#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 7.27 -0.30 1.61 0.01 -1.26 -5.04 113.70 115.99 2cq8 s SER 2 Ca 0.00 1.75 -0.03 0.00 1.31 0.00 0.00 55.95 58.99 2cq8 s SER 2 Cb 0.00 -2.55 0.04 0.00 0.21 0.00 0.00 66.02 63.72 2cq8 s SER 2 CO 0.00 -0.07 0.01 -0.44 0.41 0.00 0.00 173.24 173.15 2cq8 s SER 3 N -1.65 4.88 0.13 2.44 0.01 -1.26 -5.01 113.70 113.24 2cq8 s SER 3 Ca 0.50 -1.16 0.00 0.00 1.31 0.00 0.00 55.95 56.60 2cq8 s SER 3 Cb -0.18 -1.74 0.00 0.00 0.21 0.00 0.00 66.02 64.32 2cq8 s SER 3 CO 0.23 -0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.24 2cq8 n GLY 4 N 4.67 -2.81 3.87 3.44 0.00 -1.26 -4.95 105.19 108.16 2cq8 n GLY 4 Ca -0.14 -1.35 -0.32 0.00 0.00 0.00 0.00 46.02 44.21 2cq8 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cq8 s SER 5 N -4.57 6.63 -0.72 1.61 0.15 -1.26 -5.01 113.70 110.52 2cq8 s SER 5 Ca 0.00 0.89 -0.27 0.00 0.70 0.00 0.00 55.95 57.27 2cq8 s SER 5 Cb 0.00 -2.21 0.03 0.00 -1.71 0.00 0.00 66.02 62.12 2cq8 s SER 5 CO 0.00 -0.03 1.33 -0.44 1.20 0.00 0.00 173.24 175.30 2cq8 s SER 6 N -2.27 6.10 -0.48 5.45 0.01 -1.26 -4.86 113.70 116.38 2cq8 s SER 6 Ca 0.45 -0.35 0.08 0.00 1.31 0.00 0.00 55.95 57.44 2cq8 s SER 6 Cb -0.12 -2.56 0.35 0.00 0.21 0.00 0.00 66.02 63.90 2cq8 s SER 6 CO 0.21 -1.87 0.86 0.61 0.41 0.00 0.00 173.24 173.47 2cq8 n GLY 7 N 5.39 4.71 0.48 3.44 0.00 -1.26 -4.84 105.19 113.12 2cq8 n GLY 7 Ca 0.05 -2.30 -0.13 0.00 0.00 0.00 0.00 46.02 43.63 2cq8 n GLY 7 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2cq8 n PHE 8 N -0.03 0.00 -3.58 1.61 7.35 -1.26 -5.02 117.46 116.53 2cq8 n PHE 8 Ca 0.28 0.00 -0.35 0.00 -0.76 0.00 0.00 57.45 56.63 2cq8 n PHE 8 Cb 0.52 -0.49 -0.05 0.00 0.35 0.00 0.00 39.48 39.80 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 -2.39 3.58 0.51 -5.13 5.36 -1.26 -4.92 117.98 113.73 2cq8 s PHE 9 Ca -0.21 0.78 0.00 0.00 -0.96 0.00 0.00 56.93 56.54 2cq8 s PHE 9 Cb 0.07 -2.15 0.00 0.00 -0.34 0.00 0.00 43.02 40.59 2cq8 s PHE 9 CO 0.28 0.52 0.00 1.63 -1.46 0.00 0.00 175.22 176.19 2cq8 n LYS 10 N 0.91 -3.69 0.00 10.12 5.02 -1.26 -5.04 118.16 124.22 2cq8 n LYS 10 Ca -0.08 2.84 0.00 0.00 -2.02 0.00 0.00 58.31 59.05 2cq8 n LYS 10 Cb 0.52 -3.49 0.00 0.00 -0.02 0.00 0.00 35.03 32.05 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 -2.19 -0.75 2.22 0.72 0.00 -1.26 -5.01 105.19 98.91 2cq8 n GLY 11 Ca 0.00 0.38 -0.03 0.00 0.00 0.00 0.00 46.02 46.38 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 0.00 -3.44 -2.67 4.61 0.00 -1.26 -5.05 120.51 112.70 2cq8 n ALA 12 Ca 0.00 1.29 -0.04 0.00 0.00 0.00 0.00 53.44 54.69 2cq8 n ALA 12 Cb 0.00 -2.52 0.10 0.00 0.00 0.00 0.00 19.45 17.03 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 0.94 -3.17 -3.64 0.00 0.00 -1.26 -5.06 120.51 108.32 2cq8 n ALA 13 Ca -0.21 -0.42 -0.03 0.00 0.00 0.00 0.00 53.44 52.78 2cq8 n ALA 13 Cb 0.33 -3.06 -0.05 0.00 0.00 0.00 0.00 19.45 16.66 2cq8 n ALA 13 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2cq8 s SER 14 N -0.26 -0.07 0.43 0.00 0.01 -1.26 -5.16 113.70 107.39 2cq8 s SER 14 Ca 0.22 0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.59 2cq8 s SER 14 Cb 0.27 0.09 0.00 0.00 0.21 0.00 0.00 66.02 66.59 2cq8 s SER 14 CO -0.16 -0.05 0.00 -1.54 0.41 0.00 0.00 173.24 171.90 2cq8 n SER 15 N 0.95 -6.97 -4.03 2.44 3.41 -1.26 -4.91 113.62 103.25 2cq8 n SER 15 Ca -0.05 0.94 -0.23 0.00 -0.26 0.00 0.00 58.87 59.27 2cq8 n SER 15 Cb 0.58 -4.20 -0.16 0.00 -0.26 0.00 0.00 64.21 60.17 2cq8 n SER 15 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2cq8 s VAL 16 N -3.54 1.05 0.89 -3.33 0.11 -1.26 -5.09 120.40 109.23 2cq8 s VAL 