#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 -0.87 -0.34 1.61 0.15 -1.26 -5.13 113.70 107.86 2cq8 s SER 2 Ca 0.00 1.39 -0.19 0.00 0.70 0.00 0.00 55.95 57.85 2cq8 s SER 2 Cb 0.00 1.50 -0.00 0.00 -1.71 0.00 0.00 66.02 65.81 2cq8 s SER 2 CO 0.00 -0.23 0.55 -0.44 1.20 0.00 0.00 173.24 174.32 2cq8 s SER 3 N 1.98 6.36 0.37 5.45 0.01 -1.26 -5.04 113.70 121.57 2cq8 s SER 3 Ca -0.08 0.07 0.04 0.00 1.31 0.00 0.00 55.95 57.28 2cq8 s SER 3 Cb -0.08 -2.28 -0.03 0.00 0.21 0.00 0.00 66.02 63.83 2cq8 s SER 3 CO -0.18 -0.49 0.12 -0.83 0.41 0.00 0.00 173.24 172.27 2cq8 s GLY 4 N 1.75 2.39 -0.28 3.44 0.00 -1.26 -4.96 107.32 108.39 2cq8 s GLY 4 Ca 0.20 -1.50 -0.17 0.00 0.00 0.00 0.00 44.72 43.25 2cq8 s GLY 4 CO 0.13 -1.78 0.35 1.44 0.00 0.00 0.00 173.10 173.24 2cq8 n SER 5 N -1.11 -6.64 -4.16 1.64 7.64 -1.26 -4.94 113.62 104.79 2cq8 n SER 5 Ca -0.04 0.38 -0.35 0.00 1.01 0.00 0.00 58.87 59.86 2cq8 n SER 5 Cb 0.65 -2.82 -0.13 0.00 -1.01 0.00 0.00 64.21 60.90 2cq8 n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2cq8 s SER 6 N -1.54 5.02 0.00 6.43 1.04 -1.26 -4.62 113.70 118.76 2cq8 s SER 6 Ca 0.18 -1.48 0.00 0.00 0.48 0.00 0.00 55.95 55.14 2cq8 s SER 6 Cb -0.03 -1.75 0.00 0.00 0.10 0.00 0.00 66.02 64.34 2cq8 s SER 6 CO 0.57 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 175.06 2cq8 n GLY 7 N 4.62 4.66 3.56 7.32 0.00 -1.26 -5.07 105.19 119.01 2cq8 n GLY 7 Ca -0.10 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.64 2cq8 n GLY 7 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2cq8 s PHE 8 N 0.27 2.46 -0.05 1.61 0.40 -1.26 -4.52 117.98 116.88 2cq8 s PHE 8 Ca 0.00 -0.64 -0.00 0.00 -0.60 0.00 0.00 56.93 55.69 2cq8 s PHE 8 Cb 0.00 -4.67 0.00 0.00 0.51 0.00 0.00 43.02 38.86 2cq8 s PHE 8 CO 0.00 -1.97 0.00 1.19 0.70 0.00 0.00 175.22 175.14 2cq8 n PHE 9 N 9.07 -0.72 -3.60 0.36 3.01 -1.26 -5.02 117.46 119.31 2cq8 n PHE 9 Ca 0.26 0.32 -0.05 0.00 1.01 0.00 0.00 57.45 58.99 2cq8 n PHE 9 Cb 0.50 -1.54 -0.03 0.00 -0.01 0.00 0.00 39.48 38.40 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 -1.09 0.33 0.00 -1.08 -2.85 -1.26 -5.16 119.74 108.63 2cq8 s LYS 10 Ca -0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 55.97 54.94 2cq8 s LYS 10 Cb 0.00 0.15 0.00 0.00 -2.06 0.00 0.00 37.83 35.92 2cq8 s LYS 10 CO 0.14 -0.13 0.00 0.41 0.10 0.00 0.00 175.35 175.88 2cq8 n GLY 11 N 0.27 -0.38 2.72 0.59 0.00 -1.26 -4.62 105.19 102.51 2cq8 n GLY 11 Ca -0.03 -0.27 -0.06 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.14 -3.12 -0.54 4.61 0.00 -1.26 -4.96 120.51 115.11 2cq8 n ALA 12 Ca 0.00 0.96 -0.26 0.00 0.00 0.00 0.00 53.44 54.13 2cq8 n ALA 12 Cb 0.00 -2.94 0.19 0.00 0.00 0.00 0.00 19.45 16.69 2cq8 n ALA 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cq8 n ALA 13 N -0.10 -2.95 -3.71 0.00 0.00 -1.26 -5.02 120.51 107.46 2cq8 n ALA 13 Ca 0.09 -1.30 -0.19 0.00 0.00 0.00 0.00 53.44 52.04 2cq8 n ALA 13 Cb 0.33 -1.30 -0.17 0.00 0.00 0.00 0.00 19.45 18.30 2cq8 n ALA 13 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2cq8 s SER 14 N -2.10 0.89 -0.25 0.00 1.04 -1.26 -5.13 113.70 106.89 2cq8 s SER 14 Ca 0.51 0.01 -0.36 0.00 0.48 0.00 0.00 55.95 56.59 2cq8 s SER 14 Cb -0.10 -0.22 0.15 0.00 0.10 0.00 0.00 66.02 65.96 2cq8 s SER 14 CO 0.52 -0.18 1.31 -0.94 0.98 0.00 0.00 173.24 174.93 2cq8 s SER 15 N 1.66 -0.07 0.01 7.02 1.04 -1.26 -5.17 113.70 116.93 2cq8 s SER 15 Ca -0.01 0.01 0.03 0.00 0.48 0.00 0.00 55.95 56.46 2cq8 s SER 15 Cb -0.13 0.07 -0.01 0.00 0.10 0.00 0.00 66.02 66.05 2cq8 s SER 15 CO -0.03 -0.11 -0.10 0.54 0.98 0.00 0.00 173.24 174.52 2cq8 s VAL 16 N -2.07 0.75 0.27 5.02 