#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gd8 n SER 15 N 0.00 0.43 0.10 4.04 3.41 -1.26 0.70 113.62 121.04 1gd8 n SER 15 Ca 0.00 0.69 0.08 0.00 -0.26 0.00 0.00 58.87 59.38 1gd8 n SER 15 Cb 0.00 -0.74 -0.00 0.00 -0.26 0.00 0.00 64.21 63.21 1gd8 n SER 15 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 1gd8 h HIS 16 N 0.00 0.00 0.04 7.33 3.86 -2.05 -2.96 115.15 121.37 1gd8 h HIS 16 Ca 0.00 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.10 1gd8 h HIS 16 Cb 0.05 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.52 1gd8 h HIS 16 CO 0.00 0.16 -0.52 0.00 0.86 0.00 0.00 177.93 178.43 1gd8 h ARG 17 N 0.00 0.09 -0.93 2.45 3.08 -0.17 -3.17 114.38 115.73 1gd8 h ARG 17 Ca -0.04 -0.15 0.04 0.00 0.07 0.00 0.00 59.98 59.90 1gd8 h ARG 17 Cb 1.16 0.06 -0.06 0.00 0.08 0.00 0.00 29.97 31.21 1gd8 h ARG 17 CO 0.01 1.07 0.60 1.25 -1.07 0.00 0.00 179.97 181.84 1gd8 h LEU 18 N -0.80 1.00 -1.17 3.04 7.12 -1.36 0.95 115.31 124.10 1gd8 h LEU 18 Ca -0.12 -0.01 -0.03 0.00 0.13 0.00 0.00 57.88 57.86 1gd8 h LEU 18 Cb 1.26 -0.22 -0.03 0.00 -0.53 0.00 0.00 40.66 41.14 1gd8 h LEU 18 CO 0.00 0.68 0.26 0.00 -0.13 0.00 0.00 178.44 179.25 1gd8 h ALA 19 N 1.39 1.35 -0.02 1.25 0.00 -1.65 0.19 119.26 121.77 1gd8 h ALA 19 Ca 0.37 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1gd8 h ALA 19 Cb 0.02 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1gd8 h ALA 19 CO -0.13 0.49 -0.04 1.25 0.00 0.00 0.00 179.25 180.83 1gd8 h LEU 20 N 0.83 0.07 -0.79 0.00 6.46 -1.10 -2.41 115.31 118.36 1gd8 h LEU 20 Ca 0.20 -0.58 0.09 0.00 -0.12 0.00 0.00 57.88 57.47 1gd8 h LEU 20 Cb 0.13 -0.02 -0.07 0.00 -0.73 0.00 0.00 40.66 39.96 1gd8 h LEU 20 CO -0.02 0.64 0.44 1.88 -0.62 0.00 0.00 178.44 180.76 1gd8 h TYR 21 N -0.50 0.80 -0.67 1.25 0.99 -0.63 0.40 116.97 118.61 1gd8 h TYR 21 Ca 0.00 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.76 1gd8 h TYR 21 Cb 0.63 -0.24 -0.03 0.00 1.00 0.00 0.00 36.73 38.09 1gd8 h TYR 21 CO 0.13 0.32 0.41 0.00 -0.00 0.00 0.00 178.16 179.03 1gd8 h ARG 22 N 0.75 0.89 -0.32 4.88 3.08 -0.96 0.84 114.38 123.54 1gd8 h ARG 22 Ca 0.38 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 60.28 1gd8 h ARG 22 Cb 0.35 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1gd8 h ARG 22 CO -0.25 0.62 -0.10 -0.97 -1.07 0.00 0.00 179.97 178.20 1gd8 h ASN 23 N 0.90 0.65 -0.29 7.04 -0.73 -0.65 -2.34 115.58 120.16 1gd8 h ASN 23 Ca 0.24 -0.38 -0.04 0.00 1.87 0.00 0.00 56.30 57.99 1gd8 h ASN 23 Cb -0.05 -0.18 -0.01 0.00 0.27 0.00 0.00 38.32 38.35 1gd8 h ASN 23 CO -0.05 0.88 0.03 1.56 -0.37 0.00 0.00 177.43 179.48 1gd8 h GLN 24 N 0.41 0.49 -0.73 6.67 4.20 0.11 -3.08 115.11 123.18 1gd8 h GLN 24 Ca 0.08 -0.14 0.09 0.00 0.06 0.00 0.00 58.65 58.74 1gd8 h GLN 24 Cb 0.61 -0.05 -0.07 0.00 0.30 0.00 0.00 27.48 28.26 1gd8 h GLN 24 CO 0.04 0.61 0.38 0.00 -0.67 0.00 0.00 178.83 179.18 1gd8 h ALA 25 N 0.86 1.02 -0.40 3.87 0.00 0.77 -1.19 119.26 124.19 1gd8 h ALA 25 Ca 0.09 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1gd8 h ALA 25 Cb 0.37 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1gd8 h ALA 25 CO 0.01 -0.02 0.12 0.87 0.00 0.00 0.00 179.25 180.23 1gd8 h LYS 26 N 0.64 0.62 -0.27 0.00 1.57 -1.39 -1.93 116.57 115.80 1gd8 h LYS 26 Ca 0.36 -0.13 -0.10 0.00 -1.87 0.00 0.00 60.65 58.91 1gd8 h LYS 26 Cb 0.37 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1gd8 h LYS 26 CO -0.26 0.62 -0.24 0.77 -0.57 0.00 0.00 179.45 179.76 1gd8 h SER 27 N 0.49 0.52 -0.33 0.86 