16 Ca 0.00 -0.47 -0.12 0.00 -2.93 0.00 0.00 61.98 58.46 2cq8 s VAL 16 Cb 0.00 -0.95 0.13 0.00 -1.53 0.00 0.00 36.38 34.03 2cq8 s VAL 16 CO 0.00 0.33 1.14 -0.76 -3.33 0.00 0.00 175.10 172.48 2cq8 s LEU 17 N 0.43 2.11 -0.23 2.54 1.43 -1.26 -5.04 118.68 118.65 2cq8 s LEU 17 Ca -0.09 0.94 -0.04 0.00 -1.03 0.00 0.00 54.13 53.91 2cq8 s LEU 17 Cb -0.13 -3.30 -0.01 0.00 0.03 0.00 0.00 46.19 42.78 2cq8 s LEU 17 CO 0.02 -2.43 -0.02 -0.70 0.23 0.00 0.00 176.35 173.45 2cq8 s GLU 18 N -5.32 3.37 1.08 1.70 2.12 -1.26 -5.01 118.70 115.37 2cq8 s GLU 18 Ca 0.63 -0.63 -0.18 0.00 0.36 0.00 0.00 54.97 55.15 2cq8 s GLU 18 Cb -0.14 -3.06 0.28 0.00 0.26 0.00 0.00 34.13 31.47 2cq8 s GLU 18 CO 0.53 -0.22 0.65 1.28 -0.54 0.00 0.00 175.26 176.96 2cq8 n LEU 19 N 4.81 0.00 -4.04 2.70 7.99 -1.26 -5.07 117.00 122.13 2cq8 n LEU 19 Ca -0.18 -0.66 -0.10 0.00 -0.01 0.00 0.00 56.01 55.07 2cq8 n LEU 19 Cb 0.51 -0.73 -0.07 0.00 -0.11 0.00 0.00 43.42 43.01 2cq8 n LEU 19 CO 0.29 -2.46 0.01 0.42 -1.51 0.00 0.00 177.39 174.14 2cq8 s THR 20 N -1.84 0.02 0.37 -5.08 -4.23 -1.26 -4.89 115.64 98.72 2cq8 s THR 20 Ca 0.49 -1.57 0.17 0.00 -1.18 0.00 0.00 61.69 59.61 2cq8 s THR 20 Cb -0.08 -2.19 0.37 0.00 1.34 0.00 0.00 72.50 71.93 2cq8 s THR 20 CO 0.41 -0.08 1.68 -0.08 -0.54 0.00 0.00 174.62 176.01 2cq8 h GLU 21 N 2.43 0.31 0.00 3.99 4.81 -1.99 1.44 114.58 125.58 2cq8 h GLU 21 Ca -0.30 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 2cq8 h GLU 21 Cb 1.24 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.55 2cq8 h GLU 21 CO 0.44 0.21 -0.17 0.00 -0.73 0.00 0.00 179.01 178.76 2cq8 h ALA 22 N 1.75 0.00 -0.83 2.92 0.00 -2.01 -3.32 119.26 117.77 2cq8 h ALA 22 Ca 0.72 -0.18 0.17 0.00 0.00 0.00 0.00 54.91 55.61 2cq8 h ALA 22 Cb 1.75 0.17 -0.16 0.00 0.00 0.00 0.00 17.79 19.55 2cq8 h ALA 22 CO -0.51 0.17 -0.21 0.93 0.00 0.00 0.00 179.25 179.63 2cq8 h GLU 23 N -0.84 -0.00 -0.81 0.00 5.08 -1.77 0.39 114.58 116.63 2cq8 h GLU 23 Ca 0.00 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.50 2cq8 h GLU 23 Cb 0.17 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.27 2cq8 h GLU 23 CO 0.00 -0.00 -0.31 -0.07 -1.00 0.00 0.00 179.01 177.63 2cq8 h LEU 24 N -0.00 -1.12 -0.23 1.33 3.38 0.18 1.39 115.31 120.23 2cq8 h LEU 24 Ca 0.40 0.26 0.05 0.00 0.09 0.00 0.00 57.88 58.68 2cq8 h LEU 24 Cb 0.61 0.62 -0.04 0.00 0.09 0.00 0.00 40.66 41.93 2cq8 h LEU 24 CO -0.86 -0.29 -0.06 0.58 0.09 0.00 0.00 178.44 177.90 2cq8 h VAL 25 N -0.06 0.76 -0.81 1.22 2.07 -0.35 0.13 116.25 119.21 2cq8 h VAL 25 Ca 0.33 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.88 2cq8 h VAL 25 Cb 0.59 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 31.07 2cq8 h VAL 25 CO -0.84 0.00 0.52 0.74 0.02 0.00 0.00 177.57 178.00 2cq8 h THR 26 N -0.01 1.14 -0.29 2.57 2.02 0.75 0.78 112.91 119.87 2cq8 h THR 26 Ca 0.11 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 2cq8 h THR 26 Cb 0.18 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.60 2cq8 h THR 26 CO -0.24 0.19 0.12 0.00 0.37 0.00 0.00 175.52 175.96 2cq8 h ALA 27 N 1.33 1.68 -0.01 6.16 0.00 0.26 -0.88 119.26 127.80 2cq8 h ALA 27 Ca 0.32 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.97 2cq8 h ALA 27 Cb -0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2cq8 h ALA 27 CO -0.10 0.26 -0.80 0.93 0.00 0.00 0.00 179.25 179.53 2cq8 h GLU 28 N 0.40 0.17 -0.32 0.00 4.39 0.89 -2.20 114.58 117.91 2cq8 h GLU 28 Ca 0.10 -0.17 -0.05 0.00 0.34 0.00 0.00 59.36 59.58 2cq8 h GLU 28 Cb 0.07 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.74 2cq8 h GLU 28 CO -0.01 0.88 -0.02 0.00 -1.16 0.00 0.00 179.01 