#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cq8 n SER 2 N 0.00 -1.49 -4.22 1.61 7.64 -1.26 -4.98 113.62 110.93 2cq8 n SER 2 Ca 0.00 1.00 -0.14 0.00 1.01 0.00 0.00 58.87 60.73 2cq8 n SER 2 Cb 0.00 -0.98 -0.10 0.00 -1.01 0.00 0.00 64.21 62.11 2cq8 n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2cq8 s SER 3 N -0.95 1.64 0.00 6.43 0.01 -1.26 -5.10 113.70 114.47 2cq8 s SER 3 Ca 0.62 -0.92 0.00 0.00 1.31 0.00 0.00 55.95 56.96 2cq8 s SER 3 Cb -0.77 -0.00 0.00 0.00 0.21 0.00 0.00 66.02 65.46 2cq8 s SER 3 CO 0.59 -0.30 0.00 0.61 0.41 0.00 0.00 173.24 174.55 2cq8 n GLY 4 N 0.17 1.34 2.65 3.44 0.00 -1.26 -5.06 105.19 106.46 2cq8 n GLY 4 Ca -0.13 -1.51 -0.04 0.00 0.00 0.00 0.00 46.02 44.34 2cq8 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2cq8 n SER 5 N -0.16 -3.13 -4.91 1.61 2.88 -1.26 -4.98 113.62 103.67 2cq8 n SER 5 Ca 0.00 1.32 -0.27 0.00 -1.33 0.00 0.00 58.87 58.59 2cq8 n SER 5 Cb 0.00 -4.24 0.00 0.00 -0.75 0.00 0.00 64.21 59.22 2cq8 n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2cq8 s SER 6 N -0.47 6.19 0.00 -3.46 0.15 -1.26 -5.02 113.70 109.82 2cq8 s SER 6 Ca -0.18 0.87 0.00 0.00 0.70 0.00 0.00 55.95 57.34 2cq8 s SER 6 Cb 0.01 -2.17 0.00 0.00 -1.71 0.00 0.00 66.02 62.16 2cq8 s SER 6 CO 0.48 -0.62 0.00 0.61 1.20 0.00 0.00 173.24 174.91 2cq8 n GLY 7 N -2.27 -1.82 3.61 9.45 0.00 -1.26 -5.16 105.19 107.74 2cq8 n GLY 7 Ca 0.01 0.77 -0.34 0.00 0.00 0.00 0.00 46.02 46.45 2cq8 n GLY 7 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2cq8 s PHE 8 N 0.00 3.19 -0.29 1.61 5.36 -1.26 -5.08 117.98 121.51 2cq8 s PHE 8 Ca 0.00 0.00 -0.18 0.00 -0.96 0.00 0.00 56.93 55.79 2cq8 s PHE 8 Cb 0.00 -2.00 0.14 0.00 -0.34 0.00 0.00 43.02 40.83 2cq8 s PHE 8 CO 0.00 0.17 1.02 0.12 -1.46 0.00 0.00 175.22 175.06 2cq8 s PHE 9 N 0.14 -0.51 0.19 10.12 2.19 -1.26 -5.14 117.98 123.72 2cq8 s PHE 9 Ca 0.03 1.07 -0.29 0.00 0.33 0.00 0.00 56.93 58.07 2cq8 s PHE 9 Cb -0.13 0.34 -0.17 0.00 -1.31 0.00 0.00 43.02 41.76 2cq8 s PHE 9 CO 0.01 -0.25 0.58 0.36 1.83 0.00 0.00 175.22 177.75 2cq8 n LYS 10 N 3.25 0.07 0.00 10.12 2.85 -1.26 -4.89 118.16 128.30 2cq8 n LYS 10 Ca -0.17 0.02 0.00 0.00 -1.05 0.00 0.00 58.31 57.12 2cq8 n LYS 10 Cb 0.57 -1.07 0.00 0.00 -0.65 0.00 0.00 35.03 33.88 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 1.94 0.81 3.30 2.58 0.00 -1.26 -5.12 105.19 107.44 2cq8 n GLY 11 Ca 0.18 0.37 -0.40 0.00 0.00 0.00 0.00 46.02 46.17 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 0.00 3.25 -0.29 4.61 0.00 -1.26 -4.71 121.76 123.37 2cq8 s ALA 12 Ca 0.00 -1.95 -0.08 0.00 0.00 0.00 0.00 51.96 49.93 2cq8 s ALA 12 Cb 0.00 -2.58 0.01 0.00 0.00 0.00 0.00 23.12 20.55 2cq8 s ALA 12 CO 0.00 -1.52 0.31 0.00 0.00 0.00 0.00 175.76 174.55 2cq8 n ALA 13 N 4.93 -3.12 -2.47 0.00 0.00 -1.26 -5.08 120.51 113.52 2cq8 n ALA 13 Ca -0.11 0.72 -0.24 0.00 0.00 0.00 0.00 53.44 53.80 2cq8 n ALA 13 Cb 0.44 -2.17 -0.08 0.00 0.00 0.00 0.00 19.45 17.64 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 -1.88 2.56 0.05 0.00 1.04 -1.26 -5.05 113.70 109.15 2cq8 s SER 14 Ca 0.13 -1.70 0.00 0.00 0.48 0.00 0.00 55.95 54.86 2cq8 s SER 14 Cb -0.04 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.61 2cq8 s SER 14 CO 0.56 -0.96 0.00 -1.20 0.98 0.00 0.00 173.24 172.62 2cq8 n SER 15 N -1.36 -8.59 -1.56 7.02 7.64 -1.26 -4.92 113.62 110.60 2cq8 n SER 15 Ca -0.03 1.57 0.05 0.00 1.01 0.00 0.00 58.87 61.46 2cq8 n SER 15 Cb 0.64 -4.69 -0.03 0.00 -1.01 0.00 0.00 64.21 59.13 2cq8 n SER 15 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2cq8 n VAL 16 N 1.62 -2.35 -2.81 0.44 0.31 -1.26 -4.90 118.33 