#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 6.24 -0.10 1.61 0.01 -1.26 -4.94 113.70 115.26 2cq8 s SER 2 Ca 0.00 -0.44 -0.04 0.00 1.31 0.00 0.00 55.95 56.78 2cq8 s SER 2 Cb 0.00 -2.25 -0.03 0.00 0.21 0.00 0.00 66.02 63.95 2cq8 s SER 2 CO 0.00 -0.57 0.14 0.28 0.41 0.00 0.00 173.24 173.50 2cq8 h SER 3 N 8.67 -0.03 0.00 2.44 0.02 -2.06 -3.49 113.55 119.09 2cq8 h SER 3 Ca -0.27 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 2cq8 h SER 3 Cb 1.11 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.66 2cq8 h SER 3 CO 0.80 0.51 0.00 0.61 -1.14 0.00 0.00 176.83 177.61 2cq8 n GLY 4 N 1.65 1.15 3.52 -3.77 0.00 -1.26 -4.94 105.19 101.55 2cq8 n GLY 4 Ca -0.02 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.81 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 -4.00 6.36 0.05 1.61 0.01 -1.26 -4.45 113.70 112.02 2cq8 s SER 5 Ca 0.00 -0.27 0.00 0.00 1.31 0.00 0.00 55.95 56.99 2cq8 s SER 5 Cb 0.00 -2.35 0.00 0.00 0.21 0.00 0.00 66.02 63.88 2cq8 s SER 5 CO 0.00 -0.87 0.00 -0.24 0.41 0.00 0.00 173.24 172.54 2cq8 n SER 6 N 6.51 -0.43 0.00 2.44 2.88 -1.26 -5.15 113.62 118.61 2cq8 n SER 6 Ca 0.00 0.47 0.00 0.00 -1.33 0.00 0.00 58.87 58.01 2cq8 n SER 6 Cb 0.48 0.78 0.00 0.00 -0.75 0.00 0.00 64.21 64.72 2cq8 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cq8 n GLY 7 N -1.06 0.46 3.69 0.46 0.00 -1.26 -5.01 105.19 102.47 2cq8 n GLY 7 Ca 0.00 -1.61 -0.34 0.00 0.00 0.00 0.00 46.02 44.07 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 -2.99 3.13 -0.10 1.61 0.40 -1.26 -4.97 117.98 113.81 2cq8 s PHE 8 Ca 0.00 0.14 -0.11 0.00 -0.60 0.00 0.00 56.93 56.36 2cq8 s PHE 8 Cb 0.00 -1.73 -0.09 0.00 0.51 0.00 0.00 43.02 41.71 2cq8 s PHE 8 CO 0.00 0.47 0.37 0.74 0.70 0.00 0.00 175.22 177.50 2cq8 h PHE 9 N 4.69 -0.08 0.00 0.36 0.04 -2.04 -3.47 116.94 116.44 2cq8 h PHE 9 Ca -0.50 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.27 2cq8 h PHE 9 Cb 1.18 0.03 0.00 0.00 2.20 0.00 0.00 35.95 39.36 2cq8 h PHE 9 CO 0.62 0.24 0.00 1.63 -0.60 0.00 0.00 178.31 180.20 2cq8 n LYS 10 N -4.79 0.00 0.00 1.51 5.02 -1.26 -5.10 118.16 113.54 2cq8 n LYS 10 Ca -0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.25 2cq8 n LYS 10 Cb 0.17 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.18 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 1.28 2.26 3.53 0.72 0.00 -1.26 -4.96 105.19 106.76 2cq8 n GLY 11 Ca 0.00 -0.76 0.01 0.00 0.00 0.00 0.00 46.02 45.27 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 -0.48 -2.64 0.47 4.61 0.00 -1.26 -5.15 121.76 117.32 2cq8 s ALA 12 Ca 0.00 2.04 0.00 0.00 0.00 0.00 0.00 51.96 54.00 2cq8 s ALA 12 Cb 0.00 -1.95 0.00 0.00 0.00 0.00 0.00 23.12 21.17 2cq8 s ALA 12 CO 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 175.76 175.21 2cq8 n ALA 13 N 3.90 -3.55 0.07 0.00 0.00 -1.26 -4.38 120.51 115.29 2cq8 n ALA 13 Ca -0.14 0.70 -0.15 0.00 0.00 0.00 0.00 53.44 53.85 2cq8 n ALA 13 Cb 0.56 -1.39 -0.08 0.00 0.00 0.00 0.00 19.45 18.54 2cq8 n ALA 13 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2cq8 h SER 14 N -1.37 -1.44 -3.22 0.00 0.02 -2.01 -3.48 113.55 102.05 2cq8 h SER 14 Ca -0.11 0.17 0.34 0.00 -0.84 0.00 0.00 61.79 61.34 2cq8 h SER 14 Cb 1.29 0.55 -0.14 0.00 0.14 0.00 0.00 62.40 64.24 2cq8 h SER 14 CO 0.05 -0.50 -0.90 -0.24 -1.14 0.00 0.00 176.83 174.10 2cq8 n SER 15 N -5.46 -7.81 -4.03 3.07 2.88 -1.26 -4.97 113.62 96.05 2cq8 n SER 15 Ca -0.07 1.03 -0.13 0.00 -1.33 0.00 0.00 58.87 58.37 2cq8 n SER 15 Cb 0.39 -4.50 -0.12 0.00 -0.75 0.00 0.00 64.21 59.23 2cq8 n SER 15 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2cq8 s VAL 16 N -3.50 0.45 