#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 -0.18 -0.30 1.61 1.04 -1.26 -5.16 113.70 109.45 2cq8 s SER 2 Ca 0.00 0.23 -0.17 0.00 0.48 0.00 0.00 55.95 56.48 2cq8 s SER 2 Cb 0.00 1.19 0.19 0.00 0.10 0.00 0.00 66.02 67.50 2cq8 s SER 2 CO 0.00 -0.03 1.18 -0.94 0.98 0.00 0.00 173.24 174.43 2cq8 s SER 3 N 2.23 -0.22 0.00 7.02 1.04 -1.26 -5.13 113.70 117.38 2cq8 s SER 3 Ca -0.01 0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.74 2cq8 s SER 3 Cb -0.03 1.18 0.00 0.00 0.10 0.00 0.00 66.02 67.27 2cq8 s SER 3 CO -0.16 -0.05 0.00 0.61 0.98 0.00 0.00 173.24 174.63 2cq8 n GLY 4 N 4.03 2.57 3.50 7.32 0.00 -1.26 -5.16 105.19 116.19 2cq8 n GLY 4 Ca -0.12 -0.76 -0.26 0.00 0.00 0.00 0.00 46.02 44.88 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 0.00 3.83 0.00 1.61 0.01 -1.26 -5.07 113.70 112.82 2cq8 s SER 5 Ca 0.00 -0.78 0.00 0.00 1.31 0.00 0.00 55.95 56.48 2cq8 s SER 5 Cb 0.00 -0.47 0.00 0.00 0.21 0.00 0.00 66.02 65.76 2cq8 s SER 5 CO 0.00 0.09 0.92 -0.24 0.41 0.00 0.00 173.24 174.42 2cq8 n SER 6 N -0.08 0.00 0.00 2.44 2.88 -1.26 -5.00 113.62 112.60 2cq8 n SER 6 Ca -0.10 0.92 0.00 0.00 -1.33 0.00 0.00 58.87 58.36 2cq8 n SER 6 Cb 0.57 -0.42 0.00 0.00 -0.75 0.00 0.00 64.21 63.61 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 -0.95 4.64 3.77 0.46 0.00 -1.26 -5.12 105.19 106.73 2cq8 n GLY 7 Ca 0.00 -0.82 -0.38 0.00 0.00 0.00 0.00 46.02 44.82 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 -0.53 3.20 -0.16 1.61 -0.12 -1.26 -5.03 117.98 115.68 2cq8 s PHE 8 Ca 0.00 1.60 -0.00 0.00 -0.05 0.00 0.00 56.93 58.47 2cq8 s PHE 8 Cb 0.00 -3.32 -0.00 0.00 -0.63 0.00 0.00 43.02 39.07 2cq8 s PHE 8 CO 0.00 -1.05 -0.14 0.12 -0.05 0.00 0.00 175.22 174.10 2cq8 s PHE 9 N -1.42 2.80 0.00 3.49 5.36 -1.26 -5.01 117.98 121.93 2cq8 s PHE 9 Ca 0.55 -1.01 0.00 0.00 -0.96 0.00 0.00 56.93 55.51 2cq8 s PHE 9 Cb -0.29 -1.90 0.00 0.00 -0.34 0.00 0.00 43.02 40.49 2cq8 s PHE 9 CO 0.37 -0.46 0.00 0.36 -1.46 0.00 0.00 175.22 174.03 2cq8 n LYS 10 N 4.08 0.00 0.00 10.12 2.85 -1.26 -4.54 118.16 129.40 2cq8 n LYS 10 Ca -0.19 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.07 2cq8 n LYS 10 Cb 0.52 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.90 2cq8 n LYS 10 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2cq8 n GLY 11 N 0.00 0.77 3.54 2.58 0.00 -1.26 -4.59 105.19 106.22 2cq8 n GLY 11 Ca 0.00 0.61 -0.14 0.00 0.00 0.00 0.00 46.02 46.49 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 -1.00 -1.82 1.03 4.61 0.00 -1.26 -5.16 121.76 118.15 2cq8 s ALA 12 Ca 0.00 1.36 -0.15 0.00 0.00 0.00 0.00 51.96 53.17 2cq8 s ALA 12 Cb 0.00 -0.20 0.09 0.00 0.00 0.00 0.00 23.12 23.01 2cq8 s ALA 12 CO 0.00 -0.38 0.34 0.00 0.00 0.00 0.00 175.76 175.72 2cq8 n ALA 13 N 0.72 -3.11 0.11 0.00 0.00 -1.26 -4.86 120.51 112.11 2cq8 n ALA 13 Ca -0.15 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.38 2cq8 n ALA 13 Cb 0.58 -1.73 0.00 0.00 0.00 0.00 0.00 19.45 18.30 2cq8 n ALA 13 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2cq8 n SER 14 N -1.89 0.15 -2.02 0.00 7.64 -1.26 -5.13 113.62 111.12 2cq8 n SER 14 Ca 0.04 0.37 0.00 0.00 1.01 0.00 0.00 58.87 60.29 2cq8 n SER 14 Cb 0.57 0.20 0.00 0.00 -1.01 0.00 0.00 64.21 63.96 2cq8 n SER 14 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2cq8 n SER 15 N -3.39 -8.99 -4.16 6.43 7.64 -1.26 -5.05 113.62 104.84 2cq8 n SER 15 Ca 0.00 1.36 -0.17 0.00 1.01 0.00 0.00 58.87 61.07 2cq8 n SER 15 Cb 0.00 -5.03 -0.12 0.00 -1.01 0.00 0.00 64.21 58.06 2cq8 n SER 15 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2cq8 s VAL 16 N -0.78 1.01 -0.05 0.44 0.11 -1.26 -4.99 