#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 -0.86 -2.13 1.61 3.41 -1.26 -4.57 113.62 109.82 2cq8 n SER 2 Ca 0.00 0.40 -0.02 0.00 -0.26 0.00 0.00 58.87 58.99 2cq8 n SER 2 Cb 0.00 -1.34 -0.02 0.00 -0.26 0.00 0.00 64.21 62.60 2cq8 n SER 2 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2cq8 n SER 3 N -2.56 -4.14 -0.21 4.04 2.88 -1.26 -4.97 113.62 107.40 2cq8 n SER 3 Ca 0.09 1.17 0.00 0.00 -1.33 0.00 0.00 58.87 58.80 2cq8 n SER 3 Cb 0.53 -4.09 0.00 0.00 -0.75 0.00 0.00 64.21 59.90 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 1.29 -3.47 3.13 0.46 0.00 -1.26 -5.08 105.19 100.26 2cq8 n GLY 4 Ca -0.16 -0.94 -0.16 0.00 0.00 0.00 0.00 46.02 44.76 2cq8 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cq8 s SER 5 N -1.27 1.37 0.00 1.61 0.01 -1.26 -4.94 113.70 109.23 2cq8 s SER 5 Ca 0.00 -0.59 -0.24 0.00 1.31 0.00 0.00 55.95 56.43 2cq8 s SER 5 Cb 0.00 -0.02 -0.14 0.00 0.21 0.00 0.00 66.02 66.07 2cq8 s SER 5 CO 0.00 -0.12 1.07 0.28 0.41 0.00 0.00 173.24 174.88 2cq8 h SER 6 N 4.38 -0.61 -4.91 2.44 0.02 -1.98 -3.47 113.55 109.42 2cq8 h SER 6 Ca -0.39 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.48 2cq8 h SER 6 Cb 1.20 0.16 -0.19 0.00 0.14 0.00 0.00 62.40 63.71 2cq8 h SER 6 CO 0.40 -0.23 0.23 -0.83 -1.14 0.00 0.00 176.83 175.27 2cq8 s GLY 7 N -2.62 -0.55 0.09 -3.77 0.00 -1.26 -5.07 107.32 94.14 2cq8 s GLY 7 Ca -0.13 1.29 0.00 0.00 0.00 0.00 0.00 44.72 45.88 2cq8 s GLY 7 CO 0.43 0.87 0.00 0.33 0.00 0.00 0.00 173.10 174.73 2cq8 n PHE 8 N 0.73 -1.08 -2.18 1.90 7.35 -1.26 -5.13 117.46 117.79 2cq8 n PHE 8 Ca -0.18 0.18 -0.27 0.00 -0.76 0.00 0.00 57.45 56.42 2cq8 n PHE 8 Cb 0.58 0.67 0.15 0.00 0.35 0.00 0.00 39.48 41.23 2cq8 n PHE 8 CO 0.00 0.00 0.00 0.12 -0.76 0.00 0.00 176.76 176.12 2cq8 s PHE 9 N -2.00 1.66 -0.18 -5.13 5.36 -1.26 -4.80 117.98 111.62 2cq8 s PHE 9 Ca 0.00 0.11 -0.07 0.00 -0.96 0.00 0.00 56.93 56.00 2cq8 s PHE 9 Cb 0.00 -3.66 0.03 0.00 -0.34 0.00 0.00 43.02 39.05 2cq8 s PHE 9 CO 0.00 -2.25 0.15 1.63 -1.46 0.00 0.00 175.22 173.29 2cq8 n LYS 10 N -3.38 -3.71 -3.00 10.12 5.02 -1.26 -5.01 118.16 116.94 2cq8 n LYS 10 Ca 0.15 2.89 -0.16 0.00 -2.02 0.00 0.00 58.31 59.17 2cq8 n LYS 10 Cb 0.60 -4.39 -0.01 0.00 -0.02 0.00 0.00 35.03 31.21 2cq8 n LYS 10 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2cq8 n GLY 11 N 1.57 1.84 2.28 0.72 0.00 -1.26 -5.04 105.19 105.29 2cq8 n GLY 11 Ca -0.25 -0.87 -0.04 0.00 0.00 0.00 0.00 46.02 44.86 2cq8 n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cq8 n ALA 12 N 1.16 -3.52 -2.90 4.61 0.00 -1.26 -5.06 120.51 113.53 2cq8 n ALA 12 Ca 0.16 1.74 -0.01 0.00 0.00 0.00 0.00 53.44 55.33 2cq8 n ALA 12 Cb 0.60 -3.39 0.01 0.00 0.00 0.00 0.00 19.45 16.67 2cq8 n ALA 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cq8 s ALA 13 N -0.49 -2.86 0.47 0.00 0.00 -1.26 -5.14 121.76 112.48 2cq8 s ALA 13 Ca -0.21 0.17 0.00 0.00 0.00 0.00 0.00 51.96 51.92 2cq8 s ALA 13 Cb 0.01 -2.80 0.00 0.00 0.00 0.00 0.00 23.12 20.33 2cq8 s ALA 13 CO 0.57 -2.31 0.00 0.45 0.00 0.00 0.00 175.76 174.47 2cq8 n SER 14 N 3.50 -7.32 -3.66 0.00 2.88 -1.26 -4.87 113.62 102.89 2cq8 n SER 14 Ca 0.13 1.03 -0.28 0.00 -1.33 0.00 0.00 58.87 58.42 2cq8 n SER 14 Cb 0.59 -4.39 -0.16 0.00 -0.75 0.00 0.00 64.21 59.50 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 -6.77 3.26 -0.00 -3.46 1.04 -1.26 -5.12 113.70 101.39 2cq8 s SER 15 Ca 0.00 -1.11 0.03 0.00 0.48 0.00 0.00 55.95 55.35 2cq8 s SER 15 Cb 0.00 -0.53 -0.01 0.00 0.10 0.00 0.00 66.02 65.58 2cq8 s SER 15 CO 0.00 -0.38 -0.10 0.54 0.98 0.00 0.00 173.24 174.28 2cq8 s VAL 16 N 1.92 0.79 -0.02 5.02 0.11 -1.26 -5.08 120.40 