0.11 -1.26 -5.13 120.40 118.09 2cq8 s VAL 16 Ca 0.10 -0.60 -0.30 0.00 -2.93 0.00 0.00 61.98 58.26 2cq8 s VAL 16 Cb -0.01 -0.67 -0.09 0.00 -1.53 0.00 0.00 36.38 34.08 2cq8 s VAL 16 CO -0.04 0.07 1.07 -0.76 -3.33 0.00 0.00 175.10 172.12 2cq8 s LEU 17 N -0.60 4.56 -0.21 2.54 1.43 -1.26 -5.02 118.68 120.13 2cq8 s LEU 17 Ca 0.01 2.20 -0.12 0.00 -1.03 0.00 0.00 54.13 55.19 2cq8 s LEU 17 Cb -0.05 -3.62 -0.05 0.00 0.03 0.00 0.00 46.19 42.50 2cq8 s LEU 17 CO 0.00 -0.10 0.23 -0.70 0.23 0.00 0.00 176.35 176.02 2cq8 s GLU 18 N -1.33 4.15 0.64 1.70 2.12 -1.26 -4.96 118.70 119.76 2cq8 s GLU 18 Ca 0.44 -0.09 -0.11 0.00 0.36 0.00 0.00 54.97 55.57 2cq8 s GLU 18 Cb -0.31 -3.50 0.16 0.00 0.26 0.00 0.00 34.13 30.75 2cq8 s GLU 18 CO 0.39 0.11 0.46 1.28 -0.54 0.00 0.00 175.26 176.96 2cq8 n LEU 19 N 4.09 0.00 -4.00 2.70 7.99 -1.26 -5.07 117.00 121.45 2cq8 n LEU 19 Ca -0.13 -0.48 -0.10 0.00 -0.01 0.00 0.00 56.01 55.29 2cq8 n LEU 19 Cb 0.52 -0.47 -0.08 0.00 -0.11 0.00 0.00 43.42 43.28 2cq8 n LEU 19 CO 0.37 -1.86 -0.08 0.42 -1.51 0.00 0.00 177.39 174.73 2cq8 s THR 20 N -1.72 0.08 0.46 -5.08 -4.23 -1.26 -4.88 115.64 99.00 2cq8 s THR 20 Ca 0.33 -1.49 0.31 0.00 -1.18 0.00 0.00 61.69 59.66 2cq8 s THR 20 Cb -0.04 -1.87 0.51 0.00 1.34 0.00 0.00 72.50 72.44 2cq8 s THR 20 CO 0.26 -0.34 1.67 -0.08 -0.54 0.00 0.00 174.62 175.59 2cq8 h GLU 21 N 2.62 0.12 0.00 3.99 4.81 -1.99 1.59 114.58 125.71 2cq8 h GLU 21 Ca -0.32 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 2cq8 h GLU 21 Cb 1.22 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.57 2cq8 h GLU 21 CO 0.51 0.08 -0.30 0.00 -0.73 0.00 0.00 179.01 178.57 2cq8 h ALA 22 N 1.50 0.00 -0.76 2.92 0.00 -2.01 -3.35 119.26 117.57 2cq8 h ALA 22 Ca 0.76 -0.33 0.16 0.00 0.00 0.00 0.00 54.91 55.49 2cq8 h ALA 22 Cb 2.48 0.30 -0.14 0.00 0.00 0.00 0.00 17.79 20.43 2cq8 h ALA 22 CO -0.28 0.30 -0.15 0.93 0.00 0.00 0.00 179.25 180.05 2cq8 h GLU 23 N -0.80 0.02 -0.88 0.00 5.08 -1.69 0.32 114.58 116.62 2cq8 h GLU 23 Ca 0.00 -0.00 0.17 0.00 -1.00 0.00 0.00 59.36 58.53 2cq8 h GLU 23 Cb 0.30 -0.00 -0.17 0.00 0.50 0.00 0.00 28.75 29.38 2cq8 h GLU 23 CO 0.00 0.01 -0.23 -0.07 -1.00 0.00 0.00 179.01 177.72 2cq8 h LEU 24 N 0.02 -0.86 -0.13 1.33 3.38 0.21 1.19 115.31 120.45 2cq8 h LEU 24 Ca 0.38 0.27 0.03 0.00 0.09 0.00 0.00 57.88 58.64 2cq8 h LEU 24 Cb 0.60 0.56 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 2cq8 h LEU 24 CO -0.76 -0.29 -0.06 0.58 0.09 0.00 0.00 178.44 178.00 2cq8 h VAL 25 N -0.00 0.81 -0.53 1.22 2.07 -0.50 0.05 116.25 119.36 2cq8 h VAL 25 Ca 0.42 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.97 2cq8 h VAL 25 Cb 0.64 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 2cq8 h VAL 25 CO -0.91 0.00 0.31 0.74 0.02 0.00 0.00 177.57 177.73 2cq8 h THR 26 N -0.04 1.02 -0.53 2.57 2.02 0.87 0.55 112.91 119.37 2cq8 h THR 26 Ca 0.07 -0.21 0.07 0.00 0.77 0.00 0.00 66.41 67.12 2cq8 h THR 26 Cb 0.15 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 66.90 2cq8 h THR 26 CO -0.16 0.11 0.35 0.00 0.37 0.00 0.00 175.52 176.20 2cq8 h ALA 27 N 1.25 1.95 -0.10 6.16 0.00 0.17 0.05 119.26 128.75 2cq8 h ALA 27 Ca 0.22 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.91 2cq8 h ALA 27 Cb 0.06 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2cq8 h ALA 27 CO -0.12 -0.06 -0.79 0.93 0.00 0.00 0.00 179.25 179.22 2cq8 h GLU 28 N 0.42 0.60 -0.82 0.00 4.39 0.69 -1.86 114.58 118.00 2cq8 h GLU 28 Ca 0.24 -0.51 0.03 0.00 0.34 0.00 0.00 59.36 59.45 2cq8 h GLU 28 Cb 0.39 0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.11 2cq8 h GLU 28 CO -0.06 1.13 0.54 0.00 -1.16 