0.02 -1.39 -2.01 113.55 111.71 1gd8 h SER 27 Ca 0.13 -0.18 -0.13 0.00 -0.84 0.00 0.00 61.79 60.77 1gd8 h SER 27 Cb 0.26 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 1gd8 h SER 27 CO -0.00 0.76 -0.28 0.25 -1.14 0.00 0.00 176.83 176.42 1gd8 h LEU 28 N 0.46 0.88 -0.24 5.07 7.12 -1.06 -1.19 115.31 126.34 1gd8 h LEU 28 Ca 0.07 -0.35 -0.14 0.00 0.13 0.00 0.00 57.88 57.59 1gd8 h LEU 28 Cb 0.67 -0.24 -0.02 0.00 -0.53 0.00 0.00 40.66 40.54 1gd8 h LEU 28 CO 0.05 1.10 -0.64 -0.07 -0.13 0.00 0.00 178.44 178.74 1gd8 h LEU 29 N 0.72 0.00 0.00 2.25 -0.00 -1.26 -1.05 115.31 115.97 1gd8 h LEU 29 Ca 0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.96 1gd8 h LEU 29 Cb 0.82 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.48 1gd8 h LEU 29 CO 0.07 0.64 -0.06 0.74 -0.00 0.00 0.00 178.44 179.83 1gd8 h THR 30 N 0.00 0.61 0.11 0.22 2.02 -1.29 -3.40 112.91 111.18 1gd8 h THR 30 Ca -0.01 -1.48 -0.31 0.00 0.77 0.00 0.00 66.41 65.39 1gd8 h THR 30 Cb 1.39 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.97 1gd8 h THR 30 CO 0.08 0.21 -1.55 0.45 0.37 0.00 0.00 175.52 175.08 1gd8 h HIS 31 N -1.00 0.44 0.00 3.16 3.86 -1.37 -3.49 115.15 116.75 1gd8 h HIS 31 Ca -0.01 -0.32 0.00 0.00 -1.16 0.00 0.00 60.37 58.88 1gd8 h HIS 31 Cb 0.39 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.84 1gd8 h HIS 31 CO 0.08 1.38 0.00 0.41 0.86 0.00 0.00 177.93 180.67 1gd8 n GLY 32 N 1.67 1.40 3.36 2.45 0.00 -0.40 -5.07 105.19 108.61 1gd8 n GLY 32 Ca -0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 1gd8 n GLY 32 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1gd8 s ARG 33 N -0.45 1.16 0.09 1.61 1.70 -1.24 -3.16 118.95 118.66 1gd8 s ARG 33 Ca 0.00 -0.61 -0.15 0.00 -0.47 0.00 0.00 55.73 54.51 1gd8 s ARG 33 Cb 0.00 0.52 0.03 0.00 -0.57 0.00 0.00 34.95 34.93 1gd8 s ARG 33 CO 0.00 -0.48 0.34 0.42 -1.08 0.00 0.00 175.30 174.51 1gd8 s ILE 34 N -3.78 0.08 -0.04 4.99 -1.09 0.39 -4.57 121.20 117.18 1gd8 s ILE 34 Ca 0.02 -0.69 0.02 0.00 -2.23 0.00 0.00 60.65 57.77 1gd8 s ILE 34 Cb 0.01 -1.13 0.01 0.00 -1.58 0.00 0.00 42.46 39.77 1gd8 s ILE 34 CO -0.12 -0.38 -0.09 -0.89 -1.23 0.00 0.00 174.94 172.23 1gd8 s THR 35 N -3.39 0.82 0.00 2.92 2.01 -1.26 -0.27 115.64 116.47 1gd8 s THR 35 Ca 0.01 -0.33 0.00 0.00 0.31 0.00 0.00 61.69 61.68 1gd8 s THR 35 Cb 0.02 -0.77 0.00 0.00 0.01 0.00 0.00 72.50 71.76 1gd8 s THR 35 CO -0.09 0.27 0.00 0.35 -0.69 0.00 0.00 174.62 174.47 1gd8 n THR 36 N 3.69 0.00 -1.66 -0.82 -2.24 -0.95 -5.00 114.28 107.30 1gd8 n THR 36 Ca -0.22 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.25 1gd8 n THR 36 Cb 0.52 0.00 0.04 0.00 -2.10 0.00 0.00 70.33 68.79 1gd8 n THR 36 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1gd8 s THR 37 N -2.52 4.12 0.16 4.28 -4.23 -1.26 -1.27 115.64 114.92 1gd8 s THR 37 Ca 0.00 0.69 -0.15 0.00 -1.18 0.00 0.00 61.69 61.05 1gd8 s THR 37 Cb 0.00 -3.51 0.04 0.00 1.34 0.00 0.00 72.50 70.38 1gd8 s THR 37 CO 0.00 -0.90 1.81 0.58 -0.54 0.00 0.00 174.62 175.57 1gd8 h VAL 38 N -0.64 1.14 0.08 2.29 2.07 -1.82 -0.55 116.25 118.82 1gd8 h VAL 38 Ca -0.44 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 1gd8 h VAL 38 Cb 1.21 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1gd8 h VAL 38 CO 0.59 0.13 -0.04 -0.65 0.02 0.00 0.00 177.57 177.62 1gd8 h PRO 39 N 0.64 -0.11 -0.36 1.57 0.11 -1.93 -1.83 132.00 130.09 1gd8 h PRO 39 Ca 0.17 0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.34 1gd8 h PRO 39 Cb -0.04 