121.88 2cq8 s VAL 16 Ca 0.05 -0.51 -0.04 0.00 -2.93 0.00 0.00 61.98 58.55 2cq8 s VAL 16 Cb -0.17 -0.68 -0.04 0.00 -1.53 0.00 0.00 36.38 33.96 2cq8 s VAL 16 CO -0.21 0.17 0.20 -0.76 -3.33 0.00 0.00 175.10 171.17 2cq8 s LEU 17 N -0.39 4.37 -0.29 2.54 1.43 -1.26 -5.07 118.68 120.02 2cq8 s LEU 17 Ca 0.03 0.42 -0.19 0.00 -1.03 0.00 0.00 54.13 53.37 2cq8 s LEU 17 Cb -0.04 -2.57 -0.02 0.00 0.03 0.00 0.00 46.19 43.59 2cq8 s LEU 17 CO -0.00 0.28 0.55 -1.83 0.23 0.00 0.00 176.35 175.57 2cq8 s GLU 18 N -1.78 3.96 0.96 1.70 -1.05 -1.26 -4.97 118.70 116.26 2cq8 s GLU 18 Ca 0.26 0.25 -0.11 0.00 -0.15 0.00 0.00 54.97 55.22 2cq8 s GLU 18 Cb -0.13 -3.69 0.17 0.00 -0.44 0.00 0.00 34.13 30.04 2cq8 s GLU 18 CO 0.16 -0.45 1.10 -0.51 0.95 0.00 0.00 175.26 176.51 2cq8 s LEU 19 N 2.40 2.21 0.19 1.83 2.01 -1.26 -5.04 118.68 121.03 2cq8 s LEU 19 Ca 0.22 1.84 -0.15 0.00 0.01 0.00 0.00 54.13 56.05 2cq8 s LEU 19 Cb -0.15 -4.13 0.02 0.00 0.01 0.00 0.00 46.19 41.93 2cq8 s LEU 19 CO 0.10 -3.21 0.46 0.42 1.01 0.00 0.00 176.35 175.14 2cq8 s THR 20 N -2.68 0.04 0.29 5.49 -4.23 -1.26 -4.92 115.64 108.37 2cq8 s THR 20 Ca 0.66 -0.95 0.17 0.00 -1.18 0.00 0.00 61.69 60.40 2cq8 s THR 20 Cb -0.22 -1.66 0.29 0.00 1.34 0.00 0.00 72.50 72.25 2cq8 s THR 20 CO 0.59 -0.16 1.20 1.21 -0.54 0.00 0.00 174.62 176.92 2cq8 n GLU 21 N -0.31 -0.04 0.00 3.99 2.13 -1.26 0.24 120.64 125.39 2cq8 n GLU 21 Ca -0.09 1.03 0.00 0.00 0.66 0.00 0.00 57.16 58.76 2cq8 n GLU 21 Cb 0.62 -1.89 0.00 0.00 0.27 0.00 0.00 31.44 30.45 2cq8 n GLU 21 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2cq8 n ALA 22 N -2.46 -0.26 -0.17 4.31 0.00 -1.26 -2.44 120.51 118.23 2cq8 n ALA 22 Ca 0.29 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.72 2cq8 n ALA 22 Cb 1.02 0.00 0.08 0.00 0.00 0.00 0.00 19.45 20.55 2cq8 n ALA 22 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2cq8 h GLU 23 N 0.00 0.17 -0.99 0.00 3.07 -1.11 -0.95 114.58 114.77 2cq8 h GLU 23 Ca 0.00 -0.01 0.18 0.00 -0.50 0.00 0.00 59.36 59.03 2cq8 h GLU 23 Cb 0.00 -0.04 -0.18 0.00 -0.84 0.00 0.00 28.75 27.70 2cq8 h GLU 23 CO 0.00 0.11 -0.30 -0.07 -1.40 0.00 0.00 179.01 177.35 2cq8 h LEU 24 N 0.17 -1.12 -0.88 1.33 4.07 0.30 2.78 115.31 121.97 2cq8 h LEU 24 Ca 0.28 0.30 0.17 0.00 0.08 0.00 0.00 57.88 58.71 2cq8 h LEU 24 Cb 0.41 0.67 -0.10 0.00 1.08 0.00 0.00 40.66 42.72 2cq8 h LEU 24 CO -0.41 -0.31 0.44 0.58 -1.08 0.00 0.00 178.44 177.66 2cq8 h VAL 25 N -0.00 0.65 0.12 1.22 2.07 -0.83 1.52 116.25 121.00 2cq8 h VAL 25 Ca 0.42 -0.19 -0.23 0.00 0.82 0.00 0.00 66.70 67.52 2cq8 h VAL 25 Cb 0.67 0.03 0.02 0.00 -1.52 0.00 0.00 31.29 30.50 2cq8 h VAL 25 CO -1.00 0.10 -0.96 0.74 0.02 0.00 0.00 177.57 176.47 2cq8 h THR 26 N 0.57 1.41 0.00 2.57 2.02 0.35 -1.85 112.91 117.97 2cq8 h THR 26 Ca 0.50 -2.43 -0.01 0.00 0.77 0.00 0.00 66.41 65.24 2cq8 h THR 26 Cb 0.80 2.91 -0.00 0.00 -1.74 0.00 0.00 68.15 70.12 2cq8 h THR 26 CO -0.41 0.71 -0.06 0.00 0.37 0.00 0.00 175.52 176.13 2cq8 h ALA 27 N 0.20 1.53 0.17 6.16 0.00 0.53 0.18 119.26 128.03 2cq8 h ALA 27 Ca -0.15 -0.05 -0.32 0.00 0.00 0.00 0.00 54.91 54.38 2cq8 h ALA 27 Cb 1.70 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.49 2cq8 h ALA 27 CO 0.18 0.07 -1.53 0.93 0.00 0.00 0.00 179.25 178.90 2cq8 h GLU 28 N 0.00 0.36 -0.40 0.00 4.39 0.21 -2.71 114.58 116.43 2cq8 h GLU 28 Ca -0.00 -0.62 -0.07 0.00 0.34 0.00 0.00 59.36 59.01 2cq8 h GLU 28 Cb 0.14 0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 2cq8 h GLU 28 CO 0.01 1.26 -0.03 0.00 -1.16 0.00 0.00 179.01 179.09 2cq8 h ALA 29 N 0.33 0.54 -0.71 3.43 0.00 -0.42 -2.50 119.26 119.93 2cq8 h ALA 29 Ca -0.26 