0.04 2.46 1.01 -1.26 -5.14 120.40 114.45 2cq8 s VAL 16 Ca 0.00 -0.88 -0.16 0.00 0.00 0.00 0.00 61.98 60.94 2cq8 s VAL 16 Cb 0.00 -0.50 -0.06 0.00 0.00 0.00 0.00 36.38 35.82 2cq8 s VAL 16 CO 0.00 -0.30 0.47 -0.76 0.00 0.00 0.00 175.10 174.50 2cq8 s LEU 17 N -1.28 4.47 -0.24 3.92 1.43 -1.26 -5.06 118.68 120.66 2cq8 s LEU 17 Ca -0.08 1.05 -0.11 0.00 -1.03 0.00 0.00 54.13 53.95 2cq8 s LEU 17 Cb -0.08 -2.76 -0.05 0.00 0.03 0.00 0.00 46.19 43.33 2cq8 s LEU 17 CO 0.00 0.28 0.18 -1.83 0.23 0.00 0.00 176.35 175.22 2cq8 s GLU 18 N -1.22 4.07 1.10 1.70 -1.05 -1.26 -5.00 118.70 117.04 2cq8 s GLU 18 Ca 0.27 -0.23 -0.18 0.00 -0.15 0.00 0.00 54.97 54.67 2cq8 s GLU 18 Cb -0.17 -3.55 0.29 0.00 -0.44 0.00 0.00 34.13 30.25 2cq8 s GLU 18 CO 0.16 0.03 0.65 1.28 0.95 0.00 0.00 175.26 178.33 2cq8 n LEU 19 N 4.38 0.00 -3.95 1.83 7.99 -1.26 -5.06 117.00 120.92 2cq8 n LEU 19 Ca -0.14 -0.66 -0.08 0.00 -0.01 0.00 0.00 56.01 55.12 2cq8 n LEU 19 Cb 0.52 -0.74 -0.09 0.00 -0.11 0.00 0.00 43.42 43.00 2cq8 n LEU 19 CO 0.35 -2.51 -0.21 0.42 -1.51 0.00 0.00 177.39 173.93 2cq8 s THR 20 N -1.82 0.17 0.58 -5.08 -4.23 -1.26 -4.87 115.64 99.13 2cq8 s THR 20 Ca 0.50 -1.38 0.39 0.00 -1.18 0.00 0.00 61.69 60.01 2cq8 s THR 20 Cb -0.09 -1.31 0.57 0.00 1.34 0.00 0.00 72.50 73.01 2cq8 s THR 20 CO 0.42 -0.76 1.50 -0.08 -0.54 0.00 0.00 174.62 175.15 2cq8 h GLU 21 N 3.08 0.00 0.00 3.99 4.81 -1.98 1.70 114.58 126.17 2cq8 h GLU 21 Ca -0.34 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 2cq8 h GLU 21 Cb 1.18 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.56 2cq8 h GLU 21 CO 0.58 0.00 -0.49 0.00 -0.73 0.00 0.00 179.01 178.38 2cq8 n ALA 22 N -2.61 0.43 -0.18 2.92 0.00 -1.26 -4.14 120.51 115.67 2cq8 n ALA 22 Ca 0.33 -0.41 -0.01 0.00 0.00 0.00 0.00 53.44 53.34 2cq8 n ALA 22 Cb 1.70 0.01 0.07 0.00 0.00 0.00 0.00 19.45 21.23 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 -0.89 0.08 -0.98 0.00 4.39 -1.28 0.12 114.58 116.01 2cq8 h GLU 23 Ca 0.00 -0.00 0.31 0.00 0.34 0.00 0.00 59.36 60.01 2cq8 h GLU 23 Cb 0.49 -0.02 -0.18 0.00 -0.10 0.00 0.00 28.75 28.94 2cq8 h GLU 23 CO 0.00 0.05 0.19 -0.07 -1.16 0.00 0.00 179.01 178.02 2cq8 h LEU 24 N 0.08 -0.21 -0.26 1.33 3.38 0.22 1.83 115.31 121.68 2cq8 h LEU 24 Ca 0.28 0.27 -0.05 0.00 0.09 0.00 0.00 57.88 58.46 2cq8 h LEU 24 Cb 0.43 0.41 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 2cq8 h LEU 24 CO -0.49 -0.36 -0.04 0.58 0.09 0.00 0.00 178.44 178.21 2cq8 h VAL 25 N 0.03 1.28 -0.52 1.22 2.07 -0.94 -1.98 116.25 117.40 2cq8 h VAL 25 Ca 0.67 -1.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 2cq8 h VAL 25 Cb 1.51 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 32.67 2cq8 h VAL 25 CO -0.86 0.32 0.29 0.74 0.02 0.00 0.00 177.57 178.09 2cq8 h THR 26 N 0.25 1.17 -0.54 2.57 2.02 0.27 -0.45 112.91 118.20 2cq8 h THR 26 Ca 0.07 -0.41 0.05 0.00 0.77 0.00 0.00 66.41 66.88 2cq8 h THR 26 Cb 0.50 0.50 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 2cq8 h THR 26 CO 0.02 0.18 0.36 0.00 0.37 0.00 0.00 175.52 176.45 2cq8 h ALA 27 N 1.13 1.81 -0.04 6.16 0.00 0.20 0.69 119.26 129.21 2cq8 h ALA 27 Ca 0.18 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 2cq8 h ALA 27 Cb 0.03 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2cq8 h ALA 27 CO -0.03 0.11 -0.67 0.93 0.00 0.00 0.00 179.25 179.59 2cq8 h GLU 28 N 0.55 0.17 -0.33 0.00 5.08 -0.51 -2.59 114.58 116.94 2cq8 h GLU 28 Ca 0.23 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 2cq8 h GLU 28 Cb 0.21 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2cq8 h GLU 28 CO -0.06 0.78 0.07 0.00 -1.00 0.00 0.00 179.01 178.80 