.00 0.00 0.45 0.04 0.00 0.00 177.00 177.49 2cq8 n SER 108 N 2.64 -0.58 -1.65 6.66 2.88 -1.26 -5.14 113.62 117.16 2cq8 n SER 108 Ca 0.04 0.44 0.00 0.00 -1.33 0.00 0.00 58.87 58.01 2cq8 n SER 108 Cb 0.46 0.87 0.00 0.00 -0.75 0.00 0.00 64.21 64.79 2cq8 n SER 108 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2cq8 n SER 109 N -2.84 -7.64 0.00 -3.46 7.64 -1.26 -5.35 113.62 100.72 2cq8 n SER 109 Ca 0.00 1.08 0.00 0.00 1.01 0.00 0.00 58.87 60.96 2cq8 n SER 109 Cb 0.00 -4.07 0.00 0.00 -1.01 0.00 0.00 64.21 59.13 2cq8 n SER 109 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64