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.33 2cq8 h ALA 29 Cb 2.07 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.69 2cq8 h ALA 29 CO 0.20 0.34 0.26 0.28 0.00 0.00 0.00 179.25 180.33 2cq8 h VAL 30 N 0.54 1.25 -1.00 0.00 2.07 -0.79 -2.29 116.25 116.03 2cq8 h VAL 30 Ca 0.11 -0.82 0.12 0.00 0.82 0.00 0.00 66.70 66.93 2cq8 h VAL 30 Cb 0.52 0.46 -0.08 0.00 -1.52 0.00 0.00 31.29 30.66 2cq8 h VAL 30 CO 0.03 0.33 0.63 -0.09 0.02 0.00 0.00 177.57 178.48 2cq8 h ARG 31 N 1.02 0.95 -0.22 1.57 2.43 -1.23 0.23 114.38 119.14 2cq8 h ARG 31 Ca 0.23 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.32 2cq8 h ARG 31 Cb 0.25 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 2cq8 h ARG 31 CO -0.01 0.63 0.02 1.03 -1.51 0.00 0.00 179.97 180.13 2cq8 h SER 32 N 0.98 0.28 0.09 -3.80 0.87 -0.97 -1.09 113.55 109.91 2cq8 h SER 32 Ca 0.50 -0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 61.02 2cq8 h SER 32 Cb 0.50 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 2cq8 h SER 32 CO -0.26 0.32 -0.04 0.58 -0.53 0.00 0.00 176.83 176.90 2cq8 h VAL 33 N 0.31 1.00 -0.55 2.23 2.07 -0.37 0.97 116.25 121.91 2cq8 h VAL 33 Ca 0.07 -0.30 0.04 0.00 0.82 0.00 0.00 66.70 67.34 2cq8 h VAL 33 Cb 0.17 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 2cq8 h VAL 33 CO 0.00 0.07 0.30 -0.50 0.02 0.00 0.00 177.57 177.46 2cq8 h TRP 34 N -0.25 0.55 0.73 1.57 4.06 -0.99 0.63 115.95 122.24 2cq8 h TRP 34 Ca -0.01 0.02 -0.04 0.00 2.06 0.00 0.00 58.89 60.92 2cq8 h TRP 34 Cb 0.21 -0.17 0.01 0.00 -1.00 0.00 0.00 29.16 28.21 2cq8 h TRP 34 CO -0.03 0.28 -0.35 1.96 -3.56 0.00 0.00 178.44 176.74 2cq8 h GLN 35 N 0.57 -0.94 -0.79 0.49 1.08 -0.87 0.48 115.11 115.14 2cq8 h GLN 35 Ca 0.24 0.06 0.13 0.00 -1.45 0.00 0.00 58.65 57.62 2cq8 h GLN 35 Cb 0.11 0.21 -0.09 0.00 -0.05 0.00 0.00 27.48 27.67 2cq8 h GLN 35 CO -0.14 -0.61 0.39 0.00 -0.95 0.00 0.00 178.83 177.51 2cq8 h ARG 36 N -1.05 0.58 0.00 1.46 3.08 0.13 -3.00 114.38 115.57 2cq8 h ARG 36 Ca -0.10 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.92 2cq8 h ARG 36 Cb 0.77 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.69 2cq8 h ARG 36 CO 0.16 0.38 0.00 -0.89 -1.07 0.00 0.00 179.97 178.55 2cq8 n ILE 37 N -4.89 0.00 -2.06 2.04 5.41 0.22 -4.52 119.36 115.56 2cq8 n ILE 37 Ca 0.14 1.24 -0.43 0.00 1.00 0.00 0.00 62.75 64.71 2cq8 n ILE 37 Cb 0.37 -2.23 -0.03 0.00 -0.71 0.00 0.00 39.64 37.05 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 -3.80 3.77 -0.01 1.39 1.43 0.17 -4.91 118.68 116.72 2cq8 s LEU 38 Ca 0.00 1.53 -0.01 0.00 -1.03 0.00 0.00 54.13 54.62 2cq8 s LEU 38 Cb 0.00 -3.53 -0.01 0.00 0.03 0.00 0.00 46.19 42.68 2cq8 s LEU 38 CO 0.00 -1.41 0.27 1.55 0.23 0.00 0.00 176.35 176.99 2cq8 h PRO 39 N 11.46 -0.04 -1.00 1.29 0.13 -1.79 -3.31 132.00 138.74 2cq8 h PRO 39 Ca -0.34 0.00 0.39 0.00 -0.87 0.00 0.00 66.00 65.18 2cq8 h PRO 39 Cb 1.16 0.01 -0.18 0.00 0.13 0.00 0.00 31.00 32.12 2cq8 h PRO 39 CO 1.01 -0.02 0.45 0.87 -0.23 0.00 0.00 178.00 180.08 2cq8 h LYS 40 N -0.11 0.01 -5.97 0.86 1.57 -1.92 -3.35 116.57 107.65 2cq8 h LYS 40 Ca -0.00 -0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 2cq8 h LYS 40 Cb 0.03 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 2cq8 h LYS 40 CO 0.01 0.01 1.49 0.28 -0.57 0.00 0.00 179.45 180.66 2cq8 n VAL 41 N -5.29 0.30 0.01 0.50 0.31 -1.25 -4.79 118.33 108.12 2cq8 n VAL 41 Ca 0.35 -0.45 -0.11 0.00 -0.01 0.00 0.00 64.34 64.13 2cq8 n VAL 41 Cb 1.19 -2.43 -0.14 0.00 -0.91 0.00 0.00 33.84 31.55 2cq8 n VAL 41 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2cq8 h LEU 42 N 14.86 0.11 -7.82 7.52 3.38 -1.87 -3.47 115.31 128.03 