109.39 2cq8 n VAL 16 Ca 0.00 1.31 -0.28 0.00 -0.01 0.00 0.00 64.34 65.36 2cq8 n VAL 16 Cb 0.00 -2.14 -0.01 0.00 -0.91 0.00 0.00 33.84 30.78 2cq8 n VAL 16 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2cq8 s LEU 17 N -5.93 3.75 -0.29 7.52 1.43 -1.26 -5.06 118.68 118.83 2cq8 s LEU 17 Ca 0.00 0.94 -0.09 0.00 -1.03 0.00 0.00 54.13 53.95 2cq8 s LEU 17 Cb 0.00 -3.85 -0.01 0.00 0.03 0.00 0.00 46.19 42.35 2cq8 s LEU 17 CO 0.00 -0.47 0.13 -1.61 0.23 0.00 0.00 176.35 174.62 2cq8 s GLU 18 N -4.35 3.45 0.37 1.70 2.02 -1.26 -5.04 118.70 115.59 2cq8 s GLU 18 Ca 0.48 -0.63 -0.06 0.00 0.02 0.00 0.00 54.97 54.77 2cq8 s GLU 18 Cb -0.10 -3.49 0.10 0.00 0.10 0.00 0.00 34.13 30.74 2cq8 s GLU 18 CO 0.39 -0.34 0.23 1.28 0.02 0.00 0.00 175.26 176.85 2cq8 n LEU 19 N 4.96 0.00 -3.86 1.80 7.99 -1.26 -5.07 117.00 121.57 2cq8 n LEU 19 Ca -0.15 -0.24 -0.09 0.00 -0.01 0.00 0.00 56.01 55.52 2cq8 n LEU 19 Cb 0.50 -0.26 -0.06 0.00 -0.11 0.00 0.00 43.42 43.49 2cq8 n LEU 19 CO 0.33 -1.78 0.00 0.42 -1.51 0.00 0.00 177.39 174.85 2cq8 s THR 20 N -1.31 0.09 0.50 -5.08 -4.23 -1.26 -4.88 115.64 99.47 2cq8 s THR 20 Ca 0.17 -1.14 0.40 0.00 -1.18 0.00 0.00 61.69 59.94 2cq8 s THR 20 Cb -0.03 -1.54 0.61 0.00 1.34 0.00 0.00 72.50 72.88 2cq8 s THR 20 CO 0.14 -0.41 1.60 -0.08 -0.54 0.00 0.00 174.62 175.33 2cq8 h GLU 21 N 2.56 0.02 0.00 3.99 4.81 -1.99 1.58 114.58 125.56 2cq8 h GLU 21 Ca -0.33 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 2cq8 h GLU 21 Cb 1.22 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.60 2cq8 h GLU 21 CO 0.50 0.02 -0.51 0.00 -0.73 0.00 0.00 179.01 178.28 2cq8 n ALA 22 N -2.72 0.45 -0.30 2.92 0.00 -1.26 -3.98 120.51 115.62 2cq8 n ALA 22 Ca 0.40 -0.44 0.13 0.00 0.00 0.00 0.00 53.44 53.54 2cq8 n ALA 22 Cb 1.71 0.02 0.29 0.00 0.00 0.00 0.00 19.45 21.47 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 -0.90 0.15 -0.52 0.00 5.08 -1.56 0.55 114.58 117.39 2cq8 h GLU 23 Ca 0.00 -0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.45 2cq8 h GLU 23 Cb 0.51 -0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.63 2cq8 h GLU 23 CO 0.00 0.10 -0.12 -0.07 -1.00 0.00 0.00 179.01 177.92 2cq8 h LEU 24 N 0.16 -0.47 -0.13 1.33 3.38 0.20 0.79 115.31 120.57 2cq8 h LEU 24 Ca 0.56 0.15 0.03 0.00 0.09 0.00 0.00 57.88 58.71 2cq8 h LEU 24 Cb 1.15 0.32 -0.03 0.00 0.09 0.00 0.00 40.66 42.19 2cq8 h LEU 24 CO -0.70 -0.17 -0.05 0.58 0.09 0.00 0.00 178.44 178.19 2cq8 h VAL 25 N 0.00 0.83 -0.58 1.22 2.07 -0.06 -0.69 116.25 119.05 2cq8 h VAL 25 Ca 0.25 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.82 2cq8 h VAL 25 Cb 0.38 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 2cq8 h VAL 25 CO -0.53 0.00 0.30 0.74 0.02 0.00 0.00 177.57 178.10 2cq8 h THR 26 N -0.03 0.95 -0.31 2.57 2.02 -0.07 0.12 112.91 118.16 2cq8 h THR 26 Ca 0.07 -0.19 0.06 0.00 0.77 0.00 0.00 66.41 67.12 2cq8 h THR 26 Cb 0.13 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 2cq8 h THR 26 CO -0.15 0.10 0.22 0.00 0.37 0.00 0.00 175.52 176.06 2cq8 h ALA 27 N 1.31 2.12 0.02 6.16 0.00 0.12 0.13 119.26 129.12 2cq8 h ALA 27 Ca 0.26 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.95 2cq8 h ALA 27 Cb 0.17 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2cq8 h ALA 27 CO -0.18 -0.19 -0.93 0.93 0.00 0.00 0.00 179.25 178.89 2cq8 h GLU 28 N 0.14 0.14 -0.56 0.00 4.39 0.63 -2.63 114.58 116.70 2cq8 h GLU 28 Ca 0.14 -0.18 -0.10 0.00 0.34 0.00 0.00 59.36 59.57 2cq8 h GLU 28 Cb 0.39 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.08 2cq8 h GLU 28 CO -0.02 0.97 -0.03 0.00 -1.16 0.00 0.00 179.01 178.77 2cq8 h ALA 29 N 0.96 0.76 -0.48 