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.07 1gd8 h PRO 39 CO -0.04 0.02 0.25 0.87 -0.21 0.00 0.00 178.00 178.89 1gd8 h LYS 40 N -0.21 0.27 -0.34 1.05 1.57 -1.92 -1.55 116.57 115.44 1gd8 h LYS 40 Ca -0.01 -0.02 -0.17 0.00 -1.87 0.00 0.00 60.65 58.58 1gd8 h LYS 40 Cb 0.18 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 1gd8 h LYS 40 CO 0.02 0.18 -0.47 0.00 -0.57 0.00 0.00 179.45 178.61 1gd8 h ALA 41 N 1.80 0.52 -0.34 3.86 0.00 -0.70 -1.94 119.26 122.46 1gd8 h ALA 41 Ca 0.16 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 1gd8 h ALA 41 Cb 0.27 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1gd8 h ALA 41 CO -0.03 0.68 0.11 0.87 0.00 0.00 0.00 179.25 180.87 1gd8 h LYS 42 N 0.73 0.52 -0.58 0.00 1.57 -0.47 -1.26 116.57 117.08 1gd8 h LYS 42 Ca 0.04 -0.11 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 1gd8 h LYS 42 Cb 1.07 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 33.28 1gd8 h LYS 42 CO 0.11 0.55 0.21 0.93 -0.57 0.00 0.00 179.45 180.68 1gd8 h GLU 43 N 0.39 0.84 -0.14 3.15 5.08 -1.33 -2.83 114.58 119.75 1gd8 h GLU 43 Ca 0.11 -0.14 -0.07 0.00 -1.00 0.00 0.00 59.36 58.26 1gd8 h GLU 43 Cb 0.24 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 1gd8 h GLU 43 CO -0.00 0.71 -0.18 1.25 -1.00 0.00 0.00 179.01 179.78 1gd8 h LEU 44 N 0.83 0.40 -0.97 1.33 7.12 -1.16 -2.62 115.31 120.25 1gd8 h LEU 44 Ca 0.19 -0.51 0.16 0.00 0.13 0.00 0.00 57.88 57.86 1gd8 h LEU 44 Cb 0.19 -0.11 -0.10 0.00 -0.53 0.00 0.00 40.66 40.11 1gd8 h LEU 44 CO -0.02 0.83 0.57 0.08 -0.13 0.00 0.00 178.44 179.78 1gd8 h ARG 45 N -0.02 0.76 -0.28 1.25 0.11 -1.07 0.39 114.38 115.51 1gd8 h ARG 45 Ca 0.02 -0.05 -0.15 0.00 0.10 0.00 0.00 59.98 59.90 1gd8 h ARG 45 Cb 0.73 -0.17 -0.01 0.00 1.11 0.00 0.00 29.97 31.64 1gd8 h ARG 45 CO 0.04 0.50 -0.45 0.78 0.10 0.00 0.00 179.97 180.95 1gd8 h GLY 46 N 0.78 0.79 0.91 0.08 0.00 -1.47 -1.70 103.07 102.48 1gd8 h GLY 46 Ca 0.53 -0.84 -0.00 0.00 0.00 0.00 0.00 47.33 47.02 1gd8 h GLY 46 CO -0.35 0.76 -0.03 -2.75 0.00 0.00 0.00 176.54 174.16 1gd8 h PHE 47 N 0.58 -0.08 -0.40 5.60 3.57 -0.60 -2.17 116.94 123.44 1gd8 h PHE 47 Ca 0.04 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.45 1gd8 h PHE 47 Cb 1.00 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.76 1gd8 h PHE 47 CO 0.05 0.03 -0.08 0.28 -2.23 0.00 0.00 178.31 176.36 1gd8 h VAL 48 N -0.18 1.27 -0.70 1.41 2.07 -1.12 -2.36 116.25 116.65 1gd8 h VAL 48 Ca -0.01 -1.16 0.06 0.00 0.82 0.00 0.00 66.70 66.41 1gd8 h VAL 48 Cb 0.15 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.08 1gd8 h VAL 48 CO 0.02 0.39 0.46 0.44 0.02 0.00 0.00 177.57 178.89 1gd8 h ASP 49 N 0.58 0.65 -0.19 0.57 3.32 -1.29 -0.22 116.42 119.84 1gd8 h ASP 49 Ca 0.10 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.03 1gd8 h ASP 49 Cb 0.60 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 1gd8 h ASP 49 CO 0.04 0.43 -0.30 -0.74 -1.72 0.00 0.00 179.24 176.94 1gd8 h HIS 50 N 0.74 0.79 -0.02 4.55 2.76 -1.10 -2.11 115.15 120.77 1gd8 h HIS 50 Ca 0.30 -0.20 -0.20 0.00 -2.20 0.00 0.00 60.37 58.06 1gd8 h HIS 50 Cb 0.22 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 28.99 1gd8 h HIS 50 CO -0.00 0.91 -0.85 -0.07 -1.30 0.00 0.00 177.93 176.62 1gd8 h LEU 51 N 0.58 0.39 -0.84 0.26 3.38 -0.70 -3.02 115.31 115.37 1gd8 h LEU 51 Ca 0.07 -0.30 -0.12 0.00 0.09 0.00 0.00 57.88 57.62 1gd8 h LEU 51 Cb 0.81 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1gd8 h LEU 51 CO 0.07 1.07 -0.52 0.40 0.09 0.00 0.00 178.44 