2cq8 h LEU 42 Ca -0.38 -0.20 -0.30 0.00 0.09 0.00 0.00 57.88 57.09 2cq8 h LEU 42 Cb 1.25 -0.04 -0.29 0.00 0.09 0.00 0.00 40.66 41.68 2cq8 h LEU 42 CO 0.98 1.17 -0.75 -0.70 0.09 0.00 0.00 178.44 179.23 2cq8 s GLU 43 N -2.62 0.31 -0.19 1.13 2.12 -1.26 -5.10 118.70 113.10 2cq8 s GLU 43 Ca -0.06 -0.11 -0.03 0.00 0.36 0.00 0.00 54.97 55.13 2cq8 s GLU 43 Cb 0.08 -0.33 -0.01 0.00 0.26 0.00 0.00 34.13 34.13 2cq8 s GLU 43 CO 0.82 0.05 -0.08 0.08 -0.54 0.00 0.00 175.26 175.60 2cq8 s VAL 44 N 0.06 3.24 0.09 3.70 1.01 -1.26 -5.01 120.40 122.23 2cq8 s VAL 44 Ca -0.00 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.42 2cq8 s VAL 44 Cb -0.03 -2.44 -0.00 0.00 0.00 0.00 0.00 36.38 33.91 2cq8 s VAL 44 CO -0.00 0.46 0.00 -1.84 0.00 0.00 0.00 175.10 173.72 2cq8 n GLU 45 N 4.34 1.74 0.21 2.72 0.00 -1.26 -5.00 120.64 123.39 2cq8 n GLU 45 Ca -0.18 -0.65 0.13 0.00 0.00 0.00 0.00 57.16 56.45 2cq8 n GLU 45 Cb 0.51 0.18 0.28 0.00 0.00 0.00 0.00 31.44 32.42 2cq8 n GLU 45 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.13 177.51 2cq8 h ASP 46 N 0.22 0.00 0.84 -1.84 2.03 -1.99 -2.90 116.42 112.79 2cq8 h ASP 46 Ca -0.07 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.23 2cq8 h ASP 46 Cb 0.22 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.72 2cq8 h ASP 46 CO 0.12 0.00 -0.66 -1.28 -1.03 0.00 0.00 179.24 176.39 2cq8 h SER 47 N 0.00 0.00 -3.14 4.15 0.87 -1.98 -3.12 113.55 110.34 2cq8 h SER 47 Ca 0.00 -0.22 -0.53 0.00 -1.23 0.00 0.00 61.79 59.82 2cq8 h SER 47 Cb 0.88 0.00 0.06 0.00 -0.44 0.00 0.00 62.40 62.91 2cq8 h SER 47 CO 0.00 0.11 0.87 -0.89 -0.53 0.00 0.00 176.83 176.39 2cq8 s THR 48 N -3.17 2.33 -0.22 2.23 2.01 -1.09 -4.90 115.64 112.82 2cq8 s THR 48 Ca 0.06 0.27 -0.06 0.00 0.31 0.00 0.00 61.69 62.26 2cq8 s THR 48 Cb 0.13 -3.17 -0.03 0.00 0.01 0.00 0.00 72.50 69.45 2cq8 s THR 48 CO 0.73 0.03 0.03 -0.62 -0.69 0.00 0.00 174.62 174.10 2cq8 s ASP 49 N 0.69 4.95 0.41 3.53 -1.08 -1.26 -2.07 116.67 121.84 2cq8 s ASP 49 Ca 0.65 -0.21 0.24 0.00 -0.52 0.00 0.00 52.55 52.71 2cq8 s ASP 49 Cb -0.46 -1.87 1.27 0.00 -1.46 0.00 0.00 42.92 40.41 2cq8 s ASP 49 CO 0.41 0.02 1.68 0.15 0.52 0.00 0.00 175.17 177.95 2cq8 h PHE 50 N 7.84 0.61 0.00 -5.34 3.57 0.13 0.32 116.94 124.07 2cq8 h PHE 50 Ca -0.38 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.15 2cq8 h PHE 50 Cb 1.17 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.75 2cq8 h PHE 50 CO 0.62 -0.10 -0.07 0.74 -2.23 0.00 0.00 178.31 177.27 2cq8 h PHE 51 N 0.22 0.00 -1.61 0.41 0.04 -1.87 -2.21 116.94 111.92 2cq8 h PHE 51 Ca 0.72 0.00 0.51 0.00 2.80 0.00 0.00 57.97 62.00 2cq8 h PHE 51 Cb 2.07 0.00 -0.11 0.00 2.20 0.00 0.00 35.95 40.12 2cq8 h PHE 51 CO -0.00 0.00 1.10 1.63 -0.60 0.00 0.00 178.31 180.44 2cq8 n LYS 52 N -3.32 -0.02 0.00 1.51 5.02 -0.96 -0.77 118.16 119.62 2cq8 n LYS 52 Ca -0.01 1.13 0.00 0.00 -2.02 0.00 0.00 58.31 57.41 2cq8 n LYS 52 Cb 0.04 -2.40 0.00 0.00 -0.02 0.00 0.00 35.03 32.65 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 -4.26 0.00 0.00 4.39 7.64 0.11 -4.93 113.62 116.56 2cq8 n SER 53 Ca 0.41 0.72 0.00 0.00 1.01 0.00 0.00 58.87 61.01 2cq8 n SER 53 Cb 1.72 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 64.63 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 -0.36 0.00 3.80 0.23 0.00 0.05 -4.89 105.19 104.02 2cq8 n GLY 54 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 3.54 0.27 4.61 0.00 -0.83 -4.89 121.76 124.45 2cq8 s ALA 55 Ca 0.00 0.13 0.04 0.00 0.00 0.00 0.00 51.96 52.13 2cq8 s ALA 55 Cb 0.00 -2.74 0.04 0.00 0.00 0.00 0.00 23.12 20.42 2cq8 s ALA 55 CO 0.00 0.35 0.33 0.00 0.00 0.00 0.00 175.76 176.44 