120.40 114.88 2cq8 s VAL 16 Ca 0.00 -1.32 -0.04 0.00 -2.93 0.00 0.00 61.98 57.69 2cq8 s VAL 16 Cb 0.00 -1.04 -0.04 0.00 -1.53 0.00 0.00 36.38 33.77 2cq8 s VAL 16 CO 0.00 -0.29 0.13 -0.76 -3.33 0.00 0.00 175.10 170.85 2cq8 s LEU 17 N -1.82 4.23 -0.36 2.54 1.43 -1.26 -5.06 118.68 118.38 2cq8 s LEU 17 Ca -0.02 0.34 -0.24 0.00 -1.03 0.00 0.00 54.13 53.18 2cq8 s LEU 17 Cb -0.09 -2.29 0.01 0.00 0.03 0.00 0.00 46.19 43.85 2cq8 s LEU 17 CO 0.02 0.33 0.84 -1.61 0.23 0.00 0.00 176.35 176.15 2cq8 s GLU 18 N -1.49 3.81 1.27 1.70 2.02 -1.26 -5.00 118.70 119.76 2cq8 s GLU 18 Ca 0.21 0.45 -0.21 0.00 0.02 0.00 0.00 54.97 55.44 2cq8 s GLU 18 Cb -0.12 -3.80 0.31 0.00 0.10 0.00 0.00 34.13 30.63 2cq8 s GLU 18 CO 0.11 -0.87 1.07 -0.51 0.02 0.00 0.00 175.26 175.09 2cq8 s LEU 19 N 3.22 0.21 0.00 1.80 2.01 -1.26 -5.08 118.68 119.58 2cq8 s LEU 19 Ca 0.34 0.61 0.00 0.00 0.01 0.00 0.00 54.13 55.09 2cq8 s LEU 19 Cb -0.13 -2.23 0.00 0.00 0.01 0.00 0.00 46.19 43.84 2cq8 s LEU 19 CO 0.17 -4.51 0.00 0.35 1.01 0.00 0.00 176.35 173.37 2cq8 n THR 20 N -5.02 0.00 0.01 5.49 -2.24 -1.26 -4.91 114.28 106.35 2cq8 n THR 20 Ca 0.14 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.74 2cq8 n THR 20 Cb 0.60 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.74 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 0.75 0.00 -0.78 4.81 -1.99 -2.44 114.58 114.93 2cq8 h GLU 21 Ca 0.00 -0.70 -0.02 0.00 -0.13 0.00 0.00 59.36 58.52 2cq8 h GLU 21 Cb 0.00 0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.55 2cq8 h GLU 21 CO 0.00 1.29 -0.24 0.00 -0.73 0.00 0.00 179.01 179.33 2cq8 h ALA 22 N 0.49 0.02 -0.79 2.92 0.00 -2.00 -3.33 119.26 116.57 2cq8 h ALA 22 Ca -0.09 -0.29 0.14 0.00 0.00 0.00 0.00 54.91 54.67 2cq8 h ALA 22 Cb 1.54 0.20 -0.14 0.00 0.00 0.00 0.00 17.79 19.39 2cq8 h ALA 22 CO 0.18 0.20 -0.28 0.93 0.00 0.00 0.00 179.25 180.28 2cq8 h GLU 23 N -1.00 -0.05 -0.85 0.00 4.39 -1.96 0.31 114.58 115.42 2cq8 h GLU 23 Ca -0.02 0.00 0.14 0.00 0.34 0.00 0.00 59.36 59.82 2cq8 h GLU 23 Cb 0.36 0.01 -0.15 0.00 -0.10 0.00 0.00 28.75 28.87 2cq8 h GLU 23 CO -0.01 -0.03 -0.34 -0.07 -1.16 0.00 0.00 179.01 177.39 2cq8 h LEU 24 N -0.05 -1.25 -0.44 1.33 3.38 -1.60 1.40 115.31 118.09 2cq8 h LEU 24 Ca 0.33 0.28 0.06 0.00 0.09 0.00 0.00 57.88 58.64 2cq8 h LEU 24 Cb 0.58 0.67 -0.05 0.00 0.09 0.00 0.00 40.66 41.95 2cq8 h LEU 24 CO -0.82 -0.29 0.14 0.58 0.09 0.00 0.00 178.44 178.13 2cq8 h VAL 25 N -0.05 0.84 -0.41 1.22 2.07 -0.53 0.12 116.25 119.51 2cq8 h VAL 25 Ca 0.32 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.74 2cq8 h VAL 25 Cb 0.59 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 2cq8 h VAL 25 CO -0.88 0.05 0.27 0.74 0.02 0.00 0.00 177.57 177.77 2cq8 h THR 26 N 0.30 1.11 -0.77 2.57 2.02 0.16 0.10 112.91 118.40 2cq8 h THR 26 Ca 0.21 -0.21 0.10 0.00 0.77 0.00 0.00 66.41 67.27 2cq8 h THR 26 Cb 0.21 0.52 -0.05 0.00 -1.74 0.00 0.00 68.15 67.09 2cq8 h THR 26 CO -0.22 0.11 0.51 0.00 0.37 0.00 0.00 175.52 176.28 2cq8 h ALA 27 N 1.14 1.79 -0.14 6.16 0.00 0.24 0.10 119.26 128.55 2cq8 h ALA 27 Ca 0.15 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.86 2cq8 h ALA 27 Cb -0.05 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.58 2cq8 h ALA 27 CO -0.03 0.06 -0.70 0.93 0.00 0.00 0.00 179.25 179.50 2cq8 h GLU 28 N 0.70 0.60 -0.37 0.00 4.39 0.02 -1.63 114.58 118.29 2cq8 h GLU 28 Ca 0.36 -0.46 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 2cq8 h GLU 28 Cb 0.45 0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.17 2cq8 h GLU 28 CO -0.13 1.08 0.18 0.00 -1.16 0.00 0.00 179.01 178.98 2cq8 h ALA 29 N 0.80 0.48 -0.32 3.43 