2cq8 h ALA 29 N 1.19 0.44 -0.82 3.43 0.00 0.69 -2.56 119.26 121.63 2cq8 h ALA 29 Ca -0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 2cq8 h ALA 29 Cb 1.20 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 2cq8 h ALA 29 CO 0.10 0.12 0.51 0.28 0.00 0.00 0.00 179.25 180.25 2cq8 h VAL 30 N 0.38 1.22 -0.82 0.00 2.07 -1.21 -1.97 116.25 115.93 2cq8 h VAL 30 Ca 0.10 -0.47 0.14 0.00 0.82 0.00 0.00 66.70 67.30 2cq8 h VAL 30 Cb 0.31 0.06 -0.09 0.00 -1.52 0.00 0.00 31.29 30.06 2cq8 h VAL 30 CO 0.00 0.23 0.41 -0.09 0.02 0.00 0.00 177.57 178.14 2cq8 h ARG 31 N 1.12 0.59 -0.59 1.57 2.43 -1.12 0.31 114.38 118.69 2cq8 h ARG 31 Ca 0.29 -0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.49 2cq8 h ARG 31 Cb -0.07 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.32 2cq8 h ARG 31 CO -0.06 0.39 0.39 1.03 -1.51 0.00 0.00 179.97 180.21 2cq8 h SER 32 N 0.61 0.51 0.67 -3.80 0.87 -0.97 0.39 113.55 111.82 2cq8 h SER 32 Ca 0.44 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.97 2cq8 h SER 32 Cb 0.61 -0.11 0.01 0.00 -0.44 0.00 0.00 62.40 62.47 2cq8 h SER 32 CO -0.35 0.33 -0.32 0.58 -0.53 0.00 0.00 176.83 176.54 2cq8 h VAL 33 N 0.58 0.30 0.00 2.23 2.07 -0.26 0.69 116.25 121.87 2cq8 h VAL 33 Ca 0.25 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 67.68 2cq8 h VAL 33 Cb 0.25 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.31 2cq8 h VAL 33 CO -0.07 0.02 -0.32 -0.50 0.02 0.00 0.00 177.57 176.71 2cq8 h TRP 34 N -0.99 -0.88 0.10 1.57 4.06 -0.93 0.21 115.95 119.08 2cq8 h TRP 34 Ca -0.09 0.03 0.01 0.00 2.06 0.00 0.00 58.89 60.90 2cq8 h TRP 34 Cb 0.71 0.39 -0.04 0.00 -1.00 0.00 0.00 29.16 29.22 2cq8 h TRP 34 CO -0.01 -0.41 -0.46 1.96 -3.56 0.00 0.00 178.44 175.96 2cq8 h GLN 35 N -0.47 -0.62 -1.15 0.49 1.08 -0.85 1.22 115.11 114.80 2cq8 h GLN 35 Ca 0.06 0.04 0.32 0.00 -1.45 0.00 0.00 58.65 57.63 2cq8 h GLN 35 Cb 0.56 0.14 -0.09 0.00 -0.05 0.00 0.00 27.48 28.04 2cq8 h GLN 35 CO -0.27 -0.41 0.77 0.00 -0.95 0.00 0.00 178.83 177.96 2cq8 h ARG 36 N -0.65 0.22 0.00 1.46 3.08 0.79 -2.85 114.38 116.43 2cq8 h ARG 36 Ca -0.01 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2cq8 h ARG 36 Cb 0.65 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.65 2cq8 h ARG 36 CO -0.25 0.15 0.00 -0.89 -1.07 0.00 0.00 179.97 177.91 2cq8 n ILE 37 N -4.52 0.00 -1.49 2.04 5.41 0.69 -4.69 119.36 116.80 2cq8 n ILE 37 Ca 0.28 0.29 -0.44 0.00 1.00 0.00 0.00 62.75 63.88 2cq8 n ILE 37 Cb 1.10 -0.74 -0.07 0.00 -0.71 0.00 0.00 39.64 39.22 2cq8 n ILE 37 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2cq8 n LEU 38 N -1.10 1.82 0.00 1.39 4.77 0.40 -4.83 117.00 119.45 2cq8 n LEU 38 Ca 0.00 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2cq8 n LEU 38 Cb 0.00 -1.30 0.00 0.00 -2.33 0.00 0.00 43.42 39.79 2cq8 n LEU 38 CO 0.00 -0.99 0.11 -0.81 -1.33 0.00 0.00 177.39 174.37 2cq8 n PRO 39 N 8.54 0.00 -0.58 3.23 -0.04 -1.26 -3.69 135.00 141.20 2cq8 n PRO 39 Ca 0.45 0.39 0.46 0.00 -0.04 0.00 0.00 63.50 64.76 2cq8 n PRO 39 Cb 0.29 -1.02 0.75 0.00 -0.04 0.00 0.00 33.50 33.48 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 0.01 -6.77 0.54 6.56 -1.94 -3.37 116.57 111.60 2cq8 h LYS 40 Ca 0.00 -0.00 -0.52 0.00 -1.06 0.00 0.00 60.65 59.07 2cq8 h LYS 40 Cb 0.00 -0.00 0.05 0.00 -0.57 0.00 0.00 32.23 31.70 2cq8 h LYS 40 CO 0.00 0.01 0.65 0.08 -2.06 0.00 0.00 179.45 178.13 2cq8 s VAL 41 N -5.07 2.98 -0.25 0.50 1.01 -1.24 -4.94 120.40 113.39 2cq8 s VAL 41 Ca -0.06 0.88 -0.10 0.00 0.00 0.00 0.00 61.98 62.69 2cq8 s VAL 41 Cb 0.29 -3.56 -0.16 0.00 0.00 0.00 0.00 36.38 32.95 2cq8 s VAL 41 CO 0.86 0.16 -0.16 0.18 0.00 0.00 