2cq8 n ALA 56 N 1.77 0.53 0.36 0.00 0.00 -1.26 -4.81 120.51 117.10 2cq8 n ALA 56 Ca -0.09 -0.99 0.14 0.00 0.00 0.00 0.00 53.44 52.51 2cq8 n ALA 56 Cb 0.50 0.30 0.55 0.00 0.00 0.00 0.00 19.45 20.81 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 0.11 0.00 0.35 0.00 0.87 -2.01 -2.62 113.55 110.25 2cq8 h SER 57 Ca -0.13 0.00 -0.32 0.00 -1.23 0.00 0.00 61.79 60.11 2cq8 h SER 57 Cb 0.58 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.50 2cq8 h SER 57 CO 0.20 0.00 -1.84 1.33 -0.53 0.00 0.00 176.83 175.99 2cq8 n VAL 58 N -2.63 1.66 -0.16 2.23 0.24 -1.26 -3.96 118.33 114.45 2cq8 n VAL 58 Ca 0.02 -0.75 0.03 0.00 -2.04 0.00 0.00 64.34 61.60 2cq8 n VAL 58 Cb 0.29 -1.24 0.32 0.00 -1.47 0.00 0.00 33.84 31.73 2cq8 n VAL 58 CO 0.00 0.00 0.00 -0.78 -2.14 0.00 0.00 176.83 173.91 2cq8 h ASP 59 N 0.02 0.72 -0.29 -1.34 3.58 -1.84 0.24 116.42 117.51 2cq8 h ASP 59 Ca -0.34 -0.01 0.07 0.00 0.42 0.00 0.00 57.03 57.16 2cq8 h ASP 59 Cb 2.03 -0.17 -0.07 0.00 1.72 0.00 0.00 39.33 42.84 2cq8 h ASP 59 CO 0.08 0.50 -0.17 0.58 -2.88 0.00 0.00 179.24 177.35 2cq8 h VAL 60 N 0.84 0.50 -0.16 2.25 2.07 -1.65 0.91 116.25 121.02 2cq8 h VAL 60 Ca 0.26 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.67 2cq8 h VAL 60 Cb -0.00 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 2cq8 h VAL 60 CO -0.07 0.00 -0.38 0.58 0.02 0.00 0.00 177.57 177.72 2cq8 h VAL 61 N -0.14 1.30 0.65 2.57 2.07 -1.53 -1.53 116.25 119.64 2cq8 h VAL 61 Ca 0.16 -1.49 -0.03 0.00 0.82 0.00 0.00 66.70 66.15 2cq8 h VAL 61 Cb 0.37 1.61 0.01 0.00 -1.52 0.00 0.00 31.29 31.76 2cq8 h VAL 61 CO -0.38 0.45 -0.31 -0.09 0.02 0.00 0.00 177.57 177.26 2cq8 h ARG 62 N 0.29 -0.84 -0.21 1.57 2.43 0.12 1.51 114.38 119.25 2cq8 h ARG 62 Ca 0.03 0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.29 2cq8 h ARG 62 Cb 0.81 0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 30.52 2cq8 h ARG 62 CO 0.06 -0.53 -0.02 1.25 -1.51 0.00 0.00 179.97 179.22 2cq8 h LEU 63 N -0.96 -0.13 -0.86 3.80 5.85 0.77 1.66 115.31 125.44 2cq8 h LEU 63 Ca -0.09 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 2cq8 h LEU 63 Cb 0.69 0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.79 2cq8 h LEU 63 CO 0.15 -0.04 0.49 0.58 -0.34 0.00 0.00 178.44 179.27 2cq8 h VAL 64 N 0.04 1.25 -0.48 1.05 2.07 -1.19 0.26 116.25 119.24 2cq8 h VAL 64 Ca 0.10 -0.59 -0.12 0.00 0.82 0.00 0.00 66.70 66.91 2cq8 h VAL 64 Cb 0.14 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.97 2cq8 h VAL 64 CO -0.19 0.27 -0.18 -0.33 0.02 0.00 0.00 177.57 177.16 2cq8 h GLU 65 N 1.19 0.97 0.51 1.57 4.39 0.33 -1.28 114.58 122.27 2cq8 h GLU 65 Ca 0.30 -0.40 -0.03 0.00 0.34 0.00 0.00 59.36 59.58 2cq8 h GLU 65 Cb 0.00 -0.04 0.01 0.00 -0.10 0.00 0.00 28.75 28.62 2cq8 h GLU 65 CO -0.05 1.07 -0.25 0.93 -1.16 0.00 0.00 179.01 179.56 2cq8 h GLU 66 N 0.83 -0.66 0.00 2.33 5.08 0.30 -2.18 114.58 120.27 2cq8 h GLU 66 Ca 0.11 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2cq8 h GLU 66 Cb 0.75 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.15 2cq8 h GLU 66 CO 0.06 -0.36 0.03 0.28 -1.00 0.00 0.00 179.01 178.02 2cq8 h VAL 67 N -0.91 0.00 -0.05 3.13 2.07 -0.53 -0.72 116.25 119.25 2cq8 h VAL 67 Ca -0.07 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 2cq8 h VAL 67 Cb 0.60 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 2cq8 h VAL 67 CO 0.12 0.00 -0.02 0.11 0.02 0.00 0.00 177.57 177.79 2cq8 h LYS 68 N 0.00 0.11 0.00 1.57 1.57 -0.59 -2.60 116.57 116.62 2cq8 h LYS 68 Ca 0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2cq8 h LYS 68 Cb 0.06 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2cq8 h LYS 68 