3.43 0.00 0.13 -2.40 119.26 121.66 2cq8 h ALA 29 Ca -0.04 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.45 2cq8 h ALA 29 Cb 1.59 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 2cq8 h ALA 29 CO 0.14 0.61 -0.09 0.28 0.00 0.00 0.00 179.25 180.19 2cq8 h VAL 30 N 0.89 1.26 -0.74 0.00 2.07 -1.15 -2.74 116.25 115.84 2cq8 h VAL 30 Ca 0.16 -1.18 0.06 0.00 0.82 0.00 0.00 66.70 66.56 2cq8 h VAL 30 Cb 0.58 0.98 -0.06 0.00 -1.52 0.00 0.00 31.29 31.27 2cq8 h VAL 30 CO 0.03 0.41 0.43 -0.09 0.02 0.00 0.00 177.57 178.37 2cq8 h ARG 31 N 0.79 0.75 -0.63 1.57 2.43 -1.11 0.03 114.38 118.21 2cq8 h ARG 31 Ca 0.13 -0.05 0.07 0.00 -0.81 0.00 0.00 59.98 59.33 2cq8 h ARG 31 Cb 0.59 -0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 29.94 2cq8 h ARG 31 CO 0.04 0.50 0.42 1.03 -1.51 0.00 0.00 179.97 180.45 2cq8 h SER 32 N 0.78 0.51 0.47 -3.80 0.87 -1.13 -0.23 113.55 111.02 2cq8 h SER 32 Ca 0.33 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.87 2cq8 h SER 32 Cb 0.21 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 2cq8 h SER 32 CO -0.19 0.33 -0.23 0.58 -0.53 0.00 0.00 176.83 176.79 2cq8 h VAL 33 N 0.58 0.54 0.35 2.23 2.07 -0.91 0.67 116.25 121.78 2cq8 h VAL 33 Ca 0.28 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.74 2cq8 h VAL 33 Cb 0.34 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 2cq8 h VAL 33 CO -0.09 0.01 -0.45 -0.50 0.02 0.00 0.00 177.57 176.56 2cq8 h TRP 34 N -0.66 -1.26 -0.12 1.57 4.06 -1.00 0.39 115.95 118.93 2cq8 h TRP 34 Ca -0.06 0.02 0.03 0.00 2.06 0.00 0.00 58.89 60.93 2cq8 h TRP 34 Cb 0.50 0.50 -0.06 0.00 -1.00 0.00 0.00 29.16 29.11 2cq8 h TRP 34 CO -0.04 -0.59 -0.49 1.96 -3.56 0.00 0.00 178.44 175.72 2cq8 h GLN 35 N -0.85 -0.51 -0.74 0.49 1.08 -0.97 1.17 115.11 114.78 2cq8 h GLN 35 Ca -0.03 0.03 0.17 0.00 -1.45 0.00 0.00 58.65 57.37 2cq8 h GLN 35 Cb 0.78 0.12 -0.12 0.00 -0.05 0.00 0.00 27.48 28.20 2cq8 h GLN 35 CO -0.12 -0.34 0.05 0.00 -0.95 0.00 0.00 178.83 177.47 2cq8 h ARG 36 N -0.53 0.14 0.00 1.46 3.08 0.62 -2.89 114.38 116.25 2cq8 h ARG 36 Ca 0.03 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2cq8 h ARG 36 Cb 0.62 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.64 2cq8 h ARG 36 CO -0.39 0.09 0.00 -0.89 -1.07 0.00 0.00 179.97 177.71 2cq8 n ILE 37 N -5.29 0.00 -1.67 2.04 5.41 0.13 -4.53 119.36 115.45 2cq8 n ILE 37 Ca 0.13 1.06 -0.43 0.00 1.00 0.00 0.00 62.75 64.52 2cq8 n ILE 37 Cb 0.47 -1.97 -0.03 0.00 -0.71 0.00 0.00 39.64 37.40 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 -2.95 3.53 0.00 1.39 1.43 0.39 -4.88 118.68 117.59 2cq8 s LEU 38 Ca 0.00 1.88 0.00 0.00 -1.03 0.00 0.00 54.13 54.98 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 0.24 -0.81 0.23 0.00 0.00 176.35 174.15 2cq8 n PRO 39 N 8.61 0.00 -0.33 1.29 -0.04 -1.26 -3.86 135.00 139.41 2cq8 n PRO 39 Ca 0.28 0.45 0.24 0.00 -0.04 0.00 0.00 63.50 64.43 2cq8 n PRO 39 Cb 0.45 -1.07 0.46 0.00 -0.04 0.00 0.00 33.50 33.30 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 0.00 -6.13 0.54 1.57 -1.93 -3.37 116.57 107.26 2cq8 h LYS 40 Ca 0.00 -0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.16 2cq8 h LYS 40 Cb 0.00 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2cq8 h LYS 40 CO 0.00 0.00 1.29 0.28 -0.57 0.00 0.00 179.45 180.45 2cq8 n VAL 41 N -5.37 0.43 0.01 0.50 0.31 -1.25 -4.81 118.33 108.15 2cq8 n VAL 41 Ca 0.32 -0.24 -0.06 0.00 -0.01 0.00 0.00 64.34 64.35 2cq8 n VAL 41 Cb 1.06 -2.02 -0.12 0.00 -0.91 0.00 0.00 33.84 31.85 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 11.63 0.00 -7.79 7.52 3.38 -1.87 -3.47 115.31 124.70 2cq8 h LEU 42 Ca -0.41 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.39 2cq8 h LEU 42 Cb 1.27 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.81 2cq8 h LEU 42 CO 0.97 0.88 -0.58 -1.83 0.09 0.00 0.00 178.44 177.97 2cq8 s GLU 43 N -2.70 0.36 -0.28 1.13 -1.05 -1.26 -5.10 118.70 109.80 2cq8 s GLU 43 Ca -0.03 -0.36 0.01 0.00 -0.15 0.00 0.00 54.97 54.44 2cq8 s GLU 43 Cb 0.08 0.15 0.06 0.00 -0.44 0.00 0.00 34.13 33.98 2cq8 s GLU 43 CO 0.82 -0.08 -0.05 0.08 0.95 0.00 0.00 175.26 176.98 2cq8 s VAL 44 N -1.13 2.56 0.52 1.83 1.01 -1.26 -5.01 120.40 118.93 2cq8 s VAL 44 Ca -0.12 -1.54 0.08 0.00 0.00 0.00 0.00 61.98 60.40 2cq8 s VAL 44 Cb -0.07 -2.50 0.04 0.00 0.00 0.00 0.00 36.38 33.85 2cq8 s VAL 44 CO 0.01 -0.08 0.58 -1.83 0.00 0.00 0.00 175.10 173.78 2cq8 s GLU 45 N 1.17 2.40 0.00 2.72 1.03 -1.26 -4.97 118.70 119.79 2cq8 s GLU 45 Ca -0.07 -1.67 0.22 0.00 0.03 0.00 0.00 54.97 53.48 2cq8 s GLU 45 Cb -0.20 -2.47 1.16 0.00 -0.80 0.00 0.00 34.13 31.82 2cq8 s GLU 45 CO -0.03 -0.60 1.69 -0.25 -1.33 0.00 0.00 175.26 174.74 2cq8 n ASP 46 N -1.94 0.00 -0.17 0.83 9.92 -1.26 -1.73 116.55 122.20 2cq8 n ASP 46 Ca 0.08 -0.22 0.06 0.00 -0.53 0.00 0.00 54.79 54.19 2cq8 n ASP 46 Cb 0.62 -0.20 -0.03 0.00 -0.64 0.00 0.00 41.12 40.86 2cq8 n ASP 46 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 2cq8 n SER 47 N -1.20 1.07 -4.67 -2.24 2.88 -1.26 -2.67 113.62 105.53 2cq8 n SER 47 Ca 0.12 -1.03 -0.43 0.00 -1.33 0.00 0.00 58.87 56.20 2cq8 n SER 47 Cb 0.14 0.71 -0.02 0.00 -0.75 0.00 0.00 64.21 64.28 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 -1.90 4.11 -0.13 2.46 2.01 -0.70 -4.90 115.64 116.58 2cq8 s THR 48 Ca 0.08 1.39 -0.22 0.00 0.31 0.00 0.00 61.69 63.26 2cq8 s THR 48 Cb 0.10 -3.90 -0.03 0.00 0.01 0.00 0.00 72.50 68.69 2cq8 s THR 48 CO 0.42 -0.07 0.65 -0.62 -0.69 0.00 0.00 174.62 174.31 2cq8 s ASP 49 N 1.98 6.82 0.65 3.53 2.15 -1.26 -1.64 116.67 128.90 2cq8 s ASP 49 Ca 0.59 0.99 0.37 0.00 0.43 0.00 0.00 52.55 54.93 2cq8 s ASP 49 Cb -0.25 -2.37 2.07 0.00 -0.30 0.00 0.00 42.92 42.07 2cq8 s ASP 49 CO 0.20 -0.19 2.21 0.15 -0.17 0.00 0.00 175.17 177.38 2cq8 h PHE 50 N 7.09 0.00 0.00 -5.34 3.57 0.13 -0.65 116.94 121.73 2cq8 h PHE 50 Ca -0.36 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.14 2cq8 h PHE 50 Cb 1.17 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.91 2cq8 h PHE 50 CO 0.68 0.00 -0.18 1.19 -2.23 0.00 0.00 178.31 177.76 2cq8 n PHE 51 N -3.21 0.23 -0.34 0.41 3.72 -1.26 -3.20 117.46 113.81 2cq8 n PHE 51 Ca -0.02 0.10 0.13 0.00 -0.05 0.00 0.00 57.45 57.61 2cq8 n PHE 51 Cb 0.19 -0.36 0.27 0.00 -0.94 0.00 0.00 39.48 38.64 2cq8 n PHE 51 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2cq8 h LYS 52 N -0.30 0.01 0.00 -1.08 1.57 -1.91 -1.79 116.57 113.07 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 0.18 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.49 2cq8 h LYS 52 CO 0.00 0.01 0.00 0.43 -0.57 0.00 0.00 179.45 179.32 2cq8 n SER 53 N -5.49 0.00 0.00 0.86 7.64 -0.26 -4.80 113.62 111.57 2cq8 n SER 53 Ca 0.22 0.59 0.00 0.00 1.01 0.00 0.00 58.87 60.69 2cq8 n SER 53 Cb 0.72 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.82 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 -0.99 0.00 3.89 0.23 0.00 -0.68 -4.93 105.19 102.70 2cq8 n GLY 54 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 3.82 0.00 4.61 0.00 -1.19 -4.94 121.76 124.05 2cq8 s ALA 55 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 51.96 51.42 2cq8 s ALA 55 Cb 0.00 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 21.01 2cq8 s ALA 55 CO 0.00 0.65 0.00 0.00 0.00 0.00 0.00 175.76 176.41 