0.00 0.00 179.01 179.46 2cq8 h ALA 29 N 0.72 1.47 -0.11 3.43 0.00 0.95 -0.59 119.26 125.13 2cq8 h ALA 29 Ca -0.05 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 2cq8 h ALA 29 Cb 1.40 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2cq8 h ALA 29 CO 0.15 0.46 -0.30 0.28 0.00 0.00 0.00 179.25 179.84 2cq8 h VAL 30 N 1.04 1.39 -0.97 0.00 2.07 -1.22 -3.12 116.25 115.44 2cq8 h VAL 30 Ca 0.32 -1.61 0.17 0.00 0.82 0.00 0.00 66.70 66.40 2cq8 h VAL 30 Cb -0.01 2.13 -0.10 0.00 -1.52 0.00 0.00 31.29 31.79 2cq8 h VAL 30 CO -0.09 0.47 0.57 -0.09 0.02 0.00 0.00 177.57 178.46 2cq8 h ARG 31 N -0.03 0.75 -0.51 1.57 2.43 -0.61 0.39 114.38 118.37 2cq8 h ARG 31 Ca -0.01 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2cq8 h ARG 31 Cb 0.91 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.27 2cq8 h ARG 31 CO 0.06 0.50 0.32 1.03 -1.51 0.00 0.00 179.97 180.37 2cq8 h SER 32 N 0.77 0.59 -0.47 -3.80 0.87 -1.08 -1.26 113.55 109.17 2cq8 h SER 32 Ca 0.54 -0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 61.06 2cq8 h SER 32 Cb 0.77 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.56 2cq8 h SER 32 CO -0.36 0.44 0.22 0.58 -0.53 0.00 0.00 176.83 177.19 2cq8 h VAL 33 N 0.69 1.19 0.81 2.23 2.07 -0.18 0.36 116.25 123.42 2cq8 h VAL 33 Ca 0.18 -0.54 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 2cq8 h VAL 33 Cb -0.05 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 2cq8 h VAL 33 CO -0.04 0.21 -0.43 -0.50 0.02 0.00 0.00 177.57 176.83 2cq8 h TRP 34 N 0.61 -1.12 -0.56 1.57 4.06 -0.77 0.32 115.95 120.06 2cq8 h TRP 34 Ca 0.16 -0.02 0.11 0.00 2.06 0.00 0.00 58.89 61.20 2cq8 h TRP 34 Cb 0.13 0.38 -0.11 0.00 -1.00 0.00 0.00 29.16 28.56 2cq8 h TRP 34 CO -0.01 -0.67 -0.14 1.96 -3.56 0.00 0.00 178.44 176.02 2cq8 h GLN 35 N -1.14 -0.00 -0.98 0.49 1.08 -1.17 1.02 115.11 114.41 2cq8 h GLN 35 Ca -0.11 0.00 0.08 0.00 -1.45 0.00 0.00 58.65 57.17 2cq8 h GLN 35 Cb 0.89 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 28.25 2cq8 h GLN 35 CO 0.16 -0.00 0.63 0.00 -0.95 0.00 0.00 178.83 178.66 2cq8 h ARG 36 N -0.01 1.05 0.00 1.46 -0.00 -0.06 -3.19 114.38 113.64 2cq8 h ARG 36 Ca 0.27 -0.06 0.00 0.00 -0.50 0.00 0.00 59.98 59.68 2cq8 h ARG 36 Cb 0.41 -0.24 0.00 0.00 0.00 0.00 0.00 29.97 30.14 2cq8 h ARG 36 CO -0.58 0.70 0.00 -0.89 0.00 0.00 0.00 179.97 179.20 2cq8 n ILE 37 N -4.53 0.00 -1.84 2.04 5.41 0.11 -4.64 119.36 115.91 2cq8 n ILE 37 Ca 0.16 0.80 -0.43 0.00 1.00 0.00 0.00 62.75 64.28 2cq8 n ILE 37 Cb 0.24 -1.73 -0.03 0.00 -0.71 0.00 0.00 39.64 37.41 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 -3.69 3.61 0.00 1.39 1.43 0.32 -4.89 118.68 116.84 2cq8 s LEU 38 Ca 0.00 1.68 0.00 0.00 -1.03 0.00 0.00 54.13 54.78 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 -1.69 0.23 -0.81 0.23 0.00 0.00 176.35 174.31 2cq8 n PRO 39 N 8.37 0.00 -0.32 1.29 -0.04 -1.26 -3.88 135.00 139.16 2cq8 n PRO 39 Ca 0.25 0.41 0.23 0.00 -0.04 0.00 0.00 63.50 64.34 2cq8 n PRO 39 Cb 0.45 -1.03 0.43 0.00 -0.04 0.00 0.00 33.50 33.31 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 -1.73 -0.07 -1.52 0.54 4.76 -1.26 -4.12 118.16 114.76 2cq8 n LYS 40 Ca 0.00 1.40 -0.47 0.00 -2.87 0.00 0.00 58.31 56.37 2cq8 n LYS 40 Cb 0.00 -2.36 -0.05 0.00 -1.84 0.00 0.00 35.03 30.78 2cq8 n LYS 40 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2cq8 n VAL 41 N -5.32 0.26 0.11 -0.18 0.31 -1.25 -4.80 118.33 107.46 2cq8 n VAL 41 Ca 0.30 -0.37 -0.17 0.00 -0.01 0.00 0.00 64.34 64.09 2cq8 n VAL 41 Cb 1.00 -2.12 -0.13 0.00 -0.91 0.00 0.00 33.84 31.68 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 13.80 0.51 -8.09 