178.70 2cq8 h ALA 29 N 1.06 1.37 -0.04 3.43 0.00 0.45 -1.67 119.26 123.87 2cq8 h ALA 29 Ca -0.03 -0.21 -0.19 0.00 0.00 0.00 0.00 54.91 54.49 2cq8 h ALA 29 Cb 1.39 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 19.05 2cq8 h ALA 29 CO 0.12 0.44 -0.71 0.28 0.00 0.00 0.00 179.25 179.38 2cq8 h VAL 30 N 0.48 1.36 -0.98 0.00 2.07 -1.26 -3.18 116.25 114.74 2cq8 h VAL 30 Ca 0.10 -2.05 0.13 0.00 0.82 0.00 0.00 66.70 65.71 2cq8 h VAL 30 Cb 0.34 2.38 -0.08 0.00 -1.52 0.00 0.00 31.29 32.41 2cq8 h VAL 30 CO 0.01 0.62 0.62 -0.09 0.02 0.00 0.00 177.57 178.74 2cq8 h ARG 31 N 0.14 0.88 -0.16 1.57 2.43 -0.97 0.30 114.38 118.57 2cq8 h ARG 31 Ca -0.08 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.04 2cq8 h ARG 31 Cb 1.38 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 2cq8 h ARG 31 CO 0.14 0.58 0.08 1.03 -1.51 0.00 0.00 179.97 180.29 2cq8 h SER 32 N 0.91 0.19 0.63 -3.80 0.87 -1.30 -1.45 113.55 109.60 2cq8 h SER 32 Ca 0.49 -0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 61.01 2cq8 h SER 32 Cb 0.56 -0.05 0.01 0.00 -0.44 0.00 0.00 62.40 62.48 2cq8 h SER 32 CO -0.26 0.17 -0.30 0.58 -0.53 0.00 0.00 176.83 176.49 2cq8 h VAL 33 N 0.22 0.27 -0.46 2.23 2.07 -0.43 0.49 116.25 120.64 2cq8 h VAL 33 Ca 0.06 -0.25 0.09 0.00 0.82 0.00 0.00 66.70 67.42 2cq8 h VAL 33 Cb 0.03 0.34 -0.09 0.00 -1.52 0.00 0.00 31.29 30.04 2cq8 h VAL 33 CO -0.01 0.03 -0.19 -0.50 0.02 0.00 0.00 177.57 176.92 2cq8 h TRP 34 N -1.04 -0.47 0.05 1.57 4.06 -1.14 0.66 115.95 119.64 2cq8 h TRP 34 Ca -0.09 0.05 0.01 0.00 2.06 0.00 0.00 58.89 60.92 2cq8 h TRP 34 Cb 0.70 0.28 -0.04 0.00 -1.00 0.00 0.00 29.16 29.09 2cq8 h TRP 34 CO -0.00 -0.28 -0.43 1.96 -3.56 0.00 0.00 178.44 176.13 2cq8 h GLN 35 N -0.09 -0.56 -0.47 0.49 1.08 -1.16 1.42 115.11 115.83 2cq8 h GLN 35 Ca 0.22 0.04 0.09 0.00 -1.45 0.00 0.00 58.65 57.55 2cq8 h GLN 35 Cb 0.43 0.13 -0.08 0.00 -0.05 0.00 0.00 27.48 27.91 2cq8 h GLN 35 CO -0.52 -0.37 -0.06 0.00 -0.95 0.00 0.00 178.83 176.92 2cq8 h ARG 36 N -0.58 0.05 0.00 1.46 3.08 -0.01 -3.09 114.38 115.29 2cq8 h ARG 36 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2cq8 h ARG 36 Cb 0.60 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.64 2cq8 h ARG 36 CO -0.26 0.03 0.00 -0.89 -1.07 0.00 0.00 179.97 177.78 2cq8 n ILE 37 N -5.29 0.00 -1.65 2.04 5.41 0.22 -4.45 119.36 115.64 2cq8 n ILE 37 Ca 0.04 1.27 -0.43 0.00 1.00 0.00 0.00 62.75 64.63 2cq8 n ILE 37 Cb 0.25 -2.26 -0.03 0.00 -0.71 0.00 0.00 39.64 36.89 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 -2.78 3.55 0.00 1.39 1.43 0.48 -4.88 118.68 117.87 2cq8 s LEU 38 Ca 0.00 1.91 0.00 0.00 -1.03 0.00 0.00 54.13 55.01 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 -1.85 0.22 -0.81 0.23 0.00 0.00 176.35 174.14 2cq8 n PRO 39 N 8.61 0.00 -0.32 1.29 -0.04 -1.26 -3.86 135.00 139.41 2cq8 n PRO 39 Ca 0.28 0.40 0.26 0.00 -0.04 0.00 0.00 63.50 64.39 2cq8 n PRO 39 Cb 0.45 -1.02 0.48 0.00 -0.04 0.00 0.00 33.50 33.37 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 -1.69 -0.07 -1.63 0.54 4.76 -1.26 -4.13 118.16 114.68 2cq8 n LYS 40 Ca 0.00 1.40 -0.43 0.00 -2.87 0.00 0.00 58.31 56.41 2cq8 n LYS 40 Cb 0.00 -2.41 -0.03 0.00 -1.84 0.00 0.00 35.03 30.75 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 0.57 0.02 -0.18 0.31 -1.25 -4.83 118.33 107.64 2cq8 n VAL 41 Ca 0.32 -0.28 -0.20 0.00 -0.01 0.00 0.00 64.34 64.18 2cq8 n VAL 41 Cb 1.09 -2.39 -0.14 0.00 -0.91 0.00 0.00 33.84 31.49 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 12.51 0.39 -8.13 7.52 3.38 -1.86 -3.47 115.31 125.65 2cq8 h LEU 42 Ca -0.45 -0.81 -0.45 0.00 0.09 0.00 0.00 57.88 56.26 