2cq8 n ALA 56 N 0.75 0.00 1.27 0.00 0.00 -1.26 -4.83 120.51 116.44 2cq8 n ALA 56 Ca -0.08 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.51 2cq8 n ALA 56 Cb 0.52 0.00 0.66 0.00 0.00 0.00 0.00 19.45 20.63 2cq8 n ALA 56 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2cq8 n SER 57 N -1.18 0.12 -0.04 0.00 3.41 -1.26 -3.41 113.62 111.26 2cq8 n SER 57 Ca 0.00 -0.05 -0.21 0.00 -0.26 0.00 0.00 58.87 58.35 2cq8 n SER 57 Cb 0.00 -0.27 -0.13 0.00 -0.26 0.00 0.00 64.21 63.55 2cq8 n SER 57 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2cq8 n VAL 58 N -1.30 1.68 -0.19 -3.33 0.24 -1.26 -4.08 118.33 110.09 2cq8 n VAL 58 Ca 0.12 -0.55 0.16 0.00 -2.04 0.00 0.00 64.34 62.02 2cq8 n VAL 58 Cb 0.28 -1.72 0.49 0.00 -1.47 0.00 0.00 33.84 31.43 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 -0.13 0.42 -0.38 -1.34 5.19 -1.93 0.15 116.42 118.40 2cq8 h ASP 59 Ca -0.46 0.03 0.07 0.00 -0.62 0.00 0.00 57.03 56.05 2cq8 h ASP 59 Cb 1.90 -0.06 -0.07 0.00 0.18 0.00 0.00 39.33 41.29 2cq8 h ASP 59 CO -0.01 0.21 -0.03 0.58 -3.12 0.00 0.00 179.24 176.87 2cq8 h VAL 60 N 0.45 0.67 -0.16 -1.35 2.07 -1.71 1.29 116.25 117.52 2cq8 h VAL 60 Ca 0.40 -0.02 -0.18 0.00 0.82 0.00 0.00 66.70 67.72 2cq8 h VAL 60 Cb 0.89 0.61 -0.00 0.00 -1.52 0.00 0.00 31.29 31.26 2cq8 h VAL 60 CO -0.14 0.01 -0.62 0.58 0.02 0.00 0.00 177.57 177.42 2cq8 h VAL 61 N 0.06 1.33 0.32 2.57 2.07 -1.11 -1.97 116.25 119.52 2cq8 h VAL 61 Ca 0.19 -1.90 -0.02 0.00 0.82 0.00 0.00 66.70 65.79 2cq8 h VAL 61 Cb 0.28 1.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 2cq8 h VAL 61 CO -0.35 0.59 -0.15 -0.09 0.02 0.00 0.00 177.57 177.59 2cq8 h ARG 62 N 0.42 -0.42 -0.38 1.57 2.43 0.63 1.46 114.38 120.10 2cq8 h ARG 62 Ca -0.01 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.22 2cq8 h ARG 62 Cb 1.19 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.80 2cq8 h ARG 62 CO 0.12 -0.25 0.17 1.25 -1.51 0.00 0.00 179.97 179.75 2cq8 h LEU 63 N -0.48 0.23 -0.61 3.80 5.85 0.16 1.54 115.31 125.79 2cq8 h LEU 63 Ca -0.04 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 2cq8 h LEU 63 Cb 0.36 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 2cq8 h LEU 63 CO 0.07 0.17 0.21 0.58 -0.34 0.00 0.00 178.44 179.13 2cq8 h VAL 64 N 0.35 1.24 -0.44 1.05 2.07 -1.13 0.95 116.25 120.34 2cq8 h VAL 64 Ca 0.17 -0.81 -0.07 0.00 0.82 0.00 0.00 66.70 66.80 2cq8 h VAL 64 Cb 0.10 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 2cq8 h VAL 64 CO -0.14 0.31 -0.01 -0.33 0.02 0.00 0.00 177.57 177.42 2cq8 h GLU 65 N 0.87 0.79 0.58 1.57 4.39 0.29 -0.78 114.58 122.30 2cq8 h GLU 65 Ca 0.20 -0.26 -0.03 0.00 0.34 0.00 0.00 59.36 59.61 2cq8 h GLU 65 Cb 0.27 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 28.86 2cq8 h GLU 65 CO -0.01 0.86 -0.28 0.93 -1.16 0.00 0.00 179.01 179.35 2cq8 h GLU 66 N 0.63 -0.75 -0.05 2.33 5.08 0.25 -1.80 114.58 120.26 2cq8 h GLU 66 Ca 0.12 0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.55 2cq8 h GLU 66 Cb 0.52 0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 2cq8 h GLU 66 CO 0.03 -0.47 0.09 0.28 -1.00 0.00 0.00 179.01 177.94 2cq8 h VAL 67 N -0.85 0.30 -0.62 3.13 2.07 -0.81 0.65 116.25 120.12 2cq8 h VAL 67 Ca -0.08 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 2cq8 h VAL 67 Cb 0.63 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 2cq8 h VAL 67 CO 0.13 0.00 0.19 0.11 0.02 0.00 0.00 177.57 178.02 2cq8 h LYS 68 N 0.00 0.96 0.00 1.57 1.57 -0.27 -1.63 116.57 118.78 2cq8 h LYS 68 Ca 0.03 -0.21 -0.03 0.00 -1.87 0.00 0.00 60.65 58.57 2cq8 h LYS 68 Cb 0.21 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 