0.00 0.12 -1.78 119.26 121.98 2cq8 h ALA 29 Ca -0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2cq8 h ALA 29 Cb 1.29 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2cq8 h ALA 29 CO 0.13 0.03 0.13 0.28 0.00 0.00 0.00 179.25 179.82 2cq8 h VAL 30 N 0.46 1.18 -0.98 0.00 2.07 -0.87 -2.43 116.25 115.68 2cq8 h VAL 30 Ca 0.13 -0.55 0.20 0.00 0.82 0.00 0.00 66.70 67.30 2cq8 h VAL 30 Cb 0.10 0.95 -0.11 0.00 -1.52 0.00 0.00 31.29 30.72 2cq8 h VAL 30 CO -0.02 0.19 0.57 -0.09 0.02 0.00 0.00 177.57 178.25 2cq8 h ARG 31 N 0.37 0.67 -0.38 1.57 2.43 -0.97 0.61 114.38 118.68 2cq8 h ARG 31 Ca 0.11 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 2cq8 h ARG 31 Cb 0.18 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2cq8 h ARG 31 CO -0.01 0.44 0.16 1.03 -1.51 0.00 0.00 179.97 180.08 2cq8 h SER 32 N 0.69 0.48 -0.21 -3.80 0.87 -0.84 -1.37 113.55 109.37 2cq8 h SER 32 Ca 0.58 -0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 61.09 2cq8 h SER 32 Cb 0.95 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.77 2cq8 h SER 32 CO -0.41 0.43 0.12 0.58 -0.53 0.00 0.00 176.83 177.02 2cq8 h VAL 33 N 0.53 1.11 0.74 2.23 2.07 0.43 0.61 116.25 123.97 2cq8 h VAL 33 Ca 0.13 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.33 2cq8 h VAL 33 Cb 0.10 0.92 -0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2cq8 h VAL 33 CO -0.02 0.11 -0.45 -0.50 0.02 0.00 0.00 177.57 176.73 2cq8 h TRP 34 N 0.24 -1.19 -0.08 1.57 4.06 -0.87 0.90 115.95 120.58 2cq8 h TRP 34 Ca 0.08 -0.01 0.04 0.00 2.06 0.00 0.00 58.89 61.05 2cq8 h TRP 34 Cb 0.07 0.42 -0.06 0.00 -1.00 0.00 0.00 29.16 28.59 2cq8 h TRP 34 CO -0.04 -0.67 -0.43 1.96 -3.56 0.00 0.00 178.44 175.70 2cq8 h GLN 35 N -1.11 -0.52 -0.78 0.49 1.08 -1.14 0.98 115.11 114.12 2cq8 h GLN 35 Ca -0.10 0.04 0.19 0.00 -1.45 0.00 0.00 58.65 57.32 2cq8 h GLN 35 Cb 0.89 0.12 -0.13 0.00 -0.05 0.00 0.00 27.48 28.31 2cq8 h GLN 35 CO 0.10 -0.34 0.09 0.00 -0.95 0.00 0.00 178.83 177.73 2cq8 h ARG 36 N -0.54 0.15 0.00 1.46 3.08 0.37 -2.82 114.38 116.09 2cq8 h ARG 36 Ca 0.06 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.10 2cq8 h ARG 36 Cb 0.65 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.66 2cq8 h ARG 36 CO -0.37 0.10 0.00 -0.89 -1.07 0.00 0.00 179.97 177.74 2cq8 n ILE 37 N -5.28 0.00 -1.64 2.04 5.41 0.30 -4.59 119.36 115.60 2cq8 n ILE 37 Ca 0.16 1.00 -0.43 0.00 1.00 0.00 0.00 62.75 64.48 2cq8 n ILE 37 Cb 0.52 -1.94 -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 -3.63 3.51 0.00 1.39 1.43 0.33 -4.88 118.68 116.83 2cq8 s LEU 38 Ca 0.00 1.90 0.00 0.00 -1.03 0.00 0.00 54.13 55.00 2cq8 s LEU 38 Cb 0.00 -3.51 0.00 0.00 0.03 0.00 0.00 46.19 42.71 2cq8 s LEU 38 CO 0.00 -1.88 0.23 -0.81 0.23 0.00 0.00 176.35 174.12 2cq8 n PRO 39 N 8.65 0.00 -0.33 1.29 -0.04 -1.26 -3.86 135.00 139.46 2cq8 n PRO 39 Ca 0.29 0.43 0.25 0.00 -0.04 0.00 0.00 63.50 64.43 2cq8 n PRO 39 Cb 0.45 -1.06 0.48 0.00 -0.04 0.00 0.00 33.50 33.33 2cq8 n PRO 39 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2cq8 h LYS 40 N 0.00 0.02 -6.10 0.54 1.79 -1.93 -3.37 116.57 107.53 2cq8 h LYS 40 Ca 0.00 -0.00 -0.62 0.00 -2.18 0.00 0.00 60.65 57.85 2cq8 h LYS 40 Cb 0.00 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2cq8 h LYS 40 CO 0.00 0.02 1.33 0.28 -1.08 0.00 0.00 179.45 179.99 2cq8 n VAL 41 N -5.33 0.40 0.01 0.50 0.31 -1.25 -4.81 118.33 108.16 2cq8 n VAL 41 Ca 0.32 -0.27 -0.12 0.00 -0.01 0.00 0.00 64.34 64.27 2cq8 n VAL 41 Cb 1.08 -2.05 -0.14 0.00 -0.91 0.00 0.00 33.84 31.82 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 12.10 0.13 -7.97 7.52 3.38 -1.87 -3.47 115.31 125.12 2cq8 h