CO 0.00 0.48 0.00 0.93 -0.57 0.00 0.00 179.45 180.29 2cq8 h GLU 69 N -0.27 0.00 -0.11 3.15 4.39 -0.85 1.91 114.58 122.80 2cq8 h GLU 69 Ca 0.01 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.68 2cq8 h GLU 69 Cb 0.45 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.09 2cq8 h GLU 69 CO 0.01 0.00 -0.06 -0.07 -1.16 0.00 0.00 179.01 177.73 2cq8 h LEU 70 N 0.00 0.24 -2.79 1.33 3.38 -1.15 -3.09 115.31 113.23 2cq8 h LEU 70 Ca 0.00 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.55 2cq8 h LEU 70 Cb 0.31 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2cq8 h LEU 70 CO 0.00 0.61 0.00 0.00 0.09 0.00 0.00 178.44 179.14 2cq8 n ASP 72 N 1.19 -7.32 -2.08 0.00 -0.08 0.39 -4.26 116.55 104.39 2cq8 n ASP 72 Ca 0.19 0.63 -0.10 0.00 -1.51 0.00 0.00 54.79 54.00 2cq8 n ASP 72 Cb 0.54 -4.91 0.04 0.00 2.34 0.00 0.00 41.12 39.13 2cq8 n ASP 72 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2cq8 n GLY 73 N -0.15 0.15 3.49 0.27 0.00 0.55 -4.93 105.19 104.58 2cq8 n GLY 73 Ca 0.09 -0.22 -0.38 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 -2.59 1.30 -3.35 0.99 7.94 -0.95 -4.79 117.00 115.55 2cq8 n LEU 74 Ca -0.07 0.75 -0.39 0.00 -1.11 0.00 0.00 56.01 55.19 2cq8 n LEU 74 Cb 0.55 -1.21 -0.02 0.00 0.53 0.00 0.00 43.42 43.27 2cq8 n LEU 74 CO 0.30 -2.84 3.20 -1.84 -1.11 0.00 0.00 177.39 175.10 2cq8 n GLU 75 N -0.23 3.87 -4.24 1.96 0.28 -1.26 -4.84 120.64 116.17 2cq8 n GLU 75 Ca 0.12 -2.46 -0.31 0.00 -0.16 0.00 0.00 57.16 54.35 2cq8 n GLU 75 Cb 0.47 -2.78 -0.09 0.00 1.43 0.00 0.00 31.44 30.48 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 -0.25 3.41 0.10 -1.84 2.96 -1.26 -5.02 118.68 116.78 2cq8 s LEU 76 Ca 0.66 -0.12 0.03 0.00 -0.22 0.00 0.00 54.13 54.49 2cq8 s LEU 76 Cb 0.18 -2.05 -0.04 0.00 0.50 0.00 0.00 46.19 44.78 2cq8 s LEU 76 CO -0.07 0.23 -0.10 -1.83 -1.32 0.00 0.00 176.35 173.27 2cq8 s GLU 77 N -1.89 0.87 0.48 1.98 -1.05 -1.26 -5.01 118.70 112.82 2cq8 s GLU 77 Ca 0.22 -1.22 0.28 0.00 -0.15 0.00 0.00 54.97 54.10 2cq8 s GLU 77 Cb -0.11 -0.50 1.35 0.00 -0.44 0.00 0.00 34.13 34.43 2cq8 s GLU 77 CO 0.13 0.07 1.81 -0.91 0.95 0.00 0.00 175.26 177.31 2cq8 h ASN 78 N 3.38 0.19 0.01 0.83 2.35 -2.00 0.28 115.58 120.62 2cq8 h ASN 78 Ca -0.37 0.03 0.01 0.00 -0.55 0.00 0.00 56.30 55.42 2cq8 h ASN 78 Cb 1.19 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.55 2cq8 h ASN 78 CO 0.56 0.04 -0.04 -0.33 -1.65 0.00 0.00 177.43 176.01 2cq8 h GLU 79 N 0.16 -0.07 -0.67 0.81 4.39 -1.98 -1.59 114.58 115.64 2cq8 h GLU 79 Ca 0.55 0.00 0.13 0.00 0.34 0.00 0.00 59.36 60.39 2cq8 h GLU 79 Cb 1.86 0.02 -0.13 0.00 -0.10 0.00 0.00 28.75 30.39 2cq8 h GLU 79 CO -0.13 -0.05 -0.24 -0.44 -1.16 0.00 0.00 179.01 176.99 2cq8 h ASP 80 N -0.07 -0.87 -0.51 1.42 3.32 -0.84 1.21 116.42 120.08 2cq8 h ASP 80 Ca 0.01 0.22 0.06 0.00 0.02 0.00 0.00 57.03 57.34 2cq8 h ASP 80 Cb 0.09 0.50 -0.05 0.00 0.22 0.00 0.00 39.33 40.09 2cq8 h ASP 80 CO -0.03 -0.26 0.21 0.58 -1.72 0.00 0.00 179.24 178.01 2cq8 h VAL 81 N -0.06 0.87 0.00 -1.35 2.07 -1.36 0.58 116.25 117.00 2cq8 h VAL 81 Ca 0.30 -0.14 -0.04 0.00 0.82 0.00 0.00 66.70 67.63 2cq8 h VAL 81 Cb 0.54 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 2cq8 h VAL 81 CO -0.72 0.07 -0.21 1.88 0.02 0.00 0.00 177.57 178.61 2cq8 h TYR 82 N 0.41 0.00 0.16 1.57 0.05 0.89 -2.65 116.97 117.40 2cq8 h TYR 82 Ca 0.24 0.00 -0.30 0.00 0.05 0.00 0.00 58.73 58.72 2cq8 h TYR 82 Cb 0.22 0.00 0.03 0.00 1.01 0.00 0.00 36.73 37.98 2cq8 h TYR 82 CO -0.14 0.21 -1.30 0.52 -1.05 0.00 0.00 178.16 176.40 2cq8 h MET 83 N 0.00 0.51 -3.34 4.88 2.86 0.35 -3.40 114.93 116.78 2cq8 h MET 83 Ca -0.00 -0.76 -0.62 