7.52 3.38 -1.87 -3.47 115.31 127.09 2cq8 h LEU 42 Ca -0.34 -0.53 -0.24 0.00 0.09 0.00 0.00 57.88 56.87 2cq8 h LEU 42 Cb 1.28 -0.16 -0.21 0.00 0.09 0.00 0.00 40.66 41.65 2cq8 h LEU 42 CO 0.99 1.40 -0.72 -1.83 0.09 0.00 0.00 178.44 178.37 2cq8 s GLU 43 N -2.71 0.44 -0.15 1.13 -1.05 -1.26 -5.08 118.70 110.02 2cq8 s GLU 43 Ca -0.05 -0.69 0.01 0.00 -0.15 0.00 0.00 54.97 54.09 2cq8 s GLU 43 Cb 0.07 -0.14 0.02 0.00 -0.44 0.00 0.00 34.13 33.63 2cq8 s GLU 43 CO 0.89 0.01 -0.18 0.08 0.95 0.00 0.00 175.26 177.01 2cq8 s VAL 44 N -1.39 1.87 0.31 1.83 1.01 -1.26 -5.02 120.40 117.75 2cq8 s VAL 44 Ca -0.12 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.03 2cq8 s VAL 44 Cb -0.10 -1.69 0.00 0.00 0.00 0.00 0.00 36.38 34.59 2cq8 s VAL 44 CO -0.00 0.51 0.01 -1.84 0.00 0.00 0.00 175.10 173.78 2cq8 n GLU 45 N 4.46 1.24 0.15 2.72 0.28 -1.26 -5.00 120.64 123.22 2cq8 n GLU 45 Ca -0.19 -2.25 -0.00 0.00 -0.16 0.00 0.00 57.16 54.55 2cq8 n GLU 45 Cb 0.51 0.58 0.23 0.00 1.43 0.00 0.00 31.44 34.19 2cq8 n GLU 45 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 2cq8 h ASP 46 N 0.73 0.04 0.11 -1.84 5.19 -1.98 -2.90 116.42 115.76 2cq8 h ASP 46 Ca -0.26 -0.02 -0.22 0.00 -0.62 0.00 0.00 57.03 55.91 2cq8 h ASP 46 Cb 0.78 -0.01 0.01 0.00 0.18 0.00 0.00 39.33 40.28 2cq8 h ASP 46 CO 0.42 0.55 -0.87 -1.28 -3.12 0.00 0.00 179.24 174.95 2cq8 h SER 47 N 0.03 0.72 -1.27 6.45 0.87 -1.95 -1.35 113.55 117.04 2cq8 h SER 47 Ca -0.00 -0.52 -0.75 0.00 -1.23 0.00 0.00 61.79 59.28 2cq8 h SER 47 Cb 0.93 -0.22 0.05 0.00 -0.44 0.00 0.00 62.40 62.72 2cq8 h SER 47 CO 0.07 1.31 0.30 0.41 -0.53 0.00 0.00 176.83 178.38 2cq8 n THR 48 N -3.85 0.02 -3.57 2.23 -1.04 -1.09 -4.73 114.28 102.25 2cq8 n THR 48 Ca -0.07 -0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.55 2cq8 n THR 48 Cb 0.79 -0.40 -0.11 0.00 -1.82 0.00 0.00 70.33 68.79 2cq8 n THR 48 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2cq8 s ASP 49 N 0.60 6.00 0.63 8.00 -1.08 -1.26 -1.80 116.67 127.77 2cq8 s ASP 49 Ca 0.90 -0.17 0.24 0.00 -0.52 0.00 0.00 52.55 53.00 2cq8 s ASP 49 Cb -1.16 -2.12 1.16 0.00 -1.46 0.00 0.00 42.92 39.34 2cq8 s ASP 49 CO 0.56 -0.12 1.63 0.15 0.52 0.00 0.00 175.17 177.91 2cq8 h PHE 50 N 8.41 0.00 0.00 -5.34 3.57 -1.62 0.38 116.94 122.34 2cq8 h PHE 50 Ca -0.34 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.16 2cq8 h PHE 50 Cb 1.18 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.92 2cq8 h PHE 50 CO 0.72 0.00 -0.07 1.19 -2.23 0.00 0.00 178.31 177.92 2cq8 n PHE 51 N -3.16 0.11 -0.29 0.41 3.72 -1.26 -3.08 117.46 113.91 2cq8 n PHE 51 Ca 0.07 0.05 0.23 0.00 -0.05 0.00 0.00 57.45 57.75 2cq8 n PHE 51 Cb 0.81 -0.29 0.44 0.00 -0.94 0.00 0.00 39.48 39.49 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 -2.58 -0.06 -0.18 -1.08 4.01 -0.98 0.18 118.16 117.46 2cq8 n LYS 52 Ca -0.01 1.25 -0.04 0.00 -0.51 0.00 0.00 58.31 59.00 2cq8 n LYS 52 Cb 0.04 -2.16 0.03 0.00 -0.51 0.00 0.00 35.03 32.42 2cq8 n LYS 52 CO 0.00 0.00 0.00 0.77 -1.11 0.00 0.00 177.40 177.06 2cq8 h SER 53 N 0.00 -0.88 0.00 4.39 0.02 -1.13 -3.45 113.55 112.51 2cq8 h SER 53 Ca 0.68 0.20 0.00 0.00 -0.84 0.00 0.00 61.79 61.83 2cq8 h SER 53 Cb 1.71 0.47 0.00 0.00 0.14 0.00 0.00 62.40 64.72 2cq8 h SER 53 CO -0.73 -0.27 0.00 0.61 -1.14 0.00 0.00 176.83 175.31 2cq8 n GLY 54 N -1.43 0.29 3.82 -3.77 0.00 0.48 -4.90 105.19 99.68 2cq8 n GLY 54 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.45 3.77 0.50 4.61 0.00 -1.15 -5.03 121.76 124.02 2cq8 s ALA 55 Ca 0.00 -0.55 0.01 0.00 0.00 0.00 0.00 51.96 51.41 2cq8 s ALA 55 Cb 0.00 -2.14 0.02 0.00 0.00 0.00 0.00 23.12 20.99 