179.55 1gd8 h ILE 52 N 0.19 1.36 -0.32 1.22 2.04 -1.04 -1.69 117.51 119.27 1gd8 h ILE 52 Ca -0.05 -1.78 0.03 0.00 1.00 0.00 0.00 64.86 64.05 1gd8 h ILE 52 Cb 1.46 1.89 -0.03 0.00 -0.74 0.00 0.00 36.82 39.41 1gd8 h ILE 52 CO 0.14 0.52 0.15 -0.74 0.00 0.00 0.00 178.15 178.22 1gd8 h HIS 53 N 0.13 0.27 -0.16 1.37 2.76 -1.30 0.80 115.15 119.02 1gd8 h HIS 53 Ca 0.00 0.01 -0.13 0.00 -2.20 0.00 0.00 60.37 58.06 1gd8 h HIS 53 Cb 0.96 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.83 1gd8 h HIS 53 CO 0.01 0.14 -0.46 -0.07 -1.30 0.00 0.00 177.93 176.25 1gd8 h LEU 54 N 0.31 0.42 -1.40 0.26 3.38 -1.39 -1.51 115.31 115.38 1gd8 h LEU 54 Ca 0.14 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 1gd8 h LEU 54 Cb 0.07 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1gd8 h LEU 54 CO -0.11 0.82 -0.30 0.00 0.09 0.00 0.00 178.44 178.94 1gd8 h ALA 55 N 1.19 1.42 -0.13 1.53 0.00 -0.74 0.79 119.26 123.33 1gd8 h ALA 55 Ca 0.02 -0.27 -0.20 0.00 0.00 0.00 0.00 54.91 54.45 1gd8 h ALA 55 Cb 0.93 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.68 1gd8 h ALA 55 CO 0.08 0.38 -0.72 0.87 0.00 0.00 0.00 179.25 179.86 1gd8 h LYS 56 N 0.00 0.71 0.00 0.00 1.79 -0.35 -2.80 116.57 115.92 1gd8 h LYS 56 Ca -0.00 -0.59 -0.03 0.00 -2.18 0.00 0.00 60.65 57.85 1gd8 h LYS 56 Cb 0.56 0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 31.33 1gd8 h LYS 56 CO 0.04 1.21 -0.13 -0.09 -1.08 0.00 0.00 179.45 179.40 1gd8 h ARG 57 N 0.41 0.00 -5.82 3.15 2.43 -0.67 -3.47 114.38 110.41 1gd8 h ARG 57 Ca -0.05 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.04 1gd8 h ARG 57 Cb 1.35 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.90 1gd8 h ARG 57 CO 0.15 0.13 -0.16 0.41 -1.51 0.00 0.00 179.97 178.98 1gd8 n GLY 58 N -0.57 -0.18 3.46 2.80 0.00 0.21 -4.96 105.19 105.97 1gd8 n GLY 58 Ca -0.01 0.08 -0.24 0.00 0.00 0.00 0.00 46.02 45.84 1gd8 n GLY 58 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1gd8 s ASP 59 N -2.84 2.52 0.20 1.61 -4.77 -1.26 -4.99 116.67 107.15 1gd8 s ASP 59 Ca 0.02 -1.69 -0.13 0.00 -3.30 0.00 0.00 52.55 47.45 1gd8 s ASP 59 Cb -0.01 0.52 0.23 0.00 -1.09 0.00 0.00 42.92 42.57 1gd8 s ASP 59 CO 0.14 -0.96 1.65 0.17 0.70 0.00 0.00 175.17 176.87 1gd8 h LEU 60 N 1.87 -0.42 -0.33 2.11 -0.00 -2.00 -0.74 115.31 115.80 1gd8 h LEU 60 Ca -0.33 0.16 -0.19 0.00 -0.00 0.00 0.00 57.88 57.52 1gd8 h LEU 60 Cb 1.26 0.32 -0.01 0.00 -0.00 0.00 0.00 40.66 42.23 1gd8 h LEU 60 CO 0.52 -0.16 -0.83 0.45 -0.00 0.00 0.00 178.44 178.43 1gd8 h HIS 61 N 0.05 0.35 -0.34 0.17 3.86 -1.99 -3.00 115.15 114.25 1gd8 h HIS 61 Ca 0.29 -0.18 -0.07 0.00 -1.16 0.00 0.00 60.37 59.25 1gd8 h HIS 61 Cb 0.46 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.87 1gd8 h HIS 61 CO -0.42 0.97 -0.04 0.00 0.86 0.00 0.00 177.93 179.29 1gd8 h ALA 62 N 0.98 0.46 0.00 2.45 0.00 -1.77 -2.16 119.26 119.23 1gd8 h ALA 62 Ca -0.04 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 1gd8 h ALA 62 Cb 1.44 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 1gd8 h ALA 62 CO 0.13 0.27 -0.02 -0.09 0.00 0.00 0.00 179.25 179.54 1gd8 h ARG 63 N 0.43 0.00 -0.03 0.00 2.43 -1.18 -0.57 114.38 115.45 1gd8 h ARG 63 Ca 0.09 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 1gd8 h ARG 63 Cb 0.52 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1gd8 h ARG 63 CO 0.03 0.02 -0.17 -0.09 -1.51 0.00 0.00 179.97 178.25 1gd8 h ARG 64 N 0.00 0.17 -0.48 0.20 2.43 -1.31 -2.84 114.38 112.54 1gd8 h ARG 64 Ca -0.00 -0.14 -0.05 0.00 -0.81 0.00 0.00 59.98 58.98 1gd8 h ARG 64 Cb 0.04 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 1gd8 h ARG 64 CO 0.00 0.80 0.08 -0.07 -1.51 0.00 0.00 179.97 179.28 1gd8 h LEU 65 N -0.42 0.69 -0.55 3.80 -0.00 -0.92 -1.55 115.31 116.36 1gd8 h LEU 65 Ca -0.01 -0.13 -0.09 0.00 -0.00 0.00 0.00 57.88 57.65 1gd8 h LEU 65 Cb 0.84 -0.18 -0.02 0.00 -0.00 0.00 0.00 40.66 41.30 1gd8 h LEU 65 CO 0.03 0.71 -0.01 0.58 -0.00 0.00 0.00 178.44 179.75 1gd8 h VAL 66 N 0.71 1.26 -0.12 1.22 2.07 -1.17 -1.97 116.25 118.26 1gd8 h VAL 66 Ca 0.15 -1.13 -0.16 0.00 0.82 0.00 0.00 66.70 66.38 1gd8 h VAL 66 Cb 0.31 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1gd8 h VAL 66 CO 0.00 0.40 -0.61 0.25 0.02 0.00 0.00 177.57 177.64 1gd8 h LEU 67 N 0.86 0.48 -1.41 2.57 6.46 -1.24 0.37 115.31 123.40 1gd8 h LEU 67 Ca 0.15 -0.28 -0.00 0.00 -0.12 0.00 0.00 57.88 57.64 1gd8 h LEU 67 Cb 0.55 -0.14 -0.03 0.00 -0.73 0.00 0.00 40.66 40.31 1gd8 h LEU 67 CO 0.03 0.98 0.32 -0.09 -0.62 0.00 0.00 178.44 179.06 1gd8 h ARG 68 N 0.32 0.72 0.05 1.25 2.43 -1.13 -3.05 114.38 114.97 1gd8 h ARG 68 Ca -0.01 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 58.98 1gd8 h ARG 68 Cb 1.15 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.54 1gd8 h ARG 68 CO 0.11 0.51 -0.61 0.22 -1.51 0.00 0.00 179.97 178.69 1gd8 h ASP 69 N 0.74 0.17 -3.62 -3.80 3.58 -1.07 -3.43 116.42 109.00 1gd8 h ASP 69 Ca 0.19 -0.89 -0.69 0.00 0.42 0.00 0.00 57.03 56.06 1gd8 h ASP 69 Cb -0.03 -0.06 -0.26 0.00 1.72 0.00 0.00 39.33 40.71 1gd8 h ASP 69 CO -0.04 1.27 -0.57 -0.22 -2.88 0.00 0.00 179.24 176.80 1gd8 s LEU 70 N -7.98 4.35 -1.43 2.28 0.20 0.13 -4.91 118.68 111.32 1gd8 s LEU 70 Ca -0.19 -0.93 -0.12 0.00 0.69 0.00 0.00 54.13 53.57 1gd8 s LEU 70 Cb 0.00 -1.94 0.06 0.00 -0.43 0.00 0.00 46.19 43.88 1gd8 s LEU 70 CO 0.72 -0.31 2.21 0.00 -0.29 0.00 0.00 176.35 178.69 1gd8 n GLN 71 N 4.91 3.18 -3.52 1.98 1.13 -1.22 -4.23 117.38 119.61 1gd8 n GLN 71 Ca -0.13 -2.82 -0.00 0.00 -1.94 0.00 0.00 57.00 52.11 1gd8 n GLN 71 Cb 0.46 -3.13 -0.04 0.00 0.11 0.00 0.00 30.24 27.64 1gd8 n GLN 71 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1gd8 s ASP 72 N 2.43 -0.78 0.06 1.08 3.68 -1.26 -5.07 116.67 116.80 1gd8 s ASP 72 Ca 0.47 1.10 -0.18 0.00 2.13 0.00 0.00 52.55 56.07 1gd8 s ASP 72 Cb 0.13 1.83 -0.13 0.00 -1.45 0.00 0.00 42.92 43.31 1gd8 s ASP 72 CO -0.06 -0.16 1.36 0.58 0.13 0.00 0.00 175.17 177.02 1gd8 h VAL 73 N 5.61 1.33 -0.93 1.11 2.07 -1.96 -2.23 116.25 121.25 1gd8 h VAL 73 Ca -0.18 -1.44 0.21 0.00 0.82 0.00 0.00 66.70 66.11 1gd8 h VAL 73 Cb 1.12 1.81 -0.07 0.00 -1.52 0.00 0.00 31.29 32.63 1gd8 h VAL 73 CO 0.10 0.44 0.61 0.11 0.02 0.00 0.00 177.57 178.85 1gd8 h LYS 74 N 0.18 0.42 0.11 1.57 1.57 -1.98 0.21 116.57 118.65 1gd8 h LYS 74 Ca 0.02 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1gd8 h LYS 74 Cb 0.81 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.03 1gd8 h LYS 74 CO 0.06 0.28 -0.05 -0.07 -0.57 0.00 0.00 179.45 179.09 1gd8 h LEU 75 N 0.43 -0.13 -1.53 2.94 3.38 -1.96 -1.38 115.31 117.07 1gd8 h LEU 75 Ca 0.49 -0.44 0.12 0.00 0.09 0.00 0.00 57.88 58.14 1gd8 h LEU 75 Cb 1.19 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.93 1gd8 h LEU 75 CO -0.20 0.46 0.48 0.58 0.09 0.00 0.00 178.44 179.84 1gd8 h VAL 76 N -0.79 0.86 0.19 1.22 2.07 -0.69 0.94 116.25 120.04 1gd8 h VAL 76 Ca -0.02 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 1gd8 h VAL 76 Cb 0.56 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 