2cq8 h LEU 42 Cb 1.24 -0.13 -0.29 0.00 0.09 0.00 0.00 40.66 41.57 2cq8 h LEU 42 CO 0.95 1.72 -0.80 -0.70 0.09 0.00 0.00 178.44 179.70 2cq8 s GLU 43 N -2.57 1.02 -0.20 1.13 2.12 -1.26 -5.05 118.70 113.88 2cq8 s GLU 43 Ca -0.18 -0.43 -0.01 0.00 0.36 0.00 0.00 54.97 54.71 2cq8 s GLU 43 Cb 0.07 -0.97 0.01 0.00 0.26 0.00 0.00 34.13 33.49 2cq8 s GLU 43 CO 0.79 0.25 -0.13 0.08 -0.54 0.00 0.00 175.26 175.71 2cq8 s VAL 44 N -0.22 2.60 0.10 3.70 1.01 -1.26 -5.01 120.40 121.32 2cq8 s VAL 44 Ca 0.04 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.23 2cq8 s VAL 44 Cb -0.05 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.18 2cq8 s VAL 44 CO -0.00 0.47 0.06 -1.84 0.00 0.00 0.00 175.10 173.78 2cq8 n GLU 45 N 4.69 1.43 0.15 2.72 0.00 -1.26 -4.97 120.64 123.39 2cq8 n GLU 45 Ca -0.20 -0.64 0.13 0.00 0.00 0.00 0.00 57.16 56.45 2cq8 n GLU 45 Cb 0.50 0.09 0.37 0.00 0.00 0.00 0.00 31.44 32.41 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 0.14 0.00 -0.01 -1.84 2.03 -1.97 -2.79 116.42 111.99 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 0.23 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.73 2cq8 h ASP 46 CO 0.11 0.00 -0.33 -0.24 -1.03 0.00 0.00 179.24 177.74 2cq8 n SER 47 N -2.52 2.26 -4.75 4.15 2.88 -1.26 0.35 113.62 114.73 2cq8 n SER 47 Ca 0.04 -1.63 -0.36 0.00 -1.33 0.00 0.00 58.87 55.59 2cq8 n SER 47 Cb 0.42 0.33 0.04 0.00 -0.75 0.00 0.00 64.21 64.25 2cq8 n SER 47 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2cq8 s THR 48 N -2.34 2.52 0.15 2.46 2.01 -1.05 -4.86 115.64 114.54 2cq8 s THR 48 Ca 0.21 0.34 0.06 0.00 0.31 0.00 0.00 61.69 62.61 2cq8 s THR 48 Cb 0.19 -3.14 -0.04 0.00 0.01 0.00 0.00 72.50 69.52 2cq8 s THR 48 CO 0.49 -0.06 0.03 1.51 -0.69 0.00 0.00 174.62 175.90 2cq8 s ASP 49 N -1.49 4.99 -0.08 3.53 1.47 -1.26 -1.56 116.67 122.26 2cq8 s ASP 49 Ca 0.77 -0.29 -0.04 0.00 1.18 0.00 0.00 52.55 54.17 2cq8 s ASP 49 Cb -0.32 -1.15 -0.01 0.00 -0.34 0.00 0.00 42.92 41.09 2cq8 s ASP 49 CO 0.35 0.10 -0.08 0.15 0.68 0.00 0.00 175.17 176.37 2cq8 h PHE 50 N 2.79 0.00 0.78 2.11 3.57 -0.79 -3.27 116.94 122.12 2cq8 h PHE 50 Ca -0.47 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 60.99 2cq8 h PHE 50 Cb 1.19 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.94 2cq8 h PHE 50 CO 0.61 0.00 -0.37 0.74 -2.23 0.00 0.00 178.31 177.06 2cq8 h PHE 51 N -0.60 -0.97 -0.68 0.41 0.04 -1.82 -1.81 116.94 111.52 2cq8 h PHE 51 Ca 0.00 -0.02 0.11 0.00 2.80 0.00 0.00 57.97 60.86 2cq8 h PHE 51 Cb 0.23 0.32 -0.12 0.00 2.20 0.00 0.00 35.95 38.58 2cq8 h PHE 51 CO -0.10 -0.59 -0.38 0.87 -0.60 0.00 0.00 178.31 177.51 2cq8 h LYS 52 N -1.12 -0.14 -0.07 1.51 6.56 -1.89 -1.73 116.57 119.69 2cq8 h LYS 52 Ca -0.11 0.01 0.01 0.00 -1.06 0.00 0.00 60.65 59.50 2cq8 h LYS 52 Cb 0.82 0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 32.50 2cq8 h LYS 52 CO 0.18 -0.09 -0.06 0.77 -2.06 0.00 0.00 179.45 178.19 2cq8 h SER 53 N -0.15 -0.20 0.00 0.86 0.02 -1.59 -3.44 113.55 109.06 2cq8 h SER 53 Ca 0.24 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 2cq8 h SER 53 Cb 0.56 0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.19 2cq8 h SER 53 CO -0.75 -0.03 0.00 0.61 -1.14 0.00 0.00 176.83 175.52 2cq8 n GLY 54 N -1.03 0.00 3.75 -3.77 0.00 -0.67 -4.87 105.19 98.61 2cq8 n GLY 54 Ca -0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 0.60 4.61 0.00 -0.71 -4.87 121.76 124.93 2cq8 s ALA 55 Ca 0.00 -0.20 0.04 0.00 0.00 0.00 0.00 51.96 51.80 2cq8 s ALA 55 Cb 0.00 -2.57 0.11 0.00 0.00 0.00 0.00 23.12 20.66 2cq8 s ALA 55 CO 0.00 0.14 0.79 0.00 0.00 0.00 0.00 175.76 176.69 2cq8 n ALA 56 N 