0.00 175.10 176.14 2cq8 n LEU 42 N 1.85 2.30 -4.00 3.92 7.99 -1.26 -4.94 117.00 122.87 2cq8 n LEU 42 Ca 0.04 0.20 -0.15 0.00 -0.01 0.00 0.00 56.01 56.08 2cq8 n LEU 42 Cb 0.42 -0.90 -0.13 0.00 -0.11 0.00 0.00 43.42 42.70 2cq8 n LEU 42 CO 0.58 0.66 -0.41 -0.70 -1.51 0.00 0.00 177.39 176.02 2cq8 s GLU 43 N -2.50 0.51 -0.29 3.23 2.12 -1.26 -5.05 118.70 115.46 2cq8 s GLU 43 Ca -0.35 -0.40 -0.10 0.00 0.36 0.00 0.00 54.97 54.48 2cq8 s GLU 43 Cb 0.11 -0.43 -0.03 0.00 0.26 0.00 0.00 34.13 34.04 2cq8 s GLU 43 CO 0.56 0.11 0.17 0.08 -0.54 0.00 0.00 175.26 175.64 2cq8 s VAL 44 N -0.54 4.94 0.38 3.70 1.01 -1.26 -5.03 120.40 123.60 2cq8 s VAL 44 Ca -0.01 -0.11 0.05 0.00 0.00 0.00 0.00 61.98 61.91 2cq8 s VAL 44 Cb -0.05 -3.42 0.05 0.00 0.00 0.00 0.00 36.38 32.96 2cq8 s VAL 44 CO 0.00 0.18 0.41 -1.84 0.00 0.00 0.00 175.10 173.85 2cq8 n GLU 45 N 5.02 0.84 0.20 2.72 0.00 -1.26 -4.99 120.64 123.17 2cq8 n GLU 45 Ca -0.14 -2.17 0.12 0.00 0.00 0.00 0.00 57.16 54.97 2cq8 n GLU 45 Cb 0.51 0.03 0.22 0.00 0.00 0.00 0.00 31.44 32.20 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 0.24 0.00 0.05 -1.84 3.04 -1.98 -2.94 116.42 112.99 2cq8 h ASP 46 Ca -0.20 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.59 2cq8 h ASP 46 Cb 0.84 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.13 2cq8 h ASP 46 CO 0.31 0.00 -0.26 -1.20 -2.04 0.00 0.00 179.24 176.05 2cq8 n SER 47 N -2.93 1.90 -4.73 4.15 7.64 -1.26 -2.81 113.62 115.58 2cq8 n SER 47 Ca 0.04 -1.46 -0.42 0.00 1.01 0.00 0.00 58.87 58.05 2cq8 n SER 47 Cb 0.51 0.23 -0.03 0.00 -1.01 0.00 0.00 64.21 63.90 2cq8 n SER 47 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2cq8 s THR 48 N -2.32 3.60 -0.26 0.44 2.01 -1.11 -4.93 115.64 113.06 2cq8 s THR 48 Ca 0.25 1.23 -0.10 0.00 0.31 0.00 0.00 61.69 63.38 2cq8 s THR 48 Cb 0.19 -3.79 -0.05 0.00 0.01 0.00 0.00 72.50 68.87 2cq8 s THR 48 CO 0.47 0.14 0.16 -0.62 -0.69 0.00 0.00 174.62 174.08 2cq8 s ASP 49 N 0.64 5.90 0.41 3.53 2.15 -1.26 -1.88 116.67 126.16 2cq8 s ASP 49 Ca 0.58 -0.00 0.19 0.00 0.43 0.00 0.00 52.55 53.75 2cq8 s ASP 49 Cb -0.33 -2.08 1.13 0.00 -0.30 0.00 0.00 42.92 41.34 2cq8 s ASP 49 CO 0.33 -0.01 1.78 0.15 -0.17 0.00 0.00 175.17 177.26 2cq8 h PHE 50 N 8.05 0.60 0.00 -5.34 3.57 0.17 0.45 116.94 124.44 2cq8 h PHE 50 Ca -0.36 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.16 2cq8 h PHE 50 Cb 1.18 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.75 2cq8 h PHE 50 CO 0.71 0.07 -0.02 0.74 -2.23 0.00 0.00 178.31 177.58 2cq8 h PHE 51 N 0.37 0.00 -1.11 0.41 0.04 -1.87 -2.30 116.94 112.48 2cq8 h PHE 51 Ca 0.58 0.00 0.42 0.00 2.80 0.00 0.00 57.97 61.76 2cq8 h PHE 51 Cb 1.51 0.00 -0.16 0.00 2.20 0.00 0.00 35.95 39.50 2cq8 h PHE 51 CO -0.00 0.00 0.65 0.87 -0.60 0.00 0.00 178.31 179.22 2cq8 h LYS 52 N -0.26 0.06 0.00 1.51 1.57 -1.88 -0.35 116.57 117.22 2cq8 h LYS 52 Ca 0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2cq8 h LYS 52 Cb 0.02 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2cq8 h LYS 52 CO 0.00 0.04 0.00 0.43 -0.57 0.00 0.00 179.45 179.35 2cq8 n SER 53 N -5.06 0.00 0.00 0.86 7.64 0.16 -4.87 113.62 112.35 2cq8 n SER 53 Ca 0.37 0.88 0.00 0.00 1.01 0.00 0.00 58.87 61.13 2cq8 n SER 53 Cb 1.31 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 64.13 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 -0.92 0.00 3.77 0.23 0.00 -0.15 -4.88 105.19 103.24 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 3.55 0.55 4.61 0.00 -0.87 -4.87 121.76 124.73 2cq8 s ALA 55 Ca 0.00 -0.13 0.04 0.00 0.00 0.00 0.00 51.96 51.87 2cq8 s ALA 55 Cb 0.00 -2.60 0.09 0.00 0.00 0.00 0.00 23.12 20.62 