1gd8 h VAL 76 CO 0.02 0.09 -0.09 -0.09 0.02 0.00 0.00 177.57 177.53 1gd8 h ARG 77 N 0.50 -0.24 -0.61 1.57 2.43 -0.61 -2.76 114.38 114.66 1gd8 h ARG 77 Ca 0.35 0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.62 1gd8 h ARG 77 Cb 0.66 0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 30.20 1gd8 h ARG 77 CO -0.12 0.08 0.26 -0.22 -1.51 0.00 0.00 179.97 178.46 1gd8 h LYS 78 N -0.57 0.46 0.03 0.20 3.64 0.02 -1.90 116.57 118.44 1gd8 h LYS 78 Ca -0.03 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.36 1gd8 h LYS 78 Cb 0.43 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.10 1gd8 h LYS 78 CO 0.04 0.30 -0.32 -0.07 -2.27 0.00 0.00 179.45 177.13 1gd8 h LEU 79 N 0.47 -0.96 -0.02 5.20 3.38 -0.86 0.24 115.31 122.76 1gd8 h LEU 79 Ca 0.30 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.39 1gd8 h LEU 79 Cb 0.33 0.38 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 1gd8 h LEU 79 CO -0.27 -0.39 0.01 -0.26 0.09 0.00 0.00 178.44 177.61 1gd8 h PHE 80 N -0.50 0.03 -0.02 1.13 -1.00 -1.20 0.44 116.94 115.82 1gd8 h PHE 80 Ca 0.05 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.83 1gd8 h PHE 80 Cb 0.57 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 40.12 1gd8 h PHE 80 CO -0.33 0.24 -0.02 -0.25 -1.61 0.00 0.00 178.31 176.34 1gd8 n ASP 81 N -4.96 2.15 0.09 2.17 9.92 -0.74 -4.31 116.55 120.86 1gd8 n ASP 81 Ca -0.07 -1.70 0.00 0.00 -0.53 0.00 0.00 54.79 52.48 1gd8 n ASP 81 Cb 0.13 0.01 0.00 0.00 -0.64 0.00 0.00 41.12 40.63 1gd8 n ASP 81 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 1gd8 n GLU 82 N 0.66 0.00 -0.07 -1.24 2.13 0.76 -4.83 120.64 118.05 1gd8 n GLU 82 Ca 0.16 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.85 1gd8 n GLU 82 Cb 0.46 -0.22 -0.06 0.00 0.27 0.00 0.00 31.44 31.89 1gd8 n GLU 82 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 1gd8 h ILE 83 N 0.00 1.33 -0.02 6.31 1.08 -1.16 -3.23 117.51 121.82 1gd8 h ILE 83 Ca 0.00 -1.33 0.01 0.00 -0.39 0.00 0.00 64.86 63.14 1gd8 h ILE 83 Cb 0.07 1.76 -0.01 0.00 -3.07 0.00 0.00 36.82 35.58 1gd8 h ILE 83 CO 0.00 0.40 -0.02 0.00 -0.69 0.00 0.00 178.15 177.84 1gd8 h ALA 84 N 0.65 -0.00 -1.01 1.87 0.00 -0.33 -2.77 119.26 117.67 1gd8 h ALA 84 Ca 0.03 0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.07 1gd8 h ALA 84 Cb 0.72 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.47 1gd8 h ALA 84 CO 0.05 -0.51 0.64 -1.35 0.00 0.00 0.00 179.25 178.07 1gd8 h PRO 85 N -0.03 0.98 0.00 0.00 0.11 -1.75 -1.13 132.00 130.18 1gd8 h PRO 85 Ca 0.02 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.06 1gd8 h PRO 85 Cb 0.06 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 30.94 1gd8 h PRO 85 CO -0.04 0.65 -0.06 -0.09 -0.21 0.00 0.00 178.00 178.25 1gd8 h ARG 86 N 1.01 0.00 -0.32 1.05 2.43 -1.51 -2.61 114.38 114.44 1gd8 h ARG 86 Ca 0.49 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.61 1gd8 h ARG 86 Cb 0.46 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.98 1gd8 h ARG 86 CO -0.26 0.06 0.01 0.66 -1.51 0.00 0.00 179.97 178.93 1gd8 n TYR 87 N -3.58 1.11 0.39 2.20 4.02 -0.45 -4.49 117.16 116.35 1gd8 n TYR 87 Ca -0.02 -1.04 0.12 0.00 -0.01 0.00 0.00 57.90 56.95 1gd8 n TYR 87 Cb 0.17 -0.38 0.49 0.00 -0.02 0.00 0.00 39.34 39.60 1gd8 n TYR 87 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 1gd8 n ARG 88 N -0.59 0.19 -0.06 -0.72 3.00 -0.98 -2.35 116.66 115.14 1gd8 n ARG 88 Ca 0.25 0.43 -0.13 0.00 -0.00 0.00 0.00 57.85 58.40 1gd8 n ARG 88 Cb 0.97 -1.86 -0.12 0.00 0.00 0.00 0.00 32.46 31.44 1gd8 n ARG 88 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 1gd8 h ASP 89 N 0.00 -0.00 -4.09 6.15 3.58 -1.82 -3.46 116.42 116.78 1gd8 h ASP 89 Ca 0.00 -0.87 -0.47 0.00 0.42 0.00 0.00 57.03 56.11 1gd8 h ASP 89 Cb 0.34 0.00 0.03 0.00 1.72 0.00 0.00 39.33 41.42 1gd8 h ASP 89 CO 0.00 0.91 0.38 -0.13 -2.88 0.00 0.00 179.24 177.52 1gd8 s ARG 90 N -2.38 3.77 -0.41 0.28 0.52 -0.99 -5.00 118.95 114.73 1gd8 s ARG 90 Ca -0.17 1.32 0.10 0.00 -0.52 0.00 0.00 55.73 56.45 1gd8 s ARG 90 Cb -0.02 -2.09 0.42 0.00 0.52 0.00 0.00 34.95 33.78 1gd8 s ARG 90 CO 0.64 -0.45 1.02 0.94 0.02 0.00 0.00 175.30 177.46 1gd8 n GLN 91 N -1.10 2.48 0.00 3.54 7.27 -1.26 -4.97 117.38 123.34 1gd8 n GLN 91 Ca 0.09 -4.04 0.00 0.00 0.07 0.00 0.00 57.00 53.12 1gd8 n GLN 91 Cb 0.53 -1.87 0.00 0.00 2.41 0.00 0.00 30.24 31.31 1gd8 n GLN 91 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1gd8 n GLY 92 N -0.27 2.93 3.75 1.69 0.00 -1.26 -5.08 105.19 106.95 1gd8 n GLY 92 Ca 0.27 -1.83 -0.33 0.00 0.00 0.00 0.00 46.02 44.13 1gd8 n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gd8 n GLY 93 N -1.81 -0.99 0.15 -0.02 0.00 -1.26 -4.92 105.19 96.34 1gd8 n GLY 93 Ca 0.00 0.44 0.12 0.00 0.00 0.00 0.00 46.02 46.58 1gd8 n GLY 93 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1gd8 h TYR 94 N -1.87 0.00 -3.41 1.61 -1.99 -1.94 -3.46 116.97 105.91 1gd8 h TYR 94 Ca -0.65 0.00 -0.66 0.00 2.00 0.00 0.00 58.73 59.42 1gd8 h TYR 94 Cb 1.36 0.00 -0.25 0.00 2.00 0.00 0.00 36.73 39.84 1gd8 h TYR 94 CO 0.33 0.01 -0.74 0.99 -0.00 0.00 0.00 178.16 178.75 1gd8 s THR 95 N -3.30 3.26 -0.13 -2.88 2.01 -1.26 -0.72 115.64 112.62 1gd8 s THR 95 Ca 0.02 -0.60 -0.04 0.00 0.31 0.00 0.00 61.69 61.39 1gd8 s THR 95 Cb 0.08 -2.37 -0.03 0.00 0.01 0.00 0.00 72.50 70.18 1gd8 s THR 95 CO 0.74 0.53 0.01 -0.60 -0.69 0.00 0.00 174.62 174.61 1gd8 s ARG 96 N 0.17 3.43 -0.19 4.92 3.52 0.18 -4.84 118.95 126.14 1gd8 s ARG 96 Ca -0.06 -0.42 -0.01 0.00 -0.13 0.00 0.00 55.73 55.11 1gd8 s ARG 96 Cb -0.15 -2.94 0.00 0.00 -1.56 0.00 0.00 34.95 30.31 1gd8 s ARG 96 CO 0.04 0.47 -0.13 0.08 -0.81 0.00 0.00 175.30 174.95 1gd8 s VAL 97 N -0.22 2.69 -0.26 7.11 1.01 -1.26 -1.30 120.40 128.16 1gd8 s VAL 97 Ca 0.06 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.32 1gd8 s VAL 97 Cb -0.12 -2.17 0.06 0.00 0.00 0.00 0.00 36.38 34.14 1gd8 s VAL 97 CO 0.02 0.49 -0.09 -0.76 0.00 0.00 0.00 175.10 174.76 1gd8 s LEU 98 N 1.24 3.47 0.23 3.92 1.02 0.34 -4.95 118.68 123.95 1gd8 s LEU 98 Ca 0.03 -1.33 -0.30 0.00 0.02 0.00 0.00 54.13 52.55 1gd8 s LEU 98 Cb -0.14 -1.58 -0.10 0.00 0.02 0.00 0.00 46.19 44.39 1gd8 s LEU 98 CO -0.06 -0.19 1.46 -0.54 0.02 0.00 0.00 176.35 177.03 1gd8 s LYS 99 N 1.14 4.26 0.29 1.70 1.02 -1.26 -0.62 119.74 126.27 1gd8 s LYS 99 Ca -0.07 2.30 0.01 0.00 0.02 0.00 0.00 55.97 58.22 1gd8 s LYS 99 Cb -0.20 -3.12 -0.04 0.00 -0.52 0.00 0.00 37.83 33.95 1gd8 s LYS 99 CO -0.05 -0.45 0.47 -0.51 -0.92 0.00 0.00 175.35 173.90 1gd8 s LEU 100 N -0.06 4.13 0.09 3.17 1.43 -0.32 -4.91 118.68 122.22 1gd8 s LEU 100 Ca 0.61 0.37 -0.15 0.00 -1.03 0.00 0.00 54.13 53.94 1gd8 s LEU 100 Cb -0.42 -3.19 -0.11 0.00 0.03 0.00 0.00 46.19 42.50 1gd8 s LEU 100 CO 0.41 -0.18 1.37 0.00 0.23 0.00 0.00 176.35 178.18 1gd8 h ALA 101 N 1.19 0.38 -2.31 4.21 0.00 -1.94 -3.41 119.26 117.37 1gd8 h ALA 101 Ca -0.50 -0.45 -0.50 0.00 0.00 0.00 0.00 54.91 53.46 1gd8 h ALA 101 Cb 1.21 -0.07 0.15 0.00 0.00 0.00 0.00 17.79 19.09 1gd8 