LEU 42 Ca -0.40 -0.25 -0.21 0.00 0.09 0.00 0.00 57.88 57.11 2cq8 h LEU 42 Cb 1.27 -0.04 -0.23 0.00 0.09 0.00 0.00 40.66 41.76 2cq8 h LEU 42 CO 0.97 1.22 -0.71 -1.61 0.09 0.00 0.00 178.44 178.40 2cq8 s GLU 43 N -2.61 0.31 -0.24 1.13 2.02 -1.26 -5.09 118.70 112.96 2cq8 s GLU 43 Ca -0.08 -0.52 0.01 0.00 0.02 0.00 0.00 54.97 54.40 2cq8 s GLU 43 Cb 0.08 -0.02 0.04 0.00 0.10 0.00 0.00 34.13 34.33 2cq8 s GLU 43 CO 0.82 -0.01 -0.10 0.08 0.02 0.00 0.00 175.26 176.06 2cq8 s VAL 44 N -1.13 2.46 0.41 2.63 1.01 -1.26 -5.00 120.40 119.52 2cq8 s VAL 44 Ca -0.11 -1.24 0.03 0.00 0.00 0.00 0.00 61.98 60.66 2cq8 s VAL 44 Cb -0.08 -2.29 0.03 0.00 0.00 0.00 0.00 36.38 34.05 2cq8 s VAL 44 CO -0.01 0.17 0.27 -1.84 0.00 0.00 0.00 175.10 173.70 2cq8 n GLU 45 N 4.57 0.91 -0.00 2.72 0.00 -1.26 -4.99 120.64 122.59 2cq8 n GLU 45 Ca -0.16 -2.59 0.13 0.00 0.00 0.00 0.00 57.16 54.54 2cq8 n GLU 45 Cb 0.46 0.33 0.74 0.00 0.00 0.00 0.00 31.44 32.97 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 -1.80 0.08 -0.16 -1.84 9.92 -1.26 -2.49 116.55 119.01 2cq8 n ASP 46 Ca -0.03 -1.22 0.03 0.00 -0.53 0.00 0.00 54.79 53.03 2cq8 n ASP 46 Cb 0.47 -0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.95 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 -0.84 1.04 -4.65 -2.24 7.64 -1.26 -3.24 113.62 110.07 2cq8 n SER 47 Ca 0.19 -1.02 -0.43 0.00 1.01 0.00 0.00 58.87 58.62 2cq8 n SER 47 Cb 0.10 0.42 -0.02 0.00 -1.01 0.00 0.00 64.21 63.70 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 -0.99 4.55 -0.29 0.44 2.01 -1.04 -4.93 115.64 115.39 2cq8 s THR 48 Ca 0.06 1.85 -0.23 0.00 0.31 0.00 0.00 61.69 63.68 2cq8 s THR 48 Cb 0.05 -4.27 -0.00 0.00 0.01 0.00 0.00 72.50 68.28 2cq8 s THR 48 CO 0.15 -0.25 0.76 -0.62 -0.69 0.00 0.00 174.62 173.97 2cq8 s ASP 49 N 1.51 6.66 0.35 3.53 2.15 -1.26 -1.93 116.67 127.68 2cq8 s ASP 49 Ca 0.47 0.70 0.16 0.00 0.43 0.00 0.00 52.55 54.31 2cq8 s ASP 49 Cb -0.16 -2.39 1.18 0.00 -0.30 0.00 0.00 42.92 41.25 2cq8 s ASP 49 CO 0.10 -0.55 1.60 0.15 -0.17 0.00 0.00 175.17 176.30 2cq8 h PHE 50 N 8.02 0.68 0.15 -5.34 3.57 0.18 0.23 116.94 124.43 2cq8 h PHE 50 Ca -0.25 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.29 2cq8 h PHE 50 Cb 1.10 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.71 2cq8 h PHE 50 CO 0.77 -0.41 -0.07 0.74 -2.23 0.00 0.00 178.31 177.11 2cq8 h PHE 51 N 0.07 -0.19 -1.72 0.41 0.04 -1.86 -2.55 116.94 111.15 2cq8 h PHE 51 Ca 0.78 -0.00 0.52 0.00 2.80 0.00 0.00 57.97 62.07 2cq8 h PHE 51 Cb 1.94 0.06 -0.10 0.00 2.20 0.00 0.00 35.95 40.05 2cq8 h PHE 51 CO -0.10 -0.12 1.20 1.63 -0.60 0.00 0.00 178.31 180.32 2cq8 n LYS 52 N -3.99 -0.01 0.23 1.51 4.76 -0.57 0.44 118.16 120.52 2cq8 n LYS 52 Ca -0.02 1.11 -0.09 0.00 -2.87 0.00 0.00 58.31 56.43 2cq8 n LYS 52 Cb 0.08 -2.41 -0.04 0.00 -1.84 0.00 0.00 35.03 30.81 2cq8 n LYS 52 CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 2cq8 h SER 53 N 0.00 -0.51 0.00 4.39 0.02 -0.63 -3.48 113.55 113.35 2cq8 h SER 53 Ca 0.89 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.86 2cq8 h SER 53 Cb 3.35 0.13 0.00 0.00 0.14 0.00 0.00 62.40 66.02 2cq8 h SER 53 CO -0.16 -0.28 0.00 0.61 -1.14 0.00 0.00 176.83 175.86 2cq8 n GLY 54 N -0.51 0.00 3.70 -3.77 0.00 0.17 -4.85 105.19 99.92 2cq8 n GLY 54 Ca -0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 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 3.50 0.77 4.61 0.00 -0.97 -4.93 121.76 124.75 2cq8 s ALA 55 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 51.96 51.69 2cq8 s ALA 55 Cb 0.00 -2.73 0.00 0.00 0.00 0.00 0.00 23.12 20.39 2cq8 s ALA 55 CO 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 