3.12 0.61 0.31 0.00 0.00 -1.26 -4.62 120.51 118.67 2cq8 n ALA 56 Ca -0.09 -1.77 0.17 0.00 0.00 0.00 0.00 53.44 51.75 2cq8 n ALA 56 Cb 0.52 0.39 0.73 0.00 0.00 0.00 0.00 19.45 21.08 2cq8 n ALA 56 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2cq8 h SER 57 N -0.23 0.00 0.28 0.00 4.64 -2.02 -2.37 113.55 113.85 2cq8 h SER 57 Ca -0.26 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.72 2cq8 h SER 57 Cb 1.08 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.16 2cq8 h SER 57 CO 0.32 0.00 -1.74 -0.37 -0.87 0.00 0.00 176.83 174.17 2cq8 h VAL 58 N 0.00 0.92 -0.89 0.95 -1.51 -2.01 -3.34 116.25 110.37 2cq8 h VAL 58 Ca 0.00 -2.57 0.13 0.00 -1.23 0.00 0.00 66.70 63.03 2cq8 h VAL 58 Cb 0.37 2.67 -0.09 0.00 -2.13 0.00 0.00 31.29 32.12 2cq8 h VAL 58 CO 0.00 0.83 0.51 -0.78 -1.23 0.00 0.00 177.57 176.90 2cq8 h ASP 59 N 0.08 0.70 -0.56 4.19 3.58 -1.79 0.11 116.42 122.73 2cq8 h ASP 59 Ca -0.33 0.07 0.11 0.00 0.42 0.00 0.00 57.03 57.30 2cq8 h ASP 59 Cb 2.05 -0.06 -0.11 0.00 1.72 0.00 0.00 39.33 42.93 2cq8 h ASP 59 CO 0.15 0.35 -0.17 0.58 -2.88 0.00 0.00 179.24 177.26 2cq8 h VAL 60 N 0.79 0.38 -0.25 2.25 2.07 -1.63 1.12 116.25 120.97 2cq8 h VAL 60 Ca 0.46 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.86 2cq8 h VAL 60 Cb 0.53 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 2cq8 h VAL 60 CO -0.30 0.00 -0.34 0.58 0.02 0.00 0.00 177.57 177.53 2cq8 h VAL 61 N -0.04 1.29 0.69 2.57 2.07 -1.25 -1.95 116.25 119.63 2cq8 h VAL 61 Ca 0.27 -1.46 -0.03 0.00 0.82 0.00 0.00 66.70 66.29 2cq8 h VAL 61 Cb 0.45 1.47 0.01 0.00 -1.52 0.00 0.00 31.29 31.69 2cq8 h VAL 61 CO -0.60 0.46 -0.33 -0.09 0.02 0.00 0.00 177.57 177.03 2cq8 h ARG 62 N 0.46 -0.90 -0.58 1.57 2.43 0.21 1.09 114.38 118.67 2cq8 h ARG 62 Ca 0.05 0.06 0.12 0.00 -0.81 0.00 0.00 59.98 59.40 2cq8 h ARG 62 Cb 0.82 0.20 -0.10 0.00 -0.42 0.00 0.00 29.97 30.47 2cq8 h ARG 62 CO 0.07 -0.60 -0.06 1.25 -1.51 0.00 0.00 179.97 179.12 2cq8 h LEU 63 N -0.98 -0.38 -0.54 3.80 5.85 0.10 1.70 115.31 124.86 2cq8 h LEU 63 Ca -0.10 0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 2cq8 h LEU 63 Cb 0.71 0.30 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 2cq8 h LEU 63 CO 0.16 -0.15 0.33 0.58 -0.34 0.00 0.00 178.44 179.02 2cq8 h VAL 64 N 0.06 1.16 -0.62 1.05 2.07 -1.25 0.16 116.25 118.88 2cq8 h VAL 64 Ca 0.29 -0.36 -0.05 0.00 0.82 0.00 0.00 66.70 67.40 2cq8 h VAL 64 Cb 0.46 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 2cq8 h VAL 64 CO -0.54 0.17 0.21 -0.33 0.02 0.00 0.00 177.57 177.09 2cq8 h GLU 65 N 0.73 0.96 0.64 1.57 4.39 0.43 -0.10 114.58 123.20 2cq8 h GLU 65 Ca 0.20 -0.20 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 2cq8 h GLU 65 Cb -0.02 -0.14 0.01 0.00 -0.10 0.00 0.00 28.75 28.50 2cq8 h GLU 65 CO -0.04 0.84 -0.31 0.93 -1.16 0.00 0.00 179.01 179.27 2cq8 h GLU 66 N 0.88 -0.82 -0.04 2.33 5.08 0.29 -1.92 114.58 120.37 2cq8 h GLU 66 Ca 0.20 0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.63 2cq8 h GLU 66 Cb 0.27 0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 2cq8 h GLU 66 CO -0.01 -0.52 0.10 0.28 -1.00 0.00 0.00 179.01 177.86 2cq8 h VAL 67 N -0.95 0.23 -0.64 3.13 2.07 -0.64 0.76 116.25 120.21 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 0.69 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 2cq8 h VAL 67 CO 0.14 0.00 0.21 0.11 0.02 0.00 0.00 177.57 178.05 2cq8 h LYS 68 N 0.00 0.99 0.00 1.57 1.57 -0.21 -1.71 116.57 118.77 2cq8 h LYS 68 Ca 0.02 -0.21 -0.04 0.00 -1.87 0.00 0.00 60.65 58.55 2cq8 h LYS 68 Cb 0.22 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 2cq8 h LYS 68 CO -0.00 0.86 -0.21 0.93 -0.57 0.00 0.00 179.45 180.46 2cq8 h GLU 69 N 0.92 0.00 0.04 3.15 4.39 -0.55 1.95 114.58 124.48 2cq8 h GLU 69 Ca 0.21 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.91 2cq8 h GLU 69 Cb 0.