2cq8 s ALA 55 CO 0.00 0.42 0.73 0.00 0.00 0.00 0.00 175.76 176.91 2cq8 s ALA 56 N -0.52 3.84 0.00 0.00 0.00 -1.26 -4.78 121.76 119.04 2cq8 s ALA 56 Ca 0.15 -1.21 0.18 0.00 0.00 0.00 0.00 51.96 51.08 2cq8 s ALA 56 Cb -0.13 -2.10 0.96 0.00 0.00 0.00 0.00 23.12 21.85 2cq8 s ALA 56 CO 0.04 -0.58 1.48 0.66 0.00 0.00 0.00 175.76 177.36 2cq8 h SER 57 N 0.22 0.00 0.19 0.00 4.64 -2.01 -0.95 113.55 115.65 2cq8 h SER 57 Ca -0.44 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.87 2cq8 h SER 57 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2cq8 h SER 57 CO 0.54 0.00 -0.09 0.58 -0.87 0.00 0.00 176.83 176.99 2cq8 h VAL 58 N 0.00 0.21 -1.19 0.95 2.07 -2.01 -3.23 116.25 113.05 2cq8 h VAL 58 Ca 0.00 -0.92 0.34 0.00 0.82 0.00 0.00 66.70 66.94 2cq8 h VAL 58 Cb 0.40 0.38 -0.07 0.00 -1.52 0.00 0.00 31.29 30.47 2cq8 h VAL 58 CO 0.00 0.06 0.82 0.44 0.02 0.00 0.00 177.57 178.91 2cq8 h ASP 59 N -1.04 0.17 -0.72 0.57 3.32 -1.55 0.66 116.42 117.83 2cq8 h ASP 59 Ca -0.03 0.04 0.15 0.00 0.02 0.00 0.00 57.03 57.21 2cq8 h ASP 59 Cb 0.30 0.02 -0.10 0.00 0.22 0.00 0.00 39.33 39.77 2cq8 h ASP 59 CO 0.04 0.01 0.21 0.58 -1.72 0.00 0.00 179.24 178.37 2cq8 h VAL 60 N 0.14 0.58 -0.09 -1.35 2.07 -1.50 1.00 116.25 117.10 2cq8 h VAL 60 Ca 0.62 -0.11 -0.20 0.00 0.82 0.00 0.00 66.70 67.82 2cq8 h VAL 60 Cb 2.12 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.12 2cq8 h VAL 60 CO -0.14 0.06 -0.78 0.58 0.02 0.00 0.00 177.57 177.30 2cq8 h VAL 61 N 0.33 1.35 0.68 2.57 2.07 0.21 -2.61 116.25 120.84 2cq8 h VAL 61 Ca 0.40 -2.14 -0.03 0.00 0.82 0.00 0.00 66.70 65.75 2cq8 h VAL 61 Cb 0.65 2.12 0.01 0.00 -1.52 0.00 0.00 31.29 32.55 2cq8 h VAL 61 CO -0.46 0.65 -0.33 -0.09 0.02 0.00 0.00 177.57 177.37 2cq8 h ARG 62 N 0.35 -0.88 -0.05 1.57 2.43 0.03 1.00 114.38 118.83 2cq8 h ARG 62 Ca -0.05 0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.22 2cq8 h ARG 62 Cb 1.38 0.20 -0.06 0.00 -0.42 0.00 0.00 29.97 31.08 2cq8 h ARG 62 CO 0.14 -0.59 -0.35 1.25 -1.51 0.00 0.00 179.97 178.92 2cq8 h LEU 63 N -0.92 -1.07 -0.45 3.80 5.85 0.80 1.49 115.31 124.81 2cq8 h LEU 63 Ca -0.09 0.14 0.06 0.00 0.84 0.00 0.00 57.88 58.82 2cq8 h LEU 63 Cb 0.70 0.43 -0.05 0.00 0.37 0.00 0.00 40.66 42.12 2cq8 h LEU 63 CO 0.15 -0.40 0.17 0.58 -0.34 0.00 0.00 178.44 178.60 2cq8 h VAL 64 N -0.48 0.87 -0.98 1.05 2.07 -1.37 0.31 116.25 117.72 2cq8 h VAL 64 Ca 0.07 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.48 2cq8 h VAL 64 Cb 0.58 0.49 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 2cq8 h VAL 64 CO -0.31 0.06 0.63 -0.33 0.02 0.00 0.00 177.57 177.64 2cq8 h GLU 65 N 0.34 1.30 0.46 1.57 4.39 0.23 0.61 114.58 123.48 2cq8 h GLU 65 Ca 0.21 -0.09 -0.02 0.00 0.34 0.00 0.00 59.36 59.80 2cq8 h GLU 65 Cb 0.20 -0.29 0.00 0.00 -0.10 0.00 0.00 28.75 28.57 2cq8 h GLU 65 CO -0.21 0.88 -0.22 0.93 -1.16 0.00 0.00 179.01 179.23 2cq8 h GLU 66 N 1.34 -0.60 -0.00 2.33 5.08 0.34 -2.28 114.58 120.79 2cq8 h GLU 66 Ca 0.36 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.76 2cq8 h GLU 66 Cb -0.12 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 2cq8 h GLU 66 CO -0.07 -0.30 0.07 0.28 -1.00 0.00 0.00 179.01 177.98 2cq8 h VAL 67 N -0.85 0.01 -0.40 3.13 2.07 -0.26 0.21 116.25 120.17 2cq8 h VAL 67 Ca -0.06 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.41 2cq8 h VAL 67 Cb 0.57 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 2cq8 h VAL 67 CO 0.10 0.00 0.05 0.11 0.02 0.00 0.00 177.57 177.86 2cq8 h LYS 68 N 0.00 0.67 0.00 1.57 1.57 -0.29 -2.11 116.57 117.98 2cq8 h LYS 68 Ca 0.00 -0.19 -0.03 0.00 -1.87 0.00 0.00 60.65 58.57 2cq8 h LYS 68 Cb 