175.76 175.57 2cq8 n ALA 56 N 4.16 0.00 0.79 0.00 0.00 -1.26 -4.75 120.51 119.45 2cq8 n ALA 56 Ca -0.06 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.51 2cq8 n ALA 56 Cb 0.51 0.00 0.40 0.00 0.00 0.00 0.00 19.45 20.36 2cq8 n ALA 56 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2cq8 n SER 57 N -1.62 0.49 -0.03 0.00 7.64 -1.26 -3.47 113.62 115.37 2cq8 n SER 57 Ca 0.00 0.34 -0.17 0.00 1.01 0.00 0.00 58.87 60.05 2cq8 n SER 57 Cb 0.00 -0.35 -0.14 0.00 -1.01 0.00 0.00 64.21 62.71 2cq8 n SER 57 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2cq8 n VAL 58 N -1.88 1.66 -0.22 0.44 0.24 -1.26 -4.08 118.33 113.23 2cq8 n VAL 58 Ca 0.06 -0.70 0.05 0.00 -2.04 0.00 0.00 64.34 61.71 2cq8 n VAL 58 Cb 0.39 -1.40 0.31 0.00 -1.47 0.00 0.00 33.84 31.67 2cq8 n VAL 58 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 2cq8 h ASP 59 N 0.04 0.75 -0.48 -1.34 5.19 -1.92 0.04 116.42 118.71 2cq8 h ASP 59 Ca -0.43 0.00 0.10 0.00 -0.62 0.00 0.00 57.03 56.08 2cq8 h ASP 59 Cb 2.03 -0.16 -0.09 0.00 0.18 0.00 0.00 39.33 41.28 2cq8 h ASP 59 CO 0.05 0.49 -0.16 0.58 -3.12 0.00 0.00 179.24 177.08 2cq8 h VAL 60 N 0.86 0.45 -0.38 -1.35 2.07 -1.70 0.68 116.25 116.88 2cq8 h VAL 60 Ca 0.34 0.00 -0.16 0.00 0.82 0.00 0.00 66.70 67.70 2cq8 h VAL 60 Cb 0.22 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 2cq8 h VAL 60 CO -0.12 0.00 -0.38 0.58 0.02 0.00 0.00 177.57 177.68 2cq8 h VAL 61 N -0.05 1.27 0.21 2.57 2.07 -1.47 -2.37 116.25 118.49 2cq8 h VAL 61 Ca 0.23 -1.55 0.01 0.00 0.82 0.00 0.00 66.70 66.21 2cq8 h VAL 61 Cb 0.40 1.37 -0.04 0.00 -1.52 0.00 0.00 31.29 31.51 2cq8 h VAL 61 CO -0.52 0.52 -0.39 -0.09 0.02 0.00 0.00 177.57 177.11 2cq8 h ARG 62 N 0.75 -0.66 -0.45 1.57 2.43 0.95 1.56 114.38 120.54 2cq8 h ARG 62 Ca 0.06 0.04 0.08 0.00 -0.81 0.00 0.00 59.98 59.35 2cq8 h ARG 62 Cb 0.96 0.15 -0.06 0.00 -0.42 0.00 0.00 29.97 30.60 2cq8 h ARG 62 CO 0.09 -0.44 0.07 1.25 -1.51 0.00 0.00 179.97 179.44 2cq8 h LEU 63 N -0.68 -0.03 -1.00 3.80 5.85 0.25 1.40 115.31 124.91 2cq8 h LEU 63 Ca 0.01 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 2cq8 h LEU 63 Cb 0.67 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.78 2cq8 h LEU 63 CO -0.17 0.02 0.47 0.58 -0.34 0.00 0.00 178.44 179.00 2cq8 h VAL 64 N 0.20 1.24 -0.34 1.05 2.07 -0.83 0.12 116.25 119.76 2cq8 h VAL 64 Ca 0.22 -0.60 -0.11 0.00 0.82 0.00 0.00 66.70 67.04 2cq8 h VAL 64 Cb 0.29 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 2cq8 h VAL 64 CO -0.30 0.27 -0.21 -0.33 0.02 0.00 0.00 177.57 177.02 2cq8 h GLU 65 N 1.18 0.73 0.66 1.57 4.39 0.44 -1.50 114.58 122.06 2cq8 h GLU 65 Ca 0.30 -0.34 -0.03 0.00 0.34 0.00 0.00 59.36 59.63 2cq8 h GLU 65 Cb 0.01 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 28.66 2cq8 h GLU 65 CO -0.05 0.95 -0.32 0.93 -1.16 0.00 0.00 179.01 179.37 2cq8 h GLU 66 N 0.51 -0.86 -0.08 2.33 5.08 0.23 -1.79 114.58 120.00 2cq8 h GLU 66 Ca 0.07 0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.51 2cq8 h GLU 66 Cb 0.76 0.19 -0.00 0.00 0.50 0.00 0.00 28.75 30.20 2cq8 h GLU 66 CO 0.06 -0.55 0.14 0.28 -1.00 0.00 0.00 179.01 177.94 2cq8 h VAL 67 N -0.95 0.29 -0.70 3.13 2.07 -0.82 0.13 116.25 119.40 2cq8 h VAL 67 Ca -0.09 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.38 2cq8 h VAL 67 Cb 0.70 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 2cq8 h VAL 67 CO 0.15 0.00 0.25 0.11 0.02 0.00 0.00 177.57 178.10 2cq8 h LYS 68 N 0.00 1.06 0.00 1.57 1.57 -0.39 -1.38 116.57 119.01 2cq8 h LYS 68 Ca 0.04 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 2cq8 h LYS 68 Cb 0.33 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 