2cq8 h LYS 68 CO -0.00 0.85 -0.13 0.93 -0.57 0.00 0.00 179.45 180.53 2cq8 h GLU 69 N 0.89 0.00 -0.04 3.15 4.39 -0.51 1.82 114.58 124.27 2cq8 h GLU 69 Ca 0.20 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.89 2cq8 h GLU 69 Cb 0.29 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.94 2cq8 h GLU 69 CO -0.01 0.13 -0.01 -0.07 -1.16 0.00 0.00 179.01 177.90 2cq8 h LEU 70 N 0.00 0.08 -1.17 1.33 3.38 -0.99 -2.99 115.31 114.94 2cq8 h LEU 70 Ca -0.00 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2cq8 h LEU 70 Cb 0.65 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2cq8 h LEU 70 CO 0.02 0.43 -0.14 0.00 0.09 0.00 0.00 178.44 178.84 2cq8 n ASP 72 N 0.33 -7.12 -0.10 0.00 2.03 0.41 -4.42 116.55 107.69 2cq8 n ASP 72 Ca 0.14 -0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.32 2cq8 n ASP 72 Cb 0.45 -4.88 0.00 0.00 -0.72 0.00 0.00 41.12 35.97 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 -1.64 0.95 3.70 0.27 0.00 0.52 -4.96 105.19 104.02 2cq8 n GLY 73 Ca -0.01 -0.12 -0.44 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.10 3.66 -3.36 0.99 7.94 -1.13 -4.81 117.00 120.20 2cq8 n LEU 74 Ca 0.00 1.08 -0.31 0.00 -1.11 0.00 0.00 56.01 55.67 2cq8 n LEU 74 Cb 0.09 -1.52 -0.03 0.00 0.53 0.00 0.00 43.42 42.50 2cq8 n LEU 74 CO 0.00 -0.01 2.41 -0.62 -1.11 0.00 0.00 177.39 178.06 2cq8 n GLU 75 N 3.59 2.12 -4.11 1.96 1.02 -1.26 -4.80 120.64 119.15 2cq8 n GLU 75 Ca 0.16 -1.72 -0.22 0.00 -0.02 0.00 0.00 57.16 55.36 2cq8 n GLU 75 Cb 0.33 -2.68 -0.05 0.00 -0.02 0.00 0.00 31.44 29.02 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 0.57 3.69 0.01 -4.62 2.96 -1.26 -5.05 118.68 114.98 2cq8 s LEU 76 Ca 0.48 -0.35 -0.10 0.00 -0.22 0.00 0.00 54.13 53.94 2cq8 s LEU 76 Cb 0.12 -2.22 0.01 0.00 0.50 0.00 0.00 46.19 44.60 2cq8 s LEU 76 CO 0.00 -0.07 0.21 -1.83 -1.32 0.00 0.00 176.35 173.35 2cq8 s GLU 77 N -3.83 0.63 0.46 1.98 -1.05 -1.26 -5.01 118.70 110.61 2cq8 s GLU 77 Ca 0.33 -0.44 0.31 0.00 -0.15 0.00 0.00 54.97 55.02 2cq8 s GLU 77 Cb -0.07 0.27 1.41 0.00 -0.44 0.00 0.00 34.13 35.29 2cq8 s GLU 77 CO 0.24 -0.17 1.67 -0.91 0.95 0.00 0.00 175.26 177.04 2cq8 h ASN 78 N 3.80 0.22 -0.27 0.83 -0.26 -1.99 0.86 115.58 118.78 2cq8 h ASN 78 Ca -0.31 0.09 0.04 0.00 -0.56 0.00 0.00 56.30 55.56 2cq8 h ASN 78 Cb 1.19 0.07 -0.04 0.00 -1.06 0.00 0.00 38.32 38.48 2cq8 h ASN 78 CO 0.44 -0.08 0.03 -0.33 -1.06 0.00 0.00 177.43 176.43 2cq8 h GLU 79 N 0.13 0.12 -0.77 0.81 5.08 -1.97 -0.85 114.58 117.12 2cq8 h GLU 79 Ca 0.75 -0.01 0.17 0.00 -1.00 0.00 0.00 59.36 59.28 2cq8 h GLU 79 Cb 2.44 -0.03 -0.14 0.00 0.50 0.00 0.00 28.75 31.53 2cq8 h GLU 79 CO -0.28 0.08 -0.04 0.38 -1.00 0.00 0.00 179.01 178.14 2cq8 h ASP 80 N 0.12 -0.45 -0.14 1.42 2.03 0.36 0.83 116.42 120.59 2cq8 h ASP 80 Ca 0.12 0.21 -0.00 0.00 -0.73 0.00 0.00 57.03 56.63 2cq8 h ASP 80 Cb 0.14 0.39 -0.01 0.00 -0.83 0.00 0.00 39.33 39.02 2cq8 h ASP 80 CO -0.18 -0.21 0.07 0.58 -1.03 0.00 0.00 179.24 178.47 2cq8 h VAL 81 N 0.07 1.10 0.00 4.15 2.07 -1.28 0.78 116.25 123.14 2cq8 h VAL 81 Ca 0.41 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.64 2cq8 h VAL 81 Cb 0.72 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 2cq8 h VAL 81 CO -0.71 0.10 0.00 1.88 0.02 0.00 0.00 177.57 178.85 2cq8 h TYR 82 N 0.12 0.00 0.04 1.57 0.05 0.10 -2.57 116.97 116.28 2cq8 h TYR 82 Ca 0.05 0.00 -0.35 0.00 0.05 0.00 0.00 58.73 58.48 2cq8 h TYR 82 Cb 0.09 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 37.79 2cq8 h TYR 82 CO -0.04 0.00 -1.95 -0.12 -1.05 0.00 0.00 178.16 175.00 2cq8 n MET 83 N -2.67 0.64 -3.84 4.88 1.56 0.25 -4.71 117.12 113.22 2cq8 