0.14 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 2cq8 h LYS 68 CO -0.00 0.72 -0.13 0.93 -0.57 0.00 0.00 179.45 180.40 2cq8 h GLU 69 N 0.51 0.00 -0.00 3.15 4.39 -0.76 1.96 114.58 123.82 2cq8 h GLU 69 Ca 0.12 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.82 2cq8 h GLU 69 Cb 0.39 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.04 2cq8 h GLU 69 CO 0.01 0.13 -0.00 -0.07 -1.16 0.00 0.00 179.01 177.92 2cq8 h LEU 70 N 0.00 0.00 -1.42 1.33 3.38 -1.13 -2.95 115.31 114.52 2cq8 h LEU 70 Ca -0.00 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.66 2cq8 h LEU 70 Cb 0.56 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2cq8 h LEU 70 CO 0.02 0.31 -0.06 0.00 0.09 0.00 0.00 178.44 178.80 2cq8 n ASP 72 N 0.69 -7.11 -0.21 0.00 2.03 0.50 -4.41 116.55 108.04 2cq8 n ASP 72 Ca 0.15 -0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.44 2cq8 n ASP 72 Cb 0.49 -4.79 0.00 0.00 -0.72 0.00 0.00 41.12 36.09 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 0.92 3.68 0.27 0.00 0.55 -4.95 105.19 104.09 2cq8 n GLY 73 Ca 0.01 -0.25 -0.45 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.21 3.33 -3.09 0.99 7.94 -1.12 -4.78 117.00 120.05 2cq8 n LEU 74 Ca 0.00 1.10 -0.20 0.00 -1.11 0.00 0.00 56.01 55.80 2cq8 n LEU 74 Cb 0.19 -1.46 -0.02 0.00 0.53 0.00 0.00 43.42 42.66 2cq8 n LEU 74 CO 0.00 -0.23 2.23 -1.84 -1.11 0.00 0.00 177.39 176.44 2cq8 n GLU 75 N 3.10 1.96 -4.04 1.96 0.28 -1.26 -4.81 120.64 117.82 2cq8 n GLU 75 Ca 0.15 -1.36 -0.23 0.00 -0.16 0.00 0.00 57.16 55.56 2cq8 n GLU 75 Cb 0.31 -2.38 -0.04 0.00 1.43 0.00 0.00 31.44 30.76 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 0.09 4.04 -0.00 -1.84 2.96 -1.26 -4.95 118.68 117.71 2cq8 s LEU 76 Ca 0.38 -0.08 -0.07 0.00 -0.22 0.00 0.00 54.13 54.14 2cq8 s LEU 76 Cb 0.10 -2.59 0.00 0.00 0.50 0.00 0.00 46.19 44.21 2cq8 s LEU 76 CO -0.03 -0.02 0.14 -1.83 -1.32 0.00 0.00 176.35 173.29 2cq8 s GLU 77 N -3.71 0.46 0.53 1.98 -1.05 -1.26 -5.01 118.70 110.64 2cq8 s GLU 77 Ca 0.33 -0.34 0.40 0.00 -0.15 0.00 0.00 54.97 55.21 2cq8 s GLU 77 Cb -0.09 0.19 1.59 0.00 -0.44 0.00 0.00 34.13 35.38 2cq8 s GLU 77 CO 0.26 -0.11 1.71 -0.91 0.95 0.00 0.00 175.26 177.16 2cq8 h ASN 78 N 4.40 0.05 -0.59 0.83 2.35 -1.98 1.36 115.58 122.00 2cq8 h ASN 78 Ca -0.30 0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.45 2cq8 h ASN 78 Cb 1.19 0.01 -0.03 0.00 0.05 0.00 0.00 38.32 39.55 2cq8 h ASN 78 CO 0.40 -0.01 0.33 -0.08 -1.65 0.00 0.00 177.43 176.43 2cq8 h GLU 79 N 0.03 0.81 -0.70 0.81 4.81 -1.97 -2.04 114.58 116.33 2cq8 h GLU 79 Ca 0.72 -0.09 0.15 0.00 -0.13 0.00 0.00 59.36 60.02 2cq8 h GLU 79 Cb 2.79 -0.16 -0.12 0.00 0.63 0.00 0.00 28.75 31.90 2cq8 h GLU 79 CO -0.06 0.61 0.05 0.38 -0.73 0.00 0.00 179.01 179.26 2cq8 h ASP 80 N 0.79 -0.22 0.17 1.04 2.03 0.14 0.53 116.42 120.90 2cq8 h ASP 80 Ca 0.21 0.17 -0.01 0.00 -0.73 0.00 0.00 57.03 56.67 2cq8 h ASP 80 Cb 0.03 0.28 0.00 0.00 -0.83 0.00 0.00 39.33 38.81 2cq8 h ASP 80 CO -0.04 -0.12 -0.08 0.58 -1.03 0.00 0.00 179.24 178.56 2cq8 h VAL 81 N 0.15 0.87 -0.36 4.15 2.07 -1.41 0.64 116.25 122.36 2cq8 h VAL 81 Ca 0.38 -0.16 0.10 0.00 0.82 0.00 0.00 66.70 67.85 2cq8 h VAL 81 Cb 0.65 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 2cq8 h VAL 81 CO -0.57 0.04 0.30 1.88 0.02 0.00 0.00 177.57 179.24 2cq8 h TYR 82 N -0.30 0.00 0.18 1.57 0.05 -0.25 -1.06 116.97 117.16 2cq8 h TYR 82 Ca -0.02 0.00 -0.33 0.00 0.05 0.00 0.00 58.73 58.42 2cq8 h TYR 82 Cb 0.23 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.98 2cq8 h TYR 82 CO -0.04 0.00 -1.65 1.98 -1.05 0.00 0.00 178.16 177.40 2cq8 h MET 83 N 0.00 