2cq8 s ALA 55 CO 0.00 0.19 0.70 0.00 0.00 0.00 0.00 175.76 176.65 2cq8 n ALA 56 N 2.83 0.60 0.32 0.00 0.00 -1.26 -4.79 120.51 118.21 2cq8 n ALA 56 Ca -0.09 -1.60 0.15 0.00 0.00 0.00 0.00 53.44 51.90 2cq8 n ALA 56 Cb 0.52 0.36 0.65 0.00 0.00 0.00 0.00 19.45 20.98 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 -0.17 0.00 0.21 0.00 4.64 -2.02 -2.34 113.55 113.88 2cq8 h SER 57 Ca -0.23 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.74 2cq8 h SER 57 Cb 0.97 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.03 2cq8 h SER 57 CO 0.29 0.00 -1.94 1.33 -0.87 0.00 0.00 176.83 175.64 2cq8 n VAL 58 N -2.62 1.74 -0.34 0.95 0.24 -1.26 -4.02 118.33 113.02 2cq8 n VAL 58 Ca 0.01 -0.69 0.08 0.00 -2.04 0.00 0.00 64.34 61.69 2cq8 n VAL 58 Cb 0.21 -1.57 0.27 0.00 -1.47 0.00 0.00 33.84 31.28 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 0.06 0.88 -0.53 -1.34 3.58 -1.79 0.71 116.42 117.99 2cq8 h ASP 59 Ca -0.39 0.04 0.10 0.00 0.42 0.00 0.00 57.03 57.20 2cq8 h ASP 59 Cb 2.03 -0.13 -0.10 0.00 1.72 0.00 0.00 39.33 42.84 2cq8 h ASP 59 CO 0.09 0.47 -0.21 0.58 -2.88 0.00 0.00 179.24 177.29 2cq8 h VAL 60 N 0.95 0.35 -0.36 2.25 2.07 -1.64 1.13 116.25 121.00 2cq8 h VAL 60 Ca 0.48 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.89 2cq8 h VAL 60 Cb 0.51 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 2cq8 h VAL 60 CO -0.25 0.00 -0.21 0.58 0.02 0.00 0.00 177.57 177.71 2cq8 h VAL 61 N -0.08 1.29 -0.21 2.57 2.07 -1.34 -2.48 116.25 118.06 2cq8 h VAL 61 Ca 0.25 -1.35 0.05 0.00 0.82 0.00 0.00 66.70 66.47 2cq8 h VAL 61 Cb 0.47 1.38 -0.05 0.00 -1.52 0.00 0.00 31.29 31.57 2cq8 h VAL 61 CO -0.58 0.44 -0.11 -0.09 0.02 0.00 0.00 177.57 177.25 2cq8 h ARG 62 N 0.56 -0.09 0.24 1.57 2.43 0.13 1.32 114.38 120.54 2cq8 h ARG 62 Ca 0.07 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.26 2cq8 h ARG 62 Cb 0.77 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.30 2cq8 h ARG 62 CO 0.06 -0.06 -0.37 1.25 -1.51 0.00 0.00 179.97 179.34 2cq8 h LEU 63 N -0.10 -1.04 -0.10 3.80 5.85 0.13 1.30 115.31 125.15 2cq8 h LEU 63 Ca 0.12 0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.97 2cq8 h LEU 63 Cb 0.27 0.37 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 2cq8 h LEU 63 CO -0.27 -0.48 -0.10 0.58 -0.34 0.00 0.00 178.44 177.82 2cq8 h VAL 64 N -0.68 0.71 -0.29 1.05 2.07 -0.98 -0.39 116.25 117.75 2cq8 h VAL 64 Ca 0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 2cq8 h VAL 64 Cb 0.65 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 31.09 2cq8 h VAL 64 CO -0.14 0.00 -0.03 -0.33 0.02 0.00 0.00 177.57 177.09 2cq8 h GLU 65 N -0.12 0.05 0.12 1.57 4.39 0.22 0.38 114.58 121.19 2cq8 h GLU 65 Ca 0.07 -0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.79 2cq8 h GLU 65 Cb 0.23 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.82 2cq8 h GLU 65 CO -0.18 0.03 -0.50 0.93 -1.16 0.00 0.00 179.01 178.14 2cq8 h GLU 66 N 0.05 -0.70 -0.70 2.33 4.39 0.23 -1.29 114.58 118.88 2cq8 h GLU 66 Ca 0.14 0.05 0.14 0.00 0.34 0.00 0.00 59.36 60.03 2cq8 h GLU 66 Cb 0.20 0.16 -0.10 0.00 -0.10 0.00 0.00 28.75 28.91 2cq8 h GLU 66 CO -0.26 -0.47 0.18 0.28 -1.16 0.00 0.00 179.01 177.58 2cq8 h VAL 67 N -0.73 0.57 -1.35 3.13 2.07 -0.74 0.37 116.25 119.57 2cq8 h VAL 67 Ca 0.00 -0.10 0.47 0.00 0.82 0.00 0.00 66.70 67.89 2cq8 h VAL 67 Cb 0.74 0.26 -0.14 0.00 -1.52 0.00 0.00 31.29 30.63 2cq8 h VAL 67 CO -0.28 0.05 0.86 0.50 0.02 0.00 0.00 177.57 178.73 2cq8 h LYS 68 N 0.29 0.01 -0.02 1.57 1.63 0.28 1.77 116.57 122.11 2cq8 h LYS 68 Ca 0.38 -0.00 -0.14 0.00 -0.85 0.00 0.00 60.65 60.04 2cq8 h LYS 68 Cb 0.62 -0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.25 2cq8 h LYS 68 CO -0.46 0.01 -0.55 0.93 -3.45 0.00 0.00 179.45 175.93 2cq8 h GLU 69 N 0.02 0.41 -0.43 1.90 4.39 -0.08 1.79 114.58 122.57 2cq8 h GLU 69 Ca 0.87 -0.41 0.09 0.00 0.34 0.00 0.00 59.36 60.25 2cq8 h GLU 69 Cb 2.77 0.11 -0.09 0.00 -0.10 0.00 0.00 28.75 31.44 2cq8 h GLU 69 CO -0.49 1.07 -0.22 -0.07 -1.16 0.00 0.00 179.01 178.14 2cq8 h LEU 70 N -0.10 -0.76 0.00 1.33 3.38 0.29 -0.60 115.31 118.85 2cq8 h LEU 70 Ca -0.06 0.17 -0.17 0.00 0.09 0.00 0.00 57.88 57.90 2cq8 h LEU 70 Cb 1.25 0.40 -0.03 0.00 0.09 0.00 0.00 40.66 42.37 2cq8 h LEU 70 CO 0.11 -0.25 -1.11 0.00 0.09 0.00 0.00 178.44 177.28 2cq8 n ASP 72 N -3.09 -3.92 0.00 0.00 2.03 0.59 -4.59 116.55 107.58 2cq8 n ASP 72 Ca -0.06 -0.56 0.00 0.00 0.52 0.00 0.00 54.79 54.70 2cq8 n ASP 72 Cb 0.85 -4.42 0.00 0.00 -0.72 0.00 0.00 41.12 36.83 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 -1.19 0.86 3.93 0.27 0.00 -0.39 -4.99 105.19 103.68 2cq8 n GLY 73 Ca -0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 2cq8 n GLY 73 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2cq8 s LEU 74 N 0.00 3.50 -0.29 0.99 2.96 -1.26 -5.07 118.68 119.51 2cq8 s LEU 74 Ca 0.00 0.52 -0.06 0.00 -0.22 0.00 0.00 54.13 54.36 2cq8 s LEU 74 Cb 0.00 -3.38 0.01 0.00 0.50 0.00 0.00 46.19 43.31 2cq8 s LEU 74 CO 0.00 -0.82 0.07 -1.83 -1.32 0.00 0.00 176.35 172.45 2cq8 s GLU 75 N -4.73 3.11 -0.17 1.98 -1.05 -1.26 -4.89 118.70 111.69 2cq8 s GLU 75 Ca 0.50 -0.84 -0.18 0.00 -0.15 0.00 0.00 54.97 54.30 2cq8 s GLU 75 Cb -0.10 -3.33 0.05 0.00 -0.44 0.00 0.00 34.13 30.30 2cq8 s GLU 75 CO 0.41 -0.42 0.51 -1.17 0.95 0.00 0.00 175.26 175.54 2cq8 s LEU 76 N 1.49 0.06 0.15 1.83 2.96 -1.26 -4.95 118.68 118.96 2cq8 s LEU 76 Ca 0.03 0.94 0.08 0.00 -0.22 0.00 0.00 54.13 54.96 2cq8 s LEU 76 Cb -0.17 1.77 -0.04 0.00 0.50 0.00 0.00 46.19 48.25 2cq8 s LEU 76 CO 0.02 -0.22 -0.17 -1.83 -1.32 0.00 0.00 176.35 172.83 2cq8 s GLU 77 N 0.07 1.19 0.49 1.98 -1.05 -1.26 -5.00 118.70 115.12 2cq8 s GLU 77 Ca -0.02 -1.36 0.29 0.00 -0.15 0.00 0.00 54.97 53.74 2cq8 s GLU 77 Cb -0.03 -1.19 1.37 0.00 -0.44 0.00 0.00 34.13 33.83 2cq8 s GLU 77 CO 0.02 0.24 1.81 -0.91 0.95 0.00 0.00 175.26 177.36 2cq8 h ASN 78 N 3.33 0.17 -0.58 0.83 2.35 -1.99 0.54 115.58 120.24 2cq8 h ASN 78 Ca -0.41 0.03 0.04 0.00 -0.55 0.00 0.00 56.30 55.40 2cq8 h ASN 78 Cb 1.20 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.54 2cq8 h ASN 78 CO 0.51 0.03 0.33 -0.33 -1.65 0.00 0.00 177.43 176.32 2cq8 h GLU 79 N 0.15 0.63 -1.01 0.81 5.08 -1.97 0.42 114.58 118.69 2cq8 h GLU 79 Ca 0.55 -0.04 0.11 0.00 -1.00 0.00 0.00 59.36 58.99 2cq8 h GLU 79 Cb 1.88 -0.14 -0.08 0.00 0.50 0.00 0.00 28.75 30.91 2cq8 h GLU 79 CO -0.12 0.41 0.64 -0.44 -1.00 0.00 0.00 179.01 178.50 2cq8 h ASP 80 N 0.64 0.95 -0.45 1.42 3.32 -0.31 0.23 116.42 122.21 2cq8 h ASP 80 Ca 0.24 0.04 -0.12 0.00 0.02 0.00 0.00 57.03 57.21 2cq8 h ASP 80 Cb 0.08 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2cq8 h ASP 80 CO -0.13 0.52 -0.19 0.58 -1.72 0.00 0.00 179.24 178.31 2cq8 h VAL 81 N 1.03 1.27 0.00 -1.35 2.07 -1.08 0.13 116.25 118.32 2cq8 h VAL 81 Ca 0.49 -1.33 0.00 0.00 0.82 0.00 0.00 66.70 66.67 2cq8 h VAL 81 Cb 0.44 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 2cq8 h VAL 81 CO -0.25 0.46 0.00 1.88 0.02 0.00 0.00 177.57 179.67 2cq8 h TYR 82 N 0.76 0.00 0.02 1.57 0.05 0.11 -3.00 116.97 116.49 2cq8 h TYR 82 Ca 0.11 0.00 -0.31 0.00 0.05 0.00 0.00 58.73 58.57 2cq8 h TYR 82 Cb 0.75 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.45 2cq8 h TYR 82 CO 0.05 0.00 -1.72 -0.12 -1.05 0.00 0.00 178.16 