n MET 83 Ca -0.01 0.35 -0.32 0.00 -0.27 0.00 0.00 57.70 57.45 2cq8 n MET 83 Cb 0.10 -1.64 -0.11 0.00 2.15 0.00 0.00 33.22 33.72 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 -2.48 3.67 0.12 -5.12 0.00 0.26 -4.90 121.76 113.32 2cq8 s ALA 84 Ca -0.30 -3.55 -0.10 0.00 0.00 0.00 0.00 51.96 48.01 2cq8 s ALA 84 Cb 0.09 -2.36 -0.10 0.00 0.00 0.00 0.00 23.12 20.74 2cq8 s ALA 84 CO 0.62 -2.08 1.35 0.66 0.00 0.00 0.00 175.76 176.31 2cq8 h SER 85 N 6.16 0.86 -3.96 0.00 4.64 -1.76 -3.39 113.55 116.11 2cq8 h SER 85 Ca 0.04 -0.55 -0.46 0.00 -0.47 0.00 0.00 61.79 60.35 2cq8 h SER 85 Cb 0.85 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.67 2cq8 h SER 85 CO 0.73 1.34 0.36 0.42 -0.87 0.00 0.00 176.83 178.80 2cq8 s THR 86 N -3.79 4.17 0.08 2.95 -4.23 -1.26 0.17 115.64 113.73 2cq8 s THR 86 Ca -0.09 1.61 -0.29 0.00 -1.18 0.00 0.00 61.69 61.73 2cq8 s THR 86 Cb 0.09 -3.80 -0.17 0.00 1.34 0.00 0.00 72.50 69.96 2cq8 s THR 86 CO 0.89 -0.04 1.66 0.15 -0.54 0.00 0.00 174.62 176.74 2cq8 h PHE 87 N 2.60 -0.58 -0.72 3.99 3.57 -1.49 0.19 116.94 124.49 2cq8 h PHE 87 Ca -0.48 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.11 2cq8 h PHE 87 Cb 1.19 0.20 -0.12 0.00 2.79 0.00 0.00 35.95 40.01 2cq8 h PHE 87 CO 0.61 -0.36 -0.45 0.78 -2.23 0.00 0.00 178.31 176.67 2cq8 h GLY 88 N -0.60 -0.40 0.93 2.40 0.00 -1.70 0.87 103.07 104.58 2cq8 h GLY 88 Ca -0.05 0.59 -0.02 0.00 0.00 0.00 0.00 47.33 47.84 2cq8 h GLY 88 CO 0.08 -0.14 -0.20 -1.80 0.00 0.00 0.00 176.54 174.48 2cq8 h ASP 89 N -0.15 -0.47 -0.55 0.19 1.82 -1.74 -2.82 116.42 112.69 2cq8 h ASP 89 Ca 0.21 -0.03 0.09 0.00 -0.39 0.00 0.00 57.03 56.92 2cq8 h ASP 89 Cb 0.55 0.12 -0.11 0.00 0.68 0.00 0.00 39.33 40.58 2cq8 h ASP 89 CO -0.78 -0.28 -0.39 0.15 -1.61 0.00 0.00 179.24 176.33 2cq8 h PHE 90 N -0.63 -1.10 -0.68 0.28 3.57 0.83 -0.71 116.94 118.49 2cq8 h PHE 90 Ca -0.06 0.07 0.08 0.00 3.53 0.00 0.00 57.97 61.59 2cq8 h PHE 90 Cb 0.47 0.56 -0.10 0.00 2.79 0.00 0.00 35.95 39.67 2cq8 h PHE 90 CO -0.03 -0.41 -0.54 0.82 -2.23 0.00 0.00 178.31 175.93 2cq8 h ILE 91 N -0.22 0.02 -0.80 1.41 1.08 0.81 1.07 117.51 120.88 2cq8 h ILE 91 Ca 0.19 0.00 0.19 0.00 -0.39 0.00 0.00 64.86 64.85 2cq8 h ILE 91 Cb 0.56 0.02 -0.14 0.00 -3.07 0.00 0.00 36.82 34.19 2cq8 h ILE 91 CO -0.66 0.00 0.02 1.56 -0.69 0.00 0.00 178.15 178.38 2cq8 h GLN 92 N -0.20 0.10 -0.13 2.37 7.50 -0.91 1.51 115.11 125.34 2cq8 h GLN 92 Ca 0.14 -0.01 -0.01 0.00 0.50 0.00 0.00 58.65 59.27 2cq8 h GLN 92 Cb 0.53 -0.02 -0.01 0.00 0.05 0.00 0.00 27.48 28.03 2cq8 h GLN 92 CO -0.76 0.06 0.02 1.25 -1.50 0.00 0.00 178.83 177.91 2cq8 h LEU 93 N 0.10 0.20 0.73 1.46 6.46 0.64 -1.25 115.31 123.66 2cq8 h LEU 93 Ca 0.45 -0.25 -0.03 0.00 -0.12 0.00 0.00 57.88 57.93 2cq8 h LEU 93 Cb 0.82 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.69 2cq8 h LEU 93 CO -0.70 0.40 -0.47 0.25 -0.62 0.00 0.00 178.44 177.30 2cq8 h LEU 94 N -0.00 -1.20 -1.01 2.25 5.85 0.44 -0.91 115.31 120.72 2cq8 h LEU 94 Ca 0.04 0.07 0.32 0.00 0.84 0.00 0.00 57.88 59.15 2cq8 h LEU 94 Cb 0.28 0.35 -0.15 0.00 0.37 0.00 0.00 40.66 41.52 2cq8 h LEU 94 CO 0.00 -0.71 0.58 0.58 -0.34 0.00 0.00 178.44 178.55 2cq8 h VAL 95 N -1.13 0.32 -0.47 1.05 2.07 0.19 1.05 116.25 119.34 2cq8 h VAL 95 Ca -0.10 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 2cq8 h VAL 95 Cb 0.91 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 2cq8 h VAL 95 CO 0.08 0.06 0.29 0.03 0.02 0.00 0.00 177.57 178.06 2cq8 h ARG 96 N 0.35 0.63 -0.14 1.57 3.08 -0.40 0.71 114.38 120.17 2cq8 h ARG 96 Ca 0.73 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 60.61 2cq8 h ARG 