0.00 -2.06 0.00 0.00 59.70 56.26 2cq8 h MET 83 Cb 0.45 0.27 -0.40 0.00 0.06 0.00 0.00 31.60 31.97 2cq8 h MET 83 CO 0.03 1.35 -0.72 0.00 1.06 0.00 0.00 176.91 178.63 2cq8 s ALA 84 N -2.81 2.37 0.15 6.32 0.00 0.18 -4.94 121.76 123.03 2cq8 s ALA 84 Ca -0.08 -2.58 0.04 0.00 0.00 0.00 0.00 51.96 49.34 2cq8 s ALA 84 Cb 0.06 -1.91 -0.07 0.00 0.00 0.00 0.00 23.12 21.20 2cq8 s ALA 84 CO 0.92 -1.95 1.34 0.66 0.00 0.00 0.00 175.76 176.73 2cq8 h SER 85 N 7.00 0.16 -3.62 0.00 4.64 -1.75 -3.40 113.55 116.58 2cq8 h SER 85 Ca -0.05 -0.15 -0.51 0.00 -0.47 0.00 0.00 61.79 60.61 2cq8 h SER 85 Cb 0.94 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.95 2cq8 h SER 85 CO 0.53 1.01 0.08 0.42 -0.87 0.00 0.00 176.83 177.99 2cq8 s THR 86 N -3.02 4.66 0.09 2.95 -4.23 -1.26 0.17 115.64 114.99 2cq8 s THR 86 Ca -0.02 1.06 -0.32 0.00 -1.18 0.00 0.00 61.69 61.24 2cq8 s THR 86 Cb 0.10 -3.72 -0.15 0.00 1.34 0.00 0.00 72.50 70.07 2cq8 s THR 86 CO 0.83 0.01 1.62 0.15 -0.54 0.00 0.00 174.62 176.68 2cq8 h PHE 87 N 2.83 -0.92 -0.83 3.99 3.57 -1.57 0.22 116.94 124.23 2cq8 h PHE 87 Ca -0.48 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.10 2cq8 h PHE 87 Cb 1.18 0.34 -0.11 0.00 2.79 0.00 0.00 35.95 40.16 2cq8 h PHE 87 CO 0.63 -0.50 -0.57 0.78 -2.23 0.00 0.00 178.31 176.41 2cq8 h GLY 88 N -0.78 -0.84 0.86 2.40 0.00 -1.77 1.52 103.07 104.46 2cq8 h GLY 88 Ca -0.04 0.76 0.01 0.00 0.00 0.00 0.00 47.33 48.06 2cq8 h GLY 88 CO -0.00 -0.01 -0.04 -1.80 0.00 0.00 0.00 176.54 174.69 2cq8 h ASP 89 N -0.12 -0.11 0.19 0.19 3.58 -1.79 -2.27 116.42 116.09 2cq8 h ASP 89 Ca 0.14 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.62 2cq8 h ASP 89 Cb 0.47 0.06 -0.03 0.00 1.72 0.00 0.00 39.33 41.54 2cq8 h ASP 89 CO -0.84 -0.05 -0.44 0.15 -2.88 0.00 0.00 179.24 175.17 2cq8 h PHE 90 N -0.05 -1.27 -1.00 0.28 3.57 0.19 -1.67 116.94 116.99 2cq8 h PHE 90 Ca 0.03 0.03 0.15 0.00 3.53 0.00 0.00 57.97 61.71 2cq8 h PHE 90 Cb 0.09 0.53 -0.16 0.00 2.79 0.00 0.00 35.95 39.19 2cq8 h PHE 90 CO -0.13 -0.52 -0.39 0.82 -2.23 0.00 0.00 178.31 175.86 2cq8 h ILE 91 N -0.70 0.00 -0.66 1.41 1.08 0.21 1.18 117.51 120.04 2cq8 h ILE 91 Ca -0.02 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.59 2cq8 h ILE 91 Cb 0.67 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 34.31 2cq8 h ILE 91 CO -0.19 0.00 0.03 1.56 -0.69 0.00 0.00 178.15 178.86 2cq8 h GLN 92 N -0.00 0.14 -0.32 2.37 1.08 -0.80 1.38 115.11 118.95 2cq8 h GLN 92 Ca 0.35 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.51 2cq8 h GLN 92 Cb 0.60 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.98 2cq8 h GLN 92 CO -0.99 0.09 0.10 1.25 -0.95 0.00 0.00 178.83 178.33 2cq8 h LEU 93 N 0.14 0.46 0.72 1.46 6.46 0.20 -1.60 115.31 123.15 2cq8 h LEU 93 Ca 0.35 -0.21 -0.03 0.00 -0.12 0.00 0.00 57.88 57.87 2cq8 h LEU 93 Cb 0.58 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 40.39 2cq8 h LEU 93 CO -0.54 0.55 -0.39 0.25 -0.62 0.00 0.00 178.44 177.69 2cq8 h LEU 94 N 0.36 -0.94 -1.41 2.25 5.85 0.25 -0.85 115.31 120.83 2cq8 h LEU 94 Ca 0.10 0.04 0.33 0.00 0.84 0.00 0.00 57.88 59.19 2cq8 h LEU 94 Cb 0.25 0.26 -0.10 0.00 0.37 0.00 0.00 40.66 41.43 2cq8 h LEU 94 CO -0.00 -0.63 0.74 0.58 -0.34 0.00 0.00 178.44 178.79 2cq8 h VAL 95 N -1.02 0.38 0.04 1.05 2.07 0.18 0.76 116.25 119.70 2cq8 h VAL 95 Ca -0.10 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 2cq8 h VAL 95 Cb 0.80 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 2cq8 h VAL 95 CO 0.13 0.05 -0.02 0.03 0.02 0.00 0.00 177.57 177.79 2cq8 h ARG 96 N 0.27 -0.05 -0.29 1.57 3.08 -0.37 0.38 114.38 118.97 2cq8 h ARG 96 Ca 0.67 