175.32 2cq8 n MET 83 N -2.54 0.61 -3.74 4.88 1.56 0.58 -4.68 117.12 113.79 2cq8 n MET 83 Ca 0.01 0.44 -0.34 0.00 -0.27 0.00 0.00 57.70 57.54 2cq8 n MET 83 Cb 0.22 -1.68 -0.09 0.00 2.15 0.00 0.00 33.22 33.82 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 -2.44 3.94 0.24 -5.12 0.00 0.40 -4.87 121.76 113.92 2cq8 s ALA 84 Ca -0.30 -3.68 0.07 0.00 0.00 0.00 0.00 51.96 48.04 2cq8 s ALA 84 Cb 0.08 -2.59 0.24 0.00 0.00 0.00 0.00 23.12 20.85 2cq8 s ALA 84 CO 0.60 -2.12 1.55 0.66 0.00 0.00 0.00 175.76 176.45 2cq8 h SER 85 N 6.11 0.15 -3.58 0.00 4.64 -1.80 -3.39 113.55 115.69 2cq8 h SER 85 Ca 0.10 -0.09 -0.52 0.00 -0.47 0.00 0.00 61.79 60.81 2cq8 h SER 85 Cb 0.83 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 62.85 2cq8 h SER 85 CO 0.78 0.76 0.16 0.42 -0.87 0.00 0.00 176.83 178.09 2cq8 s THR 86 N -3.59 4.44 0.06 2.95 -4.23 -1.26 0.19 115.64 114.21 2cq8 s THR 86 Ca -0.03 1.53 -0.27 0.00 -1.18 0.00 0.00 61.69 61.74 2cq8 s THR 86 Cb 0.12 -4.00 -0.13 0.00 1.34 0.00 0.00 72.50 69.83 2cq8 s THR 86 CO 0.79 0.34 1.42 0.15 -0.54 0.00 0.00 174.62 176.78 2cq8 h PHE 87 N 3.80 -1.07 -0.88 3.99 3.57 -1.55 0.29 116.94 125.08 2cq8 h PHE 87 Ca -0.47 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.15 2cq8 h PHE 87 Cb 1.20 0.42 -0.13 0.00 2.79 0.00 0.00 35.95 40.23 2cq8 h PHE 87 CO 0.64 -0.50 -0.40 0.41 -2.23 0.00 0.00 178.31 176.22 2cq8 n GLY 88 N -1.42 -1.97 0.21 2.40 0.00 -1.12 0.94 105.19 104.22 2cq8 n GLY 88 Ca -0.09 1.01 -0.15 0.00 0.00 0.00 0.00 46.02 46.79 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 -0.38 -0.24 1.61 3.58 -1.74 -2.71 116.42 116.54 2cq8 h ASP 89 Ca 0.25 -0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.75 2cq8 h ASP 89 Cb 0.47 0.10 -0.07 0.00 1.72 0.00 0.00 39.33 41.55 2cq8 h ASP 89 CO -0.86 -0.26 -0.51 0.15 -2.88 0.00 0.00 179.24 174.88 2cq8 h PHE 90 N -0.47 -1.51 -0.95 0.28 3.57 0.35 -1.15 116.94 117.06 2cq8 h PHE 90 Ca -0.05 0.07 0.13 0.00 3.53 0.00 0.00 57.97 61.65 2cq8 h PHE 90 Cb 0.36 0.69 -0.14 0.00 2.79 0.00 0.00 35.95 39.65 2cq8 h PHE 90 CO -0.05 -0.51 -0.44 0.82 -2.23 0.00 0.00 178.31 175.90 2cq8 h ILE 91 N -0.49 0.01 -0.67 1.41 1.08 0.65 1.26 117.51 120.77 2cq8 h ILE 91 Ca 0.07 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.68 2cq8 h ILE 91 Cb 0.64 0.01 -0.11 0.00 -3.07 0.00 0.00 36.82 34.29 2cq8 h ILE 91 CO -0.49 0.00 0.04 1.56 -0.69 0.00 0.00 178.15 178.56 2cq8 h GLN 92 N -0.03 0.14 -0.23 2.37 1.08 -0.91 1.64 115.11 119.17 2cq8 h GLN 92 Ca 0.28 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.44 2cq8 h GLN 92 Cb 0.54 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.93 2cq8 h GLN 92 CO -0.94 0.09 0.03 1.25 -0.95 0.00 0.00 178.83 178.31 2cq8 h LEU 93 N 0.14 0.37 0.76 1.46 6.46 0.16 -1.27 115.31 123.39 2cq8 h LEU 93 Ca 0.36 -0.27 -0.03 0.00 -0.12 0.00 0.00 57.88 57.82 2cq8 h LEU 93 Cb 0.60 -0.10 0.00 0.00 -0.73 0.00 0.00 40.66 40.44 2cq8 h LEU 93 CO -0.56 0.55 -0.43 0.25 -0.62 0.00 0.00 178.44 177.64 2cq8 h LEU 94 N 0.18 -1.05 -0.94 2.25 5.85 0.34 -0.72 115.31 121.21 2cq8 h LEU 94 Ca 0.07 0.05 0.26 0.00 0.84 0.00 0.00 57.88 59.10 2cq8 h LEU 94 Cb 0.34 0.30 -0.14 0.00 0.37 0.00 0.00 40.66 41.53 2cq8 h LEU 94 CO 0.01 -0.68 0.44 0.58 -0.34 0.00 0.00 178.44 178.45 2cq8 h VAL 95 N -1.10 0.39 -0.85 1.05 2.07 0.23 1.03 116.25 119.08 2cq8 h VAL 95 Ca -0.10 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.29 2cq8 h VAL 95 Cb 0.87 -0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 2cq8 h VAL 95 CO 0.13 0.07 0.51 0.03 0.02 0.00 0.00 177.57 178.32 2cq8 h ARG 96 N 0.36 1.15 -0.37 1.57 3.08 -0.58 0.45 114.38 120.05 2cq8 h ARG 96 Ca 