0.38 -3.73 4.88 4.05 0.79 -3.42 114.93 117.88 2cq8 h MET 83 Ca 0.17 -0.65 -0.64 0.00 -0.28 0.00 0.00 59.70 58.30 2cq8 h MET 83 Cb 0.77 0.24 -0.41 0.00 -0.80 0.00 0.00 31.60 31.41 2cq8 h MET 83 CO -0.00 1.31 -0.68 0.00 0.23 0.00 0.00 176.91 177.77 2cq8 s ALA 84 N -2.56 2.97 -0.10 0.39 0.00 0.22 -4.95 121.76 117.73 2cq8 s ALA 84 Ca -0.16 -2.90 -0.14 0.00 0.00 0.00 0.00 51.96 48.76 2cq8 s ALA 84 Cb 0.05 -2.05 -0.12 0.00 0.00 0.00 0.00 23.12 21.01 2cq8 s ALA 84 CO 0.84 -1.91 0.45 0.66 0.00 0.00 0.00 175.76 175.81 2cq8 h SER 85 N 6.93 -0.07 -4.02 0.00 4.64 -1.75 -3.40 113.55 115.88 2cq8 h SER 85 Ca -0.06 -0.37 -0.53 0.00 -0.47 0.00 0.00 61.79 60.36 2cq8 h SER 85 Cb 0.94 0.02 0.09 0.00 -0.31 0.00 0.00 62.40 63.14 2cq8 h SER 85 CO 0.60 0.59 0.54 0.42 -0.87 0.00 0.00 176.83 178.11 2cq8 s THR 86 N -2.26 2.67 0.11 2.95 -4.23 -1.26 -1.54 115.64 112.08 2cq8 s THR 86 Ca -0.09 0.50 -0.25 0.00 -1.18 0.00 0.00 61.69 60.67 2cq8 s THR 86 Cb -0.01 -3.25 -0.08 0.00 1.34 0.00 0.00 72.50 70.50 2cq8 s THR 86 CO 0.32 -0.01 1.66 0.15 -0.54 0.00 0.00 174.62 176.20 2cq8 h PHE 87 N 1.78 -0.51 -0.80 3.99 3.57 -1.35 -0.02 116.94 123.61 2cq8 h PHE 87 Ca -0.50 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.12 2cq8 h PHE 87 Cb 1.27 0.22 -0.12 0.00 2.79 0.00 0.00 35.95 40.11 2cq8 h PHE 87 CO 0.50 -0.28 -0.47 0.78 -2.23 0.00 0.00 178.31 176.61 2cq8 h GLY 88 N -0.34 -0.46 0.92 2.40 0.00 -1.44 0.74 103.07 104.89 2cq8 h GLY 88 Ca 0.04 0.63 -0.02 0.00 0.00 0.00 0.00 47.33 47.98 2cq8 h GLY 88 CO -0.14 -0.11 -0.31 -1.80 0.00 0.00 0.00 176.54 174.18 2cq8 h ASP 89 N -0.11 -0.75 -0.49 0.19 3.58 -1.72 -2.70 116.42 114.41 2cq8 h ASP 89 Ca 0.21 0.04 0.06 0.00 0.42 0.00 0.00 57.03 57.76 2cq8 h ASP 89 Cb 0.53 0.21 -0.09 0.00 1.72 0.00 0.00 39.33 41.70 2cq8 h ASP 89 CO -0.83 -0.50 -0.55 0.15 -2.88 0.00 0.00 179.24 174.63 2cq8 h PHE 90 N -0.80 -1.70 -1.00 0.28 3.57 0.63 -0.87 116.94 117.06 2cq8 h PHE 90 Ca -0.07 0.09 0.09 0.00 3.53 0.00 0.00 57.97 61.61 2cq8 h PHE 90 Cb 0.64 0.81 -0.12 0.00 2.79 0.00 0.00 35.95 40.06 2cq8 h PHE 90 CO -0.07 -0.47 -0.58 -0.89 -2.23 0.00 0.00 178.31 174.07 2cq8 n ILE 91 N -5.36 -0.67 -0.29 1.41 2.08 0.24 0.14 119.36 116.91 2cq8 n ILE 91 Ca -0.02 2.41 0.12 0.00 0.56 0.00 0.00 62.75 65.82 2cq8 n ILE 91 Cb 0.33 -2.98 0.28 0.00 -0.75 0.00 0.00 39.64 36.52 2cq8 n ILE 91 CO 0.00 0.00 0.00 1.56 0.56 0.00 0.00 176.55 178.67 2cq8 h GLN 92 N 0.00 0.26 -0.20 0.38 7.50 -0.87 1.50 115.11 123.68 2cq8 h GLN 92 Ca 0.17 -0.02 -0.05 0.00 0.50 0.00 0.00 58.65 59.25 2cq8 h GLN 92 Cb 0.42 -0.06 -0.01 0.00 0.05 0.00 0.00 27.48 27.88 2cq8 h GLN 92 CO -0.94 0.17 -0.08 1.25 -1.50 0.00 0.00 178.83 177.73 2cq8 h LEU 93 N 0.27 0.42 0.90 1.46 6.46 0.23 -1.61 115.31 123.44 2cq8 h LEU 93 Ca 0.54 -0.40 -0.04 0.00 -0.12 0.00 0.00 57.88 57.86 2cq8 h LEU 93 Cb 1.06 -0.11 0.01 0.00 -0.73 0.00 0.00 40.66 40.88 2cq8 h LEU 93 CO -0.60 0.72 -0.44 0.25 -0.62 0.00 0.00 178.44 177.75 2cq8 h LEU 94 N 0.11 -1.05 -0.95 2.25 5.85 0.50 -0.88 115.31 121.15 2cq8 h LEU 94 Ca 0.05 0.04 0.26 0.00 0.84 0.00 0.00 57.88 59.07 2cq8 h LEU 94 Cb 0.55 0.28 -0.14 0.00 0.37 0.00 0.00 40.66 41.72 2cq8 h LEU 94 CO 0.03 -0.74 0.45 0.58 -0.34 0.00 0.00 178.44 178.42 2cq8 h VAL 95 N -1.22 0.39 -0.32 1.05 2.07 0.19 0.92 116.25 119.32 2cq8 h VAL 95 Ca -0.12 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 67.28 2cq8 h VAL 95 Cb 0.94 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 2cq8 h VAL 95 CO 0.20 0.07 0.20 0.03 0.02 0.00 0.00 177.57 178.08 2cq8 h ARG 96 N 0.36 0.40 -0.32 1.57 3.08 -0.75 1.19 114.38 119.91 2cq8 h ARG 96 Ca 0.63 -0.02 -0.11 0.00 0.07 0.00 0.00 59.98 60.55 2cq8 h ARG 96 Cb 1.32 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.26 2cq8 h ARG 96 CO -0.58 0.26 -0.25 0.87 -1.07 0.00 0.00 179.97 179.20 2cq8 h LYS 97 N 0.41 0.64 0.02 0.04 1.57 0.15 -0.56 116.57 118.84 2cq8 h LYS 97 Ca 0.12 -0.26 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 2cq8 h LYS 97 Cb -0.03 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.25 2cq8 h LYS 97 CO -0.04 0.84 -0.01 -0.07 -0.57 0.00 0.00 179.45 179.59 2cq8 h LEU 98 N 0.56 -0.03 -0.45 2.94 3.38 0.12 -3.15 115.31 118.69 2cq8 h LEU 98 Ca 0.08 -0.37 0.05 0.00 0.09 0.00 0.00 57.88 57.74 2cq8 h LEU 98 Cb 0.73 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.44 2cq8 h LEU 98 CO 0.06 0.35 0.17 0.03 0.09 0.00 0.00 178.44 179.14 2cq8 h ARG 99 N -0.41 0.33 0.00 1.13 3.08 0.15 -3.44 114.38 115.22 2cq8 h ARG 99 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2cq8 h ARG 99 Cb 0.39 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2cq8 h ARG 99 CO 0.01 0.22 0.00 0.41 -1.07 0.00 0.00 179.97 179.53 2cq8 n GLY 100 N -1.25 3.44 0.00 0.04 0.00 -0.23 -5.09 105.19 102.11 2cq8 n GLY 100 Ca 0.04 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.36 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 0.00 -4.23 1.61 2.03 -1.23 -4.80 116.55 109.93 2cq8 n ASP 101 Ca 0.00 0.00 -0.35 0.00 0.52 0.00 0.00 54.79 54.96 2cq8 n ASP 101 Cb 0.00 0.00 -0.14 0.00 -0.72 0.00 0.00 41.12 40.26 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 0.00 4.56 -0.12 1.67 1.01 -1.26 -5.07 116.67 117.46 2cq8 s ASP 102 Ca 0.00 -0.89 -0.29 0.00 0.71 0.00 0.00 52.55 52.08 2cq8 s ASP 102 Cb 0.00 -1.72 -0.02 0.00 1.01 0.00 0.00 42.92 42.19 2cq8 s ASP 102 CO 0.00 -0.16 1.29 -0.70 0.21 0.00 0.00 175.17 175.82 2cq8 s GLU 103 N 1.35 4.26 0.41 8.23 2.12 -1.26 -4.79 118.70 129.03 2cq8 s GLU 103 Ca -0.00 1.73 0.00 0.00 0.36 0.00 0.00 54.97 57.06 2cq8 s GLU 103 Cb -0.17 -3.73 0.00 0.00 0.26 0.00 0.00 34.13 30.49 2cq8 s GLU 103 CO -0.03 -0.65 0.00 0.39 -0.54 0.00 0.00 175.26 174.43 2cq8 n GLU 104 N 6.26 -2.47 -3.04 4.30 4.71 -1.26 -4.91 120.64 124.23 2cq8 n GLU 104 Ca 0.13 1.91 -0.14 0.00 -0.01 0.00 0.00 57.16 59.05 2cq8 n GLU 104 Cb 0.45 -2.93 -0.04 0.00 -1.01 0.00 0.00 31.44 27.91 2cq8 n GLU 104 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 2cq8 n SER 105 N -3.87 -2.14 -2.69 1.62 2.88 -1.26 -5.02 113.62 103.15 2cq8 n SER 105 Ca -0.05 -2.67 -0.05 0.00 -1.33 0.00 0.00 58.87 54.77 2cq8 n SER 105 Cb 0.52 0.72 0.06 0.00 -0.75 0.00 0.00 64.21 64.77 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 2.89 -1.21 2.39 0.46 0.00 -1.26 -5.04 105.19 103.42 2cq8 n GLY 106 Ca 0.23 0.76 -0.24 0.00 0.00 0.00 0.00 46.02 46.78 2cq8 n GLY 106 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cq8 n PRO 107 N 1.67 2.45 -2.99 1.61 -0.04 -1.26 -4.89 135.00 131.56 2cq8 n PRO 107 Ca 0.05 -1.51 -0.40 0.00 -0.04 0.00 0.00 63.50 61.60 2cq8 n PRO 107 Cb 0.68 -2.41 -0.06 0.00 -0.04 0.00 0.00 33.50 31.67 2cq8 n PRO 107 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2cq8 s SER 108 N 2.71 7.32 -0.45 3.54 1.04 -1.26 -4.93 113.70 121.67 2cq8 s SER 108 Ca 0.52 1.56 -0.41 0.00 0.48 0.00 0.00 55.95 58.10 2cq8 s SER 108 Cb 0.16 -2.49 -0.17 0.00 0.10 0.00 0.00 66.02 63.63 2cq8 s SER 108 CO -0.03 0.13 2.12 -0.24 0.98 0.00 0.00 173.24 176.20 2cq8 n SER 109 N 2.07 1.23 -0.45 7.02 2.88 -1.26 -5.28 113.62 119.83 2cq8 n SER 109 Ca -0.04 0.63 0.06 0.00 -1.33 0.00 0.00 58.87 58.18 2cq8 n SER 109 Cb 0.49 -1.01 0.05 0.00 -0.75 0.00 0.00 64.21 62.98 2cq8 n SER 109 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42