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.68 2cq8 h ARG 96 Cb 1.92 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.96 2cq8 h ARG 96 CO -0.33 0.23 -0.03 0.87 -1.07 0.00 0.00 179.97 179.64 2cq8 h LYS 97 N -0.32 0.44 0.56 0.04 1.57 0.12 0.51 116.57 119.49 2cq8 h LYS 97 Ca -0.00 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.65 2cq8 h LYS 97 Cb 0.30 -0.06 0.01 0.00 0.08 0.00 0.00 32.23 32.55 2cq8 h LYS 97 CO 0.01 0.50 -0.27 -0.07 -0.57 0.00 0.00 179.45 179.04 2cq8 h LEU 98 N 0.43 -0.64 -0.87 2.94 3.38 0.52 -2.29 115.31 118.78 2cq8 h LEU 98 Ca 0.09 -0.02 0.15 0.00 0.09 0.00 0.00 57.88 58.19 2cq8 h LEU 98 Cb 0.33 0.16 -0.09 0.00 0.09 0.00 0.00 40.66 41.15 2cq8 h LEU 98 CO 0.01 -0.24 0.46 0.03 0.09 0.00 0.00 178.44 178.79 2cq8 h ARG 99 N -1.13 0.63 0.00 1.13 3.08 -0.12 -3.25 114.38 114.71 2cq8 h ARG 99 Ca -0.08 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.94 2cq8 h ARG 99 Cb 0.62 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.53 2cq8 h ARG 99 CO 0.13 0.41 0.00 0.41 -1.07 0.00 0.00 179.97 179.85 2cq8 n GLY 100 N -1.33 -2.49 0.00 0.04 0.00 0.16 -5.04 105.19 96.53 2cq8 n GLY 100 Ca 0.18 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.12 0.00 -4.66 1.61 2.03 -0.87 -4.88 116.55 109.66 2cq8 n ASP 101 Ca 0.00 0.00 -0.40 0.00 0.52 0.00 0.00 54.79 54.91 2cq8 n ASP 101 Cb 0.00 0.38 -0.06 0.00 -0.72 0.00 0.00 41.12 40.72 2cq8 n ASP 101 CO 0.00 0.00 0.00 1.51 -1.92 0.00 0.00 177.20 176.79 2cq8 s ASP 102 N -3.41 6.74 0.23 1.67 1.47 -1.26 -4.85 116.67 117.26 2cq8 s ASP 102 Ca 0.00 0.90 0.00 0.00 1.18 0.00 0.00 52.55 54.63 2cq8 s ASP 102 Cb 0.00 -2.36 0.00 0.00 -0.34 0.00 0.00 42.92 40.22 2cq8 s ASP 102 CO 0.00 -0.28 0.00 -0.62 0.68 0.00 0.00 175.17 174.95 2cq8 n GLU 103 N 4.99 0.00 -3.25 2.11 1.02 -1.26 -5.13 120.64 119.12 2cq8 n GLU 103 Ca -0.01 0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.17 2cq8 n GLU 103 Cb 0.50 -0.05 -0.04 0.00 -0.02 0.00 0.00 31.44 31.83 2cq8 n GLU 103 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2cq8 s GLU 104 N -1.85 0.07 -0.30 3.49 -1.05 -1.26 -5.10 118.70 112.70 2cq8 s GLU 104 Ca 0.00 0.16 -0.18 0.00 -0.15 0.00 0.00 54.97 54.81 2cq8 s GLU 104 Cb 0.00 0.09 0.18 0.00 -0.44 0.00 0.00 34.13 33.96 2cq8 s GLU 104 CO 0.00 -0.02 1.20 -1.54 0.95 0.00 0.00 175.26 175.85 2cq8 s SER 105 N 2.00 -0.18 0.38 0.83 1.04 -1.26 -5.09 113.70 111.42 2cq8 s SER 105 Ca -0.01 0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.61 2cq8 s SER 105 Cb -0.01 1.18 0.00 0.00 0.10 0.00 0.00 66.02 67.29 2cq8 s SER 105 CO -0.16 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 174.64 2cq8 n GLY 106 N 5.04 1.88 3.56 7.32 0.00 -1.26 -3.72 105.19 118.01 2cq8 n GLY 106 Ca -0.08 0.52 -0.36 0.00 0.00 0.00 0.00 46.02 46.10 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 0.00 3.02 -0.03 1.61 0.04 -1.26 -4.83 135.00 133.55 2cq8 s PRO 107 Ca 0.00 -0.36 -0.17 0.00 0.04 0.00 0.00 61.00 60.51 2cq8 s PRO 107 Cb 0.00 -4.84 -0.10 0.00 0.04 0.00 0.00 34.50 29.60 2cq8 s PRO 107 CO 0.00 -2.64 0.71 1.03 0.04 0.00 0.00 177.00 176.14 2cq8 h SER 108 N 11.30 -0.51 -4.90 6.66 0.87 -1.99 -3.50 113.55 121.48 2cq8 h SER 108 Ca -0.02 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2cq8 h SER 108 Cb 1.05 0.13 -0.08 0.00 -0.44 0.00 0.00 62.40 63.06 2cq8 h SER 108 CO 1.29 -0.08 -1.37 -0.24 -0.53 0.00 0.00 176.83 175.91 2cq8 n SER 109 N -5.17 -4.20 0.00 6.23 2.88 -1.26 -5.02 113.62 107.07 2cq8 n SER 109 Ca -0.08 1.59 0.00 0.00 -1.33 0.00 0.00 58.87 59.05 2cq8 n SER 109 Cb 0.24 -5.29 0.00 0.00 -0.75 0.00 0.00 64.21 58.41 2cq8 n SER 109 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42