96 Cb 1.65 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 31.55 2cq8 h ARG 96 CO -0.59 0.45 -0.42 0.87 -1.07 0.00 0.00 179.97 179.20 2cq8 h LYS 97 N 0.62 0.33 0.44 0.04 1.57 0.22 -2.38 116.57 117.41 2cq8 h LYS 97 Ca 0.17 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2cq8 h LYS 97 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.29 2cq8 h LYS 97 CO -0.03 0.70 -0.21 -0.07 -0.57 0.00 0.00 179.45 179.27 2cq8 h LEU 98 N 0.28 -0.50 -0.66 2.94 3.38 0.79 -0.98 115.31 120.55 2cq8 h LEU 98 Ca 0.02 -0.09 0.13 0.00 0.09 0.00 0.00 57.88 58.03 2cq8 h LEU 98 Cb 0.87 0.13 -0.13 0.00 0.09 0.00 0.00 40.66 41.62 2cq8 h LEU 98 CO 0.07 -0.10 -0.24 0.03 0.09 0.00 0.00 178.44 178.30 2cq8 h ARG 99 N -1.00 -0.06 0.07 1.13 3.08 0.41 -2.70 114.38 115.31 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 0.56 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2cq8 h ARG 99 CO 0.10 -0.04 -0.04 0.78 -1.07 0.00 0.00 179.97 179.70 2cq8 h GLY 100 N -0.06 -0.23 -3.13 0.04 0.00 -1.44 -3.49 103.07 94.75 2cq8 h GLY 100 Ca 0.30 0.09 0.34 0.00 0.00 0.00 0.00 47.33 48.07 2cq8 h GLY 100 CO -0.71 -0.08 -0.85 1.34 0.00 0.00 0.00 176.54 176.24 2cq8 n ASP 101 N -2.31 -8.07 -1.26 0.19 2.03 -0.37 -5.03 116.55 101.73 2cq8 n ASP 101 Ca -0.01 0.97 0.00 0.00 0.52 0.00 0.00 54.79 56.27 2cq8 n ASP 101 Cb 0.04 -4.35 0.00 0.00 -0.72 0.00 0.00 41.12 36.08 2cq8 n ASP 101 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2cq8 n ASP 102 N -4.19 -6.82 -4.66 1.67 -0.08 -1.26 -5.05 116.55 96.16 2cq8 n ASP 102 Ca -0.04 0.88 -0.24 0.00 -1.51 0.00 0.00 54.79 53.88 2cq8 n ASP 102 Cb 0.63 -3.04 -0.08 0.00 2.34 0.00 0.00 41.12 40.97 2cq8 n ASP 102 CO 0.00 0.00 0.00 -1.83 0.12 0.00 0.00 177.20 175.49 2cq8 s GLU 103 N -2.60 2.17 -0.61 -0.67 -1.05 -1.26 -5.09 118.70 109.58 2cq8 s GLU 103 Ca 0.00 -1.70 -0.12 0.00 -0.15 0.00 0.00 54.97 53.00 2cq8 s GLU 103 Cb 0.00 -2.00 0.16 0.00 -0.44 0.00 0.00 34.13 31.85 2cq8 s GLU 103 CO 0.00 0.12 0.53 -1.21 0.95 0.00 0.00 175.26 175.65 2cq8 s GLU 104 N -3.76 2.99 0.14 -4.83 2.02 -1.26 -5.04 118.70 108.96 2cq8 s GLU 104 Ca 0.36 -2.02 -0.34 0.00 0.02 0.00 0.00 54.97 52.99 2cq8 s GLU 104 Cb -0.00 -4.18 -0.16 0.00 0.10 0.00 0.00 34.13 29.88 2cq8 s GLU 104 CO 0.20 -1.27 1.21 0.45 0.02 0.00 0.00 175.26 175.87 2cq8 n SER 105 N 4.63 1.37 0.00 -0.19 2.88 -1.26 -4.97 113.62 116.07 2cq8 n SER 105 Ca -0.02 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.65 2cq8 n SER 105 Cb 0.42 -1.20 0.00 0.00 -0.75 0.00 0.00 64.21 62.68 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 2.16 2.77 0.18 0.46 0.00 -1.26 -5.03 105.19 104.48 2cq8 n GLY 106 Ca 0.16 -1.79 -0.18 0.00 0.00 0.00 0.00 46.02 44.21 2cq8 n GLY 106 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cq8 h PRO 107 N 0.00 0.63 -6.14 1.61 0.13 -2.07 -3.49 132.00 122.67 2cq8 h PRO 107 Ca 0.00 -0.61 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 2cq8 h PRO 107 Cb 0.00 0.16 -0.00 0.00 0.13 0.00 0.00 31.00 31.28 2cq8 h PRO 107 CO 0.00 1.22 -0.86 0.45 -0.23 0.00 0.00 178.00 178.58 2cq8 n SER 108 N -4.02 -6.74 0.34 1.44 2.88 -1.26 -4.86 113.62 101.40 2cq8 n SER 108 Ca -0.10 0.65 -0.18 0.00 -1.33 0.00 0.00 58.87 57.92 2cq8 n SER 108 Cb 0.76 -2.16 -0.09 0.00 -0.75 0.00 0.00 64.21 61.98 2cq8 n SER 108 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2cq8 h SER 109 N 3.78 -0.98 0.00 -3.46 0.87 -2.07 -3.56 113.55 108.13 2cq8 h SER 109 Ca -0.02 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 2cq8 h SER 109 Cb 0.72 0.29 0.00 0.00 -0.44 0.00 0.00 62.40 62.97 2cq8 h SER 109 CO 0.01 -0.60 0.00 0.61 -0.53 0.00 0.00 176.83 176.32