0.63 -0.10 -0.16 0.00 0.07 0.00 0.00 59.98 60.41 2cq8 h ARG 96 Cb 1.29 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 2cq8 h ARG 96 CO -0.57 0.81 -0.40 0.87 -1.07 0.00 0.00 179.97 179.61 2cq8 h LYS 97 N 1.17 0.91 0.73 0.04 1.57 0.23 -2.29 116.57 118.93 2cq8 h LYS 97 Ca 0.30 -0.48 -0.04 0.00 -1.87 0.00 0.00 60.65 58.57 2cq8 h LYS 97 Cb -0.05 0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.29 2cq8 h LYS 97 CO -0.06 1.13 -0.35 -0.07 -0.57 0.00 0.00 179.45 179.53 2cq8 h LEU 98 N 0.74 -0.84 -0.96 2.94 3.38 0.62 -2.93 115.31 118.26 2cq8 h LEU 98 Ca 0.06 0.03 0.29 0.00 0.09 0.00 0.00 57.88 58.35 2cq8 h LEU 98 Cb 0.99 0.22 -0.15 0.00 0.09 0.00 0.00 40.66 41.80 2cq8 h LEU 98 CO 0.10 -0.52 0.42 0.03 0.09 0.00 0.00 178.44 178.56 2cq8 h ARG 99 N -1.15 0.25 0.00 1.13 3.08 -0.17 -3.39 114.38 114.14 2cq8 h ARG 99 Ca -0.10 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.93 2cq8 h ARG 99 Cb 0.76 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.75 2cq8 h ARG 99 CO 0.17 0.17 0.00 0.41 -1.07 0.00 0.00 179.97 179.64 2cq8 n GLY 100 N -1.33 0.89 4.24 0.04 0.00 -0.86 -4.71 105.19 103.46 2cq8 n GLY 100 Ca 0.28 -0.44 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.45 -3.38 1.61 -0.08 -1.18 -4.89 116.55 106.17 2cq8 n ASP 101 Ca 0.00 -1.06 -0.18 0.00 -1.51 0.00 0.00 54.79 52.04 2cq8 n ASP 101 Cb 0.00 -2.57 -0.09 0.00 2.34 0.00 0.00 41.12 40.80 2cq8 n ASP 101 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2cq8 s ASP 102 N -3.50 1.48 0.06 1.67 2.15 -1.26 -5.09 116.67 112.18 2cq8 s ASP 102 Ca 0.61 -1.30 -0.28 0.00 0.43 0.00 0.00 52.55 52.01 2cq8 s ASP 102 Cb -0.34 0.48 0.10 0.00 -0.30 0.00 0.00 42.92 42.86 2cq8 s ASP 102 CO 0.94 -0.31 1.15 -1.61 -0.17 0.00 0.00 175.17 175.16 2cq8 s GLU 103 N 1.77 0.76 0.46 4.34 2.02 -1.26 -5.12 118.70 121.66 2cq8 s GLU 103 Ca 0.14 -0.43 0.06 0.00 0.02 0.00 0.00 54.97 54.77 2cq8 s GLU 103 Cb -0.15 0.25 -0.02 0.00 0.10 0.00 0.00 34.13 34.31 2cq8 s GLU 103 CO -0.15 -0.35 0.24 -1.83 0.02 0.00 0.00 175.26 173.19 2cq8 s GLU 104 N -2.75 2.26 0.27 1.61 -1.05 -1.26 -5.15 118.70 112.64 2cq8 s GLU 104 Ca 0.14 -1.92 -0.18 0.00 -0.15 0.00 0.00 54.97 52.87 2cq8 s GLU 104 Cb 0.02 -2.00 0.01 0.00 -0.44 0.00 0.00 34.13 31.72 2cq8 s GLU 104 CO -0.01 -0.28 0.63 0.45 0.95 0.00 0.00 175.26 177.01 2cq8 s SER 105 N -4.02 -0.18 0.18 0.83 0.15 -1.26 -5.13 113.70 104.28 2cq8 s SER 105 Ca 0.36 -0.75 0.03 0.00 0.70 0.00 0.00 55.95 56.28 2cq8 s SER 105 Cb 0.01 0.68 -0.01 0.00 -1.71 0.00 0.00 66.02 65.00 2cq8 s SER 105 CO 0.21 -1.29 0.09 0.61 1.20 0.00 0.00 173.24 174.06 2cq8 n GLY 106 N -0.44 3.62 3.79 9.45 0.00 -1.26 -5.15 105.19 115.21 2cq8 n GLY 106 Ca -0.03 -1.92 -0.35 0.00 0.00 0.00 0.00 46.02 43.72 2cq8 n GLY 106 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cq8 s PRO 107 N -2.70 3.95 0.37 1.61 0.04 -1.26 -4.85 135.00 132.17 2cq8 s PRO 107 Ca 0.13 1.43 0.00 0.00 0.04 0.00 0.00 61.00 62.61 2cq8 s PRO 107 Cb 0.01 -2.29 0.00 0.00 0.04 0.00 0.00 34.50 32.26 2cq8 s PRO 107 CO 0.09 -0.31 0.00 0.43 0.04 0.00 0.00 177.00 177.25 2cq8 n SER 108 N -0.58 -6.44 -4.68 6.66 7.64 -1.26 -4.75 113.62 110.20 2cq8 n SER 108 Ca 0.07 0.79 -0.35 0.00 1.01 0.00 0.00 58.87 60.40 2cq8 n SER 108 Cb 0.51 -3.91 0.11 0.00 -1.01 0.00 0.00 64.21 59.91 2cq8 n SER 108 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2cq8 n SER 109 N -4.25 1.09 -0.17 6.43 3.41 -1.26 -5.19 113.62 113.67 2cq8 n SER 109 Ca -0.03 0.65 0.15 0.00 -0.26 0.00 0.00 58.87 59.38 2cq8 n SER 109 Cb 0.63 -1.49 0.80 0.00 -0.26 0.00 0.00 64.21 63.89 2cq8 n SER 109 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49