2cq8 h LYS 68 CO -0.00 0.90 -0.03 0.93 -0.57 0.00 0.00 179.45 180.67 2cq8 h GLU 69 N 1.01 0.00 -0.04 3.15 4.39 -0.43 1.99 114.58 124.64 2cq8 h GLU 69 Ca 0.23 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.91 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 0.03 -0.03 -0.07 -1.16 0.00 0.00 179.01 177.77 2cq8 h LEU 70 N 0.00 0.10 -1.71 1.33 3.38 -0.95 -3.12 115.31 114.34 2cq8 h LEU 70 Ca -0.00 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2cq8 h LEU 70 Cb 0.66 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2cq8 h LEU 70 CO 0.00 0.53 -0.03 0.00 0.09 0.00 0.00 178.44 179.04 2cq8 n ASP 72 N 1.06 -7.34 -0.38 0.00 2.03 0.50 -4.40 116.55 108.02 2cq8 n ASP 72 Ca 0.14 0.38 0.00 0.00 0.52 0.00 0.00 54.79 55.83 2cq8 n ASP 72 Cb 0.55 -4.95 0.00 0.00 -0.72 0.00 0.00 41.12 36.00 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 -0.60 0.96 3.70 0.27 0.00 0.55 -4.96 105.19 105.11 2cq8 n GLY 73 Ca 0.09 -0.50 -0.44 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.38 3.57 -3.21 0.99 7.94 -1.14 -4.80 117.00 119.97 2cq8 n LEU 74 Ca 0.00 1.13 -0.26 0.00 -1.11 0.00 0.00 56.01 55.77 2cq8 n LEU 74 Cb 0.37 -1.49 -0.02 0.00 0.53 0.00 0.00 43.42 42.81 2cq8 n LEU 74 CO 0.00 -0.21 2.58 -0.62 -1.11 0.00 0.00 177.39 178.03 2cq8 n GLU 75 N 2.42 2.41 -4.20 1.96 1.02 -1.26 -4.81 120.64 118.19 2cq8 n GLU 75 Ca 0.12 -1.61 -0.32 0.00 -0.02 0.00 0.00 57.16 55.32 2cq8 n GLU 75 Cb 0.33 -2.53 -0.08 0.00 -0.02 0.00 0.00 31.44 29.14 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 0.12 3.62 0.05 -4.62 2.96 -1.26 -5.05 118.68 114.50 2cq8 s LEU 76 Ca 0.46 0.00 0.08 0.00 -0.22 0.00 0.00 54.13 54.44 2cq8 s LEU 76 Cb 0.12 -2.15 -0.03 0.00 0.50 0.00 0.00 46.19 44.63 2cq8 s LEU 76 CO -0.04 0.25 -0.22 -1.83 -1.32 0.00 0.00 176.35 173.20 2cq8 s GLU 77 N -1.79 1.42 0.37 1.98 -1.05 -1.26 -5.01 118.70 113.36 2cq8 s GLU 77 Ca 0.22 -1.00 0.20 0.00 -0.15 0.00 0.00 54.97 54.25 2cq8 s GLU 77 Cb -0.12 -1.57 1.30 0.00 -0.44 0.00 0.00 34.13 33.30 2cq8 s GLU 77 CO 0.13 0.40 1.60 -0.91 0.95 0.00 0.00 175.26 177.43 2cq8 h ASN 78 N 4.76 0.36 -0.29 0.83 -0.26 -1.96 1.23 115.58 120.25 2cq8 h ASN 78 Ca -0.44 0.24 0.05 0.00 -0.56 0.00 0.00 56.30 55.59 2cq8 h ASN 78 Cb 1.16 0.23 -0.05 0.00 -1.06 0.00 0.00 38.32 38.60 2cq8 h ASN 78 CO 0.43 -0.36 -0.01 -0.33 -1.06 0.00 0.00 177.43 176.10 2cq8 h GLU 79 N 0.08 0.07 -1.29 0.81 5.08 -1.95 -0.46 114.58 116.91 2cq8 h GLU 79 Ca 0.82 -0.00 0.44 0.00 -1.00 0.00 0.00 59.36 59.62 2cq8 h GLU 79 Cb 2.15 -0.02 -0.12 0.00 0.50 0.00 0.00 28.75 31.27 2cq8 h GLU 79 CO -0.71 0.04 0.84 -0.40 -1.00 0.00 0.00 179.01 177.78 2cq8 n ASP 80 N -5.18 0.18 0.11 1.42 5.75 0.42 0.14 116.55 119.39 2cq8 n ASP 80 Ca -0.00 1.23 -0.09 0.00 -0.01 0.00 0.00 54.79 55.91 2cq8 n ASP 80 Cb 0.15 -0.60 -0.06 0.00 -1.03 0.00 0.00 41.12 39.58 2cq8 n ASP 80 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 2cq8 h VAL 81 N 0.00 0.42 0.00 2.12 2.07 -1.10 -0.54 116.25 119.22 2cq8 h VAL 81 Ca 0.80 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 67.44 2cq8 h VAL 81 Cb 2.63 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 33.11 2cq8 h VAL 81 CO -0.39 0.11 0.11 1.88 0.02 0.00 0.00 177.57 179.30 2cq8 h TYR 82 N -1.00 0.00 0.08 1.57 -1.99 0.14 -0.75 116.97 115.03 2cq8 h TYR 82 Ca -0.04 0.00 -0.32 0.00 2.00 0.00 0.00 58.73 60.38 2cq8 h TYR 82 Cb 0.45 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.16 2cq8 h TYR 82 CO 0.04 0.00 -1.74 -0.12 -0.00 0.00 0.00 178.16 176.35 2cq8 n MET 83 N -2.30 0.69 -3.55 4.88 1.56 0.23 -4.59 117.12 114.04 2cq8 n MET 83 Ca -0.01 0.38 -0.27 0.00 -0.27 