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 2cq8 h GLU 69 CO -0.01 0.21 -0.02 -0.07 -1.16 0.00 0.00 179.01 177.96 2cq8 h LEU 70 N 0.00 -0.04 -1.28 1.33 3.38 -1.04 -2.86 115.31 114.79 2cq8 h LEU 70 Ca -0.00 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2cq8 h LEU 70 Cb 0.71 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.47 2cq8 h LEU 70 CO 0.03 0.19 -0.12 0.00 0.09 0.00 0.00 178.44 178.63 2cq8 n ASP 72 N 0.49 -7.26 -0.08 0.00 2.03 0.41 -4.43 116.55 107.71 2cq8 n ASP 72 Ca 0.14 -0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.35 2cq8 n ASP 72 Cb 0.47 -4.96 0.00 0.00 -0.72 0.00 0.00 41.12 35.91 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 -1.68 0.97 3.71 0.27 0.00 0.56 -4.96 105.19 104.06 2cq8 n GLY 73 Ca -0.00 -0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.08 3.74 -3.27 0.99 7.94 -1.13 -4.81 117.00 120.38 2cq8 n LEU 74 Ca 0.00 1.12 -0.29 0.00 -1.11 0.00 0.00 56.01 55.72 2cq8 n LEU 74 Cb 0.08 -1.52 -0.02 0.00 0.53 0.00 0.00 43.42 42.49 2cq8 n LEU 74 CO 0.00 -0.08 2.70 -0.62 -1.11 0.00 0.00 177.39 178.27 2cq8 n GLU 75 N 2.72 2.60 -4.06 1.96 1.02 -1.26 -4.81 120.64 118.81 2cq8 n GLU 75 Ca 0.12 -1.76 -0.29 0.00 -0.02 0.00 0.00 57.16 55.21 2cq8 n GLU 75 Cb 0.34 -2.62 -0.06 0.00 -0.02 0.00 0.00 31.44 29.07 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 0.27 3.82 0.03 -4.62 2.96 -1.26 -5.06 118.68 114.82 2cq8 s LEU 76 Ca 0.51 -0.04 0.00 0.00 -0.22 0.00 0.00 54.13 54.37 2cq8 s LEU 76 Cb 0.13 -2.48 -0.02 0.00 0.50 0.00 0.00 46.19 44.32 2cq8 s LEU 76 CO -0.04 0.13 -0.04 -1.83 -1.32 0.00 0.00 176.35 173.26 2cq8 s GLU 77 N -2.67 0.39 0.51 1.98 -1.05 -1.26 -5.01 118.70 111.60 2cq8 s GLU 77 Ca 0.30 -0.72 0.36 0.00 -0.15 0.00 0.00 54.97 54.76 2cq8 s GLU 77 Cb -0.11 0.04 1.50 0.00 -0.44 0.00 0.00 34.13 35.12 2cq8 s GLU 77 CO 0.23 -0.04 1.74 -0.91 0.95 0.00 0.00 175.26 177.23 2cq8 h ASN 78 N 4.42 0.10 0.02 0.83 2.35 -1.99 0.53 115.58 121.83 2cq8 h ASN 78 Ca -0.33 0.03 0.01 0.00 -0.55 0.00 0.00 56.30 55.46 2cq8 h ASN 78 Cb 1.20 0.02 -0.01 0.00 0.05 0.00 0.00 38.32 39.57 2cq8 h ASN 78 CO 0.44 -0.01 -0.06 -0.33 -1.65 0.00 0.00 177.43 175.83 2cq8 h GLU 79 N 0.07 -0.10 -0.72 0.81 5.08 -1.97 -0.06 114.58 117.68 2cq8 h GLU 79 Ca 0.66 0.01 0.16 0.00 -1.00 0.00 0.00 59.36 59.18 2cq8 h GLU 79 Cb 2.43 0.02 -0.11 0.00 0.50 0.00 0.00 28.75 31.60 2cq8 h GLU 79 CO -0.10 -0.07 0.15 -0.44 -1.00 0.00 0.00 179.01 177.55 2cq8 h ASP 80 N -0.11 -0.04 -0.53 1.42 3.32 -0.33 0.37 116.42 120.52 2cq8 h ASP 80 Ca 0.02 0.15 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 2cq8 h ASP 80 Cb 0.12 0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 2cq8 h ASP 80 CO -0.05 -0.06 0.28 0.58 -1.72 0.00 0.00 179.24 178.28 2cq8 h VAL 81 N 0.24 1.18 0.00 -1.35 2.07 -1.26 0.26 116.25 117.40 2cq8 h VAL 81 Ca 0.41 -0.47 0.00 0.00 0.82 0.00 0.00 66.70 67.46 2cq8 h VAL 81 Cb 0.69 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2cq8 h VAL 81 CO -0.52 0.20 0.00 -1.22 0.02 0.00 0.00 177.57 176.04 2cq8 n TYR 82 N -4.63 0.56 -0.10 1.57 4.01 0.99 -2.53 117.16 117.03 2cq8 n TYR 82 Ca 0.03 0.25 -0.23 0.00 -0.16 0.00 0.00 57.90 57.78 2cq8 n TYR 82 Cb 0.09 -0.90 -0.12 0.00 -0.31 0.00 0.00 39.34 38.10 2cq8 n TYR 82 CO 0.00 0.00 0.00 -0.12 -0.46 0.00 0.00 176.86 176.28 2cq8 n MET 83 N -2.04 0.63 -3.75 -0.72 1.56 0.50 -4.71 117.12 108.60 2cq8 n MET 83 Ca 0.01 0.31 -0.34 0.00 -0.27 0.00 0.00 57.70 57.41 2cq8 n MET 83 Cb 0.12 -1.61 -0.09 0.00 2.15 0.00 0.00 33.22 33.79 2cq8 n MET 83 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2cq8 s ALA 84 N -2.49 3.86 0.21 -5.12 0.00 0.75 -4.87 121.76 114.10 2cq8 s ALA 84 Ca -0.32 -3.61 0.15 0.00 0.00 0.00 0.00 51.96 48.18 2cq8 s ALA 84 Cb 0.10 -2.57 0.50 0.00 0.00 0.00 0.00 23.12 21.15 2cq8 s ALA 84 CO 0.60 -2.11 1.66 0.66 0.00 0.00 0.00 175.76 176.57 2cq8 h SER 85 N 6.24 0.00 -3.13 0.00 4.64 -1.82 -3.40 113.55 116.09 2cq8 h SER 85 Ca 0.08 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.81 2cq8 h SER 85 Cb 0.85 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.90 2cq8 h SER 85 CO 0.76 0.50 -0.17 0.42 -0.87 0.00 0.00 176.83 177.48 2cq8 s THR 86 N -3.59 4.97 0.08 2.95 -4.23 -1.26 0.00 115.64 114.57 2cq8 s THR 86 Ca -0.01 0.79 -0.36 0.00 -1.18 0.00 0.00 61.69 60.94 2cq8 s THR 86 Cb 0.12 -3.72 -0.17 0.00 1.34 0.00 0.00 72.50 70.06 2cq8 s THR 86 CO 0.73 0.43 1.57 0.15 -0.54 0.00 0.00 174.62 176.96 2cq8 h PHE 87 N 4.18 -1.34 -0.76 3.99 3.57 -1.44 0.10 116.94 125.24 2cq8 h PHE 87 Ca -0.50 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.07 2cq8 h PHE 87 Cb 1.21 0.51 -0.09 0.00 2.79 0.00 0.00 35.95 40.37 2cq8 h PHE 87 CO 0.68 -0.67 -0.45 0.41 -2.23 0.00 0.00 178.31 176.06 2cq8 n GLY 88 N -1.57 -2.14 0.45 2.40 0.00 0.16 0.11 105.19 104.60 2cq8 n GLY 88 Ca -0.12 0.93 -0.19 0.00 0.00 0.00 0.00 46.02 46.64 2cq8 n GLY 88 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2cq8 h ASP 89 N 0.00 -1.01 -0.87 1.61 3.58 -1.69 -2.85 116.42 115.19 2cq8 h ASP 89 Ca 0.12 0.05 0.13 0.00 0.42 0.00 0.00 57.03 57.75 2cq8 h ASP 89 Cb 0.31 0.28 -0.14 0.00 1.72 0.00 0.00 39.33 41.50 2cq8 h ASP 89 CO -0.71 -0.66 -0.41 0.15 -2.88 0.00 0.00 179.24 174.72 2cq8 h PHE 90 N -1.07 -1.19 -0.76 0.28 3.57 0.18 0.25 116.94 118.20 2cq8 h PHE 90 Ca -0.10 0.10 0.11 0.00 3.53 0.00 0.00 57.97 61.61 2cq8 h PHE 90 Cb 0.85 0.64 -0.13 0.00 2.79 0.00 0.00 35.95 40.10 2cq8 h PHE 90 CO -0.06 -0.40 -0.41 0.82 -2.23 0.00 0.00 178.31 176.03 2cq8 h ILE 91 N -0.06 0.07 -0.61 1.41 1.08 0.94 1.19 117.51 121.54 2cq8 h ILE 91 Ca 0.28 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.88 2cq8 h ILE 91 Cb 0.56 0.07 -0.10 0.00 -3.07 0.00 0.00 36.82 34.28 2cq8 h ILE 91 CO -0.89 0.00 -0.02 1.56 -0.69 0.00 0.00 178.15 178.11 2cq8 h GLN 92 N -0.12 0.10 -0.32 2.37 1.08 -0.31 1.23 115.11 119.14 2cq8 h GLN 92 Ca 0.25 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.42 2cq8 h GLN 92 Cb 0.56 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.95 2cq8 h GLN 92 CO -0.81 0.06 0.11 1.25 -0.95 0.00 0.00 178.83 178.50 2cq8 h LEU 93 N 0.10 0.46 0.78 1.46 6.46 0.74 -1.78 115.31 123.53 2cq8 h LEU 93 Ca 0.31 -0.19 -0.03 0.00 -0.12 0.00 0.00 57.88 57.85 2cq8 h LEU 93 Cb 0.50 -0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.31 2cq8 h LEU 93 CO -0.53 0.53 -0.46 0.25 -0.62 0.00 0.00 178.44 177.60 2cq8 h LEU 94 N 0.37 -1.15 -0.97 2.25 5.85 0.33 -1.21 115.31 120.77 2cq8 h LEU 94 Ca 0.11 0.06 0.31 0.00 0.84 0.00 0.00 57.88 59.19 2cq8 h LEU 94 Cb 0.22 0.33 -0.15 0.00 0.37 0.00 0.00 40.66 41.43 2cq8 h LEU 94 CO -0.01 -0.72 0.43 0.58 -0.34 0.00 0.00 178.44 178.38 2cq8 h VAL 95 N -1.16 0.24 -0.05 1.05 2.07 0.15 0.88 116.25 119.43 2cq8 h VAL 95 Ca -0.10 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.34 2cq8 h VAL 95 Cb 0.92 -0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2cq8 h VAL 95 CO 0.12 0.04 0.02 0.03 0.02 0.00 0.00 177.57 177.80 2cq8 h ARG 96 N 0.22 0.05 -0.49 1.57 3.08 -0.60 0.89 114.38 119.10 2cq8 h ARG 96 Ca 0.69 -0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.67 2cq8 h ARG 96 Cb 1.56 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.58 2cq8 h ARG 96 CO -0.67 0.03 0.05 0.87 -1.07 0.00 0.00 179.97 179.18 2cq8 h LYS 97 N 0.05 0.79 0.44 0.04 1.57 0.15 -1.84 116.57 117.78 2cq8 h LYS 97 Ca 0.02 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 58.59 2cq8 h LYS 97 Cb 0.00 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.21 2cq8 h LYS 97 CO -0.01 0.76 -0.21 -0.07 -0.57 0.00 0.00 179.45 179.35 2cq8 h LEU 98 N 0.75 -0.50 -0.64 2.94 3.38 0.10 -3.16 115.31 118.17 2cq8 h LEU 98 Ca 0.15 -0.10 0.12 0.00 0.09 0.00 0.00 57.88 58.15 2cq8 h LEU 98 Cb 0.39 0.13 -0.12 0.00 0.09 0.00 0.00 40.66 41.14 2cq8 h LEU 98 CO 0.01 -0.16 -0.24 0.03 0.09 0.00 0.00 178.44 178.18 2cq8 h ARG 99 N -0.88 -0.07 0.00 1.13 3.08 0.93 -3.46 114.38 115.10 2cq8 h ARG 99 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2cq8 h ARG 99 Cb 0.57 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2cq8 h ARG 99 CO 0.10 -0.04 0.00 0.41 -1.07 0.00 0.00 179.97 179.37 2cq8 n GLY 100 N -1.45 0.69 1.43 0.04 0.00 -0.70 -5.07 105.19 100.13 2cq8 n GLY 100 Ca 0.07 -0.71 0.17 0.00 0.00 0.00 0.00 46.02 45.56 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 -7.87 -4.81 1.61 2.03 -1.16 -4.83 116.55 101.53 2cq8 n ASP 101 Ca 0.00 1.39 -0.37 0.00 0.52 0.00 0.00 54.79 56.32 2cq8 n ASP 101 Cb 0.00 -4.87 -0.06 0.00 -0.72 0.00 0.00 41.12 35.47 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 -7.23 6.64 -0.46 1.67 1.11 -1.26 -5.00 116.67 112.13 2cq8 s ASP 102 Ca 0.00 0.76 -0.27 0.00 0.18 0.00 0.00 52.55 53.22 2cq8 s ASP 102 Cb 0.00 -2.21 -0.04 0.00 1.07 0.00 0.00 42.92 41.74 2cq8 s ASP 102 CO 0.00 0.25 2.07 -1.61 1.18 0.00 0.00 175.17 177.06 2cq8 s GLU 103 N -0.52 2.67 -0.27 8.23 2.02 -1.26 -4.85 118.70 124.72 2cq8 s GLU 103 Ca 0.21 1.21 -0.36 0.00 0.02 0.00 0.00 54.97 56.04 2cq8 s GLU 103 Cb -0.15 -4.41 0.16 0.00 0.10 0.00 0.00 34.13 29.83 2cq8 s GLU 103 CO 0.09 -2.64 1.35 -1.83 0.02 0.00 0.00 175.26 172.24 2cq8 s GLU 104 N 7.05 0.08 -0.04 1.61 -1.05 -1.26 -5.17 118.70 119.93 2cq8 s GLU 104 Ca 0.84 -0.02 0.04 0.00 -0.15 0.00 0.00 54.97 55.67 2cq8 s GLU 104 Cb -0.19 0.04 -0.00 0.00 -0.44 0.00 0.00 34.13 33.54 2cq8 s GLU 104 CO 0.27 -0.04 -0.17 0.45 0.95 0.00 0.00 175.26 176.72 2cq8 s SER 105 N -1.88 2.14 0.52 0.83 0.15 -1.26 -5.14 113.70 109.06 2cq8 s SER 105 Ca 0.11 -0.35 -0.17 0.00 0.70 0.00 0.00 55.95 56.24 2cq8 s SER 105 Cb -0.01 -0.58 -0.08 0.00 -1.71 0.00 0.00 66.02 63.64 2cq8 s SER 105 CO -0.04 0.15 0.99 -0.83 1.20 0.00 0.00 173.24 174.72 2cq8 s GLY 106 N 0.03 2.08 -0.99 9.45 0.00 -1.26 -4.92 107.32 111.71 2cq8 s GLY 106 Ca -0.03 0.21 -0.07 0.00 0.00 0.00 0.00 44.72 44.83 2cq8 s GLY 106 CO 0.02 0.49 2.56 -1.55 0.00 0.00 0.00 173.10 174.61 2cq8 n PRO 107 N -1.58 2.54 -1.29 2.90 -0.04 -1.26 -4.88 135.00 131.40 2cq8 n PRO 107 Ca 0.07 -1.58 0.16 0.00 -0.04 0.00 0.00 63.50 62.11 2cq8 n PRO 107 Cb 0.54 -2.46 -0.05 0.00 -0.04 0.00 0.00 33.50 31.49 2cq8 n PRO 107 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2cq8 n SER 108 N 3.68 -7.47 0.21 3.54 7.64 -1.26 -5.02 113.62 114.94 2cq8 n SER 108 Ca 0.54 0.71 0.00 0.00 1.01 0.00 0.00 58.87 61.13 2cq8 n SER 108 Cb 0.27 -4.08 0.00 0.00 -1.01 0.00 0.00 64.21 59.39 2cq8 n SER 108 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2cq8 n SER 109 N -4.32 -3.76 0.00 6.43 2.88 -1.26 -5.22 113.62 108.37 2cq8 n SER 109 Ca -0.01 0.81 0.08 0.00 -1.33 0.00 0.00 58.87 58.42 2cq8 n SER 109 Cb 0.65 3.55 0.47 0.00 -0.75 0.00 0.00 64.21 68.14 2cq8 n SER 109 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42