0.00 0.00 57.70 57.52 2cq8 n MET 83 Cb 0.14 -1.72 -0.09 0.00 2.15 0.00 0.00 33.22 33.70 2cq8 n MET 83 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2cq8 n ALA 84 N -3.17 3.78 -0.16 -5.12 0.00 -0.22 -4.89 120.51 110.73 2cq8 n ALA 84 Ca -0.32 -4.61 0.04 0.00 0.00 0.00 0.00 53.44 48.55 2cq8 n ALA 84 Cb 0.91 -0.93 0.32 0.00 0.00 0.00 0.00 19.45 19.75 2cq8 n ALA 84 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2cq8 h SER 85 N 4.54 0.71 -3.78 0.00 4.64 -1.58 -3.36 113.55 114.72 2cq8 h SER 85 Ca 0.18 -0.01 -0.49 0.00 -0.47 0.00 0.00 61.79 61.00 2cq8 h SER 85 Cb 0.70 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 2cq8 h SER 85 CO 0.78 0.49 0.35 0.42 -0.87 0.00 0.00 176.83 178.00 2cq8 s THR 86 N -5.71 4.07 0.10 2.95 -4.23 -1.26 0.19 115.64 111.75 2cq8 s THR 86 Ca -0.10 2.02 -0.28 0.00 -1.18 0.00 0.00 61.69 62.15 2cq8 s THR 86 Cb 0.18 -4.26 -0.12 0.00 1.34 0.00 0.00 72.50 69.64 2cq8 s THR 86 CO 0.77 0.43 1.66 0.15 -0.54 0.00 0.00 174.62 177.08 2cq8 h PHE 87 N 3.95 -0.59 -0.81 3.99 3.57 -1.57 0.21 116.94 125.69 2cq8 h PHE 87 Ca -0.45 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.14 2cq8 h PHE 87 Cb 1.20 0.23 -0.11 0.00 2.79 0.00 0.00 35.95 40.05 2cq8 h PHE 87 CO 0.61 -0.34 -0.54 0.78 -2.23 0.00 0.00 178.31 176.60 2cq8 h GLY 88 N -0.49 -0.72 0.94 2.40 0.00 -1.72 1.01 103.07 104.48 2cq8 h GLY 88 Ca -0.01 0.72 -0.01 0.00 0.00 0.00 0.00 47.33 48.03 2cq8 h GLY 88 CO -0.04 -0.05 -0.05 -1.80 0.00 0.00 0.00 176.54 174.60 2cq8 h ASP 89 N -0.12 -0.12 -0.68 0.19 3.58 -1.76 -2.56 116.42 114.95 2cq8 h ASP 89 Ca 0.17 -0.05 0.15 0.00 0.42 0.00 0.00 57.03 57.71 2cq8 h ASP 89 Cb 0.50 0.03 -0.12 0.00 1.72 0.00 0.00 39.33 41.46 2cq8 h ASP 89 CO -0.83 -0.03 -0.05 0.15 -2.88 0.00 0.00 179.24 175.60 2cq8 h PHE 90 N -0.20 -0.14 -0.33 0.28 3.57 0.14 0.13 116.94 120.38 2cq8 h PHE 90 Ca -0.01 0.05 0.07 0.00 3.53 0.00 0.00 57.97 61.61 2cq8 h PHE 90 Cb 0.16 0.17 -0.06 0.00 2.79 0.00 0.00 35.95 39.01 2cq8 h PHE 90 CO -0.05 -0.23 -0.09 0.82 -2.23 0.00 0.00 178.31 176.53 2cq8 h ILE 91 N 0.07 0.65 -0.71 1.41 1.08 0.12 0.60 117.51 120.73 2cq8 h ILE 91 Ca 0.35 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.96 2cq8 h ILE 91 Cb 0.59 0.65 -0.10 0.00 -3.07 0.00 0.00 36.82 34.89 2cq8 h ILE 91 CO -0.63 0.00 0.23 1.56 -0.69 0.00 0.00 178.15 178.62 2cq8 h GLN 92 N -0.01 0.34 -0.16 2.37 7.50 -0.39 1.38 115.11 126.13 2cq8 h GLN 92 Ca 0.16 -0.02 -0.03 0.00 0.50 0.00 0.00 58.65 59.26 2cq8 h GLN 92 Cb 0.26 -0.08 -0.01 0.00 0.05 0.00 0.00 27.48 27.71 2cq8 h GLN 92 CO -0.35 0.23 -0.03 1.25 -1.50 0.00 0.00 178.83 178.42 2cq8 h LEU 93 N 0.35 0.31 0.86 1.46 6.46 -0.09 -1.55 115.31 123.11 2cq8 h LEU 93 Ca 0.39 -0.36 -0.04 0.00 -0.12 0.00 0.00 57.88 57.75 2cq8 h LEU 93 Cb 0.61 -0.09 0.00 0.00 -0.73 0.00 0.00 40.66 40.46 2cq8 h LEU 93 CO -0.43 0.60 -0.50 0.25 -0.62 0.00 0.00 178.44 177.74 2cq8 h LEU 94 N 0.02 -1.24 -1.14 2.25 5.85 0.17 -0.46 115.31 120.78 2cq8 h LEU 94 Ca 0.04 0.06 0.30 0.00 0.84 0.00 0.00 57.88 59.13 2cq8 h LEU 94 Cb 0.46 0.35 -0.13 0.00 0.37 0.00 0.00 40.66 41.71 2cq8 h LEU 94 CO 0.01 -0.78 0.64 0.58 -0.34 0.00 0.00 178.44 178.55 2cq8 h VAL 95 N -1.26 0.39 -0.39 1.05 2.07 0.18 0.92 116.25 119.21 2cq8 h VAL 95 Ca -0.12 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 2cq8 h VAL 95 Cb 1.00 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 2cq8 h VAL 95 CO 0.14 0.07 0.18 0.03 0.02 0.00 0.00 177.57 178.01 2cq8 h ARG 96 N 0.38 0.56 -0.16 1.57 3.08 -0.49 0.73 114.38 120.05 2cq8 h ARG 96 Ca 0.69 -0.08 -0.13 0.00 0.07 0.00 0.00 59.98 60.53 2cq8 h ARG 96 Cb 1.63 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.57 2cq8 h ARG 96 CO -0.47 0.50 -0.45 0.87 -1.07 0.00 0.00 179.97 179.35 2cq8 h LYS 97 N 0.49 0.39 0.24 0.04 1.57 0.21 -2.05 116.57 117.45 2cq8 h LYS 97 Ca 0.13 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2cq8 h LYS 97 Cb 0.12 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.44 2cq8 h LYS 97 CO -0.02 0.76 -0.11 -0.07 -0.57 0.00 0.00 179.45 179.44 2cq8 h LEU 98 N 0.31 -0.27 -0.47 2.94 3.38 0.97 -2.79 115.31 119.38 2cq8 h LEU 98 Ca 0.02 -0.24 0.10 0.00 0.09 0.00 0.00 57.88 57.85 2cq8 h LEU 98 Cb 0.91 0.07 -0.09 0.00 0.09 0.00 0.00 40.66 41.64 2cq8 h LEU 98 CO 0.08 0.13 -0.14 0.03 0.09 0.00 0.00 178.44 178.64 2cq8 h ARG 99 N -0.73 -0.02 -4.08 1.13 3.08 0.50 -3.31 114.38 110.94 2cq8 h ARG 99 Ca -0.03 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.37 2cq8 h ARG 99 Cb 0.49 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.14 2cq8 h ARG 99 CO 0.05 -0.01 -0.69 0.20 -1.07 0.00 0.00 179.97 178.45 2cq8 s GLY 100 N -3.17 2.06 -0.07 0.04 0.00 -0.77 -5.08 107.32 100.32 2cq8 s GLY 100 Ca -0.14 -2.76 0.03 0.00 0.00 0.00 0.00 44.72 41.85 2cq8 s GLY 100 CO 0.72 1.03 -0.16 -0.35 0.00 0.00 0.00 173.10 174.34 2cq8 s ASP 101 N 0.49 2.15 -0.30 1.64 2.15 -1.06 -4.52 116.67 117.22 2cq8 s ASP 101 Ca 0.13 -0.37 -0.03 0.00 0.43 0.00 0.00 52.55 52.71 2cq8 s ASP 101 Cb -0.22 -0.97 0.19 0.00 -0.30 0.00 0.00 42.92 41.62 2cq8 s ASP 101 CO -0.06 0.07 0.74 1.51 -0.17 0.00 0.00 175.17 177.27 2cq8 s ASP 102 N 0.54 -1.15 -0.47 -0.34 -4.77 -1.26 -5.10 116.67 104.12 2cq8 s ASP 102 Ca -0.15 0.48 -0.46 0.00 -3.30 0.00 0.00 52.55 49.12 2cq8 s ASP 102 Cb -0.16 1.87 -0.19 0.00 -1.09 0.00 0.00 42.92 43.34 2cq8 s ASP 102 CO 0.05 -0.21 1.65 -0.62 0.70 0.00 0.00 175.17 176.74 2cq8 n GLU 103 N 5.40 0.18 -0.00 2.11 1.02 -1.26 -4.83 120.64 123.26 2cq8 n GLU 103 Ca 0.01 0.07 -0.02 0.00 -0.02 0.00 0.00 57.16 57.19 2cq8 n GLU 103 Cb 0.53 -1.60 -0.01 0.00 -0.02 0.00 0.00 31.44 30.34 2cq8 n GLU 103 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2cq8 n GLU 104 N 4.41 0.14 -3.10 3.49 1.02 -1.26 -5.01 120.64 120.32 2cq8 n GLU 104 Ca 0.32 0.05 -0.39 0.00 -0.02 0.00 0.00 57.16 57.12 2cq8 n GLU 104 Cb -0.03 -0.64 -0.05 0.00 -0.02 0.00 0.00 31.44 30.70 2cq8 n GLU 104 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2cq8 s SER 105 N -5.54 7.02 0.00 1.62 1.04 -1.26 -4.92 113.70 111.66 2cq8 s SER 105 Ca -0.07 1.22 0.00 0.00 0.48 0.00 0.00 55.95 57.58 2cq8 s SER 105 Cb 0.01 -2.40 0.00 0.00 0.10 0.00 0.00 66.02 63.73 2cq8 s SER 105 CO 0.11 0.01 0.00 0.61 0.98 0.00 0.00 173.24 174.95 2cq8 n GLY 106 N 2.68 -0.23 3.81 7.32 0.00 -1.26 -5.05 105.19 112.46 2cq8 n GLY 106 Ca -0.04 -2.27 -0.33 0.00 0.00 0.00 0.00 46.02 43.38 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 -0.49 3.45 0.67 1.61 0.04 -1.26 -5.00 135.00 134.02 2cq8 s PRO 107 Ca 0.00 1.20 -0.17 0.00 0.04 0.00 0.00 61.00 62.07 2cq8 s PRO 107 Cb 0.00 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.49 2cq8 s PRO 107 CO 0.00 -0.70 1.27 -1.12 0.04 0.00 0.00 177.00 176.48 2cq8 s SER 108 N -2.71 4.47 0.00 6.66 0.01 -1.26 -3.42 113.70 117.45 2cq8 s SER 108 Ca 0.64 2.54 0.00 0.00 1.31 0.00 0.00 55.95 60.44 2cq8 s SER 108 Cb -0.15 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.47 2cq8 s SER 108 CO 0.34 -2.09 0.00 -0.24 0.41 0.00 0.00 173.24 171.66 2cq8 n SER 109 N -2.15 0.00 0.00 2.44 2.88 -1.26 -5.23 113.62 110.29 2cq8 n SER 109 Ca 0.15 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 2cq8 n SER 109 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 2cq8 n SER 109 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42