h ALA 101 CO 0.63 0.48 0.26 -2.00 0.00 0.00 0.00 179.25 178.63 1gd8 s GLU 102 N -4.15 1.55 0.14 0.00 2.12 -1.26 -4.92 118.70 112.18 1gd8 s GLU 102 Ca -0.12 1.08 0.03 0.00 0.36 0.00 0.00 54.97 56.31 1gd8 s GLU 102 Cb 0.08 -1.82 -0.04 0.00 0.26 0.00 0.00 34.13 32.61 1gd8 s GLU 102 CO 0.84 -2.11 -0.06 1.03 -0.54 0.00 0.00 175.26 174.43 1gd8 s ARG 103 N -4.86 1.00 0.00 4.30 0.52 -1.26 -2.45 118.95 116.20 1gd8 s ARG 103 Ca 0.63 -1.44 0.00 0.00 -0.52 0.00 0.00 55.73 54.40 1gd8 s ARG 103 Cb -0.19 -0.38 0.00 0.00 0.52 0.00 0.00 34.95 34.90 1gd8 s ARG 103 CO 0.57 -0.02 0.00 -2.13 0.02 0.00 0.00 175.30 173.74 1gd8 n ARG 104 N -0.16 -1.49 -4.38 3.54 0.63 0.46 -4.80 116.66 110.47 1gd8 n ARG 104 Ca -0.10 0.00 -0.26 0.00 -0.92 0.00 0.00 57.85 56.57 1gd8 n ARG 104 Cb 0.61 0.00 -0.12 0.00 0.45 0.00 0.00 32.46 33.40 1gd8 n ARG 104 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1gd8 s ARG 105 N -2.54 1.39 0.00 -0.14 0.52 -1.26 -3.54 118.95 113.38 1gd8 s ARG 105 Ca 0.00 -1.41 0.00 0.00 -0.52 0.00 0.00 55.73 53.80 1gd8 s ARG 105 Cb 0.00 -1.68 0.00 0.00 0.52 0.00 0.00 34.95 33.79 1gd8 s ARG 105 CO 0.00 0.37 0.00 0.41 0.02 0.00 0.00 175.30 176.10 1gd8 n GLY 106 N 0.52 1.77 0.00 -3.53 0.00 -1.26 -4.17 105.19 98.51 1gd8 n GLY 106 Ca -0.15 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1gd8 n GLY 106 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gd8 n ASP 107 N 2.29 0.84 -1.61 1.61 3.85 -1.26 -5.00 116.55 117.26 1gd8 n ASP 107 Ca 0.00 -1.13 -0.06 0.00 -0.71 0.00 0.00 54.79 52.88 1gd8 n ASP 107 Cb 0.00 0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 39.75 1gd8 n ASP 107 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1gd8 n GLY 108 N -0.07 0.25 3.70 6.12 0.00 -1.23 -4.84 105.19 109.12 1gd8 n GLY 108 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1gd8 n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gd8 n ALA 109 N -0.95 2.34 -1.72 4.61 0.00 -1.26 -4.05 120.51 119.47 1gd8 n ALA 109 Ca -0.07 0.39 -0.42 0.00 0.00 0.00 0.00 53.44 53.34 1gd8 n ALA 109 Cb 0.33 -2.51 -0.00 0.00 0.00 0.00 0.00 19.45 17.27 1gd8 n ALA 109 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1gd8 n PRO 110 N 4.34 2.26 -3.50 0.00 -0.04 -1.26 0.17 135.00 136.97 1gd8 n PRO 110 Ca 0.17 0.80 -0.19 0.00 -0.04 0.00 0.00 63.50 64.23 1gd8 n PRO 110 Cb 0.34 -2.45 -0.01 0.00 -0.04 0.00 0.00 33.50 31.34 1gd8 n PRO 110 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1gd8 s LEU 111 N -1.52 3.90 -0.09 1.53 1.43 -1.03 -3.13 118.68 119.77 1gd8 s LEU 111 Ca 0.56 -0.25 -0.09 0.00 -1.03 0.00 0.00 54.13 53.32 1gd8 s LEU 111 Cb -0.52 -2.66 0.02 0.00 0.03 0.00 0.00 46.19 43.06 1gd8 s LEU 111 CO 0.62 -0.44 0.25 0.00 0.23 0.00 0.00 176.35 177.01 1gd8 s ALA 112 N -2.20 -0.62 -0.23 4.21 0.00 -0.40 -1.18 121.76 121.34 1gd8 s ALA 112 Ca 0.45 0.71 -0.09 0.00 0.00 0.00 0.00 51.96 53.03 1gd8 s ALA 112 Cb -0.09 -0.41 -0.05 0.00 0.00 0.00 0.00 23.12 22.57 1gd8 s ALA 112 CO 0.30 -0.12 0.13 -1.17 0.00 0.00 0.00 175.76 174.90 1gd8 s LEU 113 N 0.14 3.95 -0.09 0.00 1.98 0.21 -2.24 118.68 122.63 1gd8 s LEU 113 Ca -0.00 0.05 0.00 0.00 -2.89 0.00 0.00 54.13 51.29 1gd8 s LEU 113 Cb -0.02 -2.05 -0.03 0.00 0.66 0.00 0.00 46.19 44.75 1gd8 s LEU 113 CO 0.00 0.06 -0.07 -0.69 -1.89 0.00 0.00 176.35 173.76 1gd8 s VAL 114 N 1.06 3.64 0.20 1.68 1.01 0.62 -0.50 120.40 128.11 1gd8 s VAL 114 Ca 0.06 -0.49 -0.22 0.00 0.00 0.00 0.00 61.98 61.33 1gd8 s VAL 114 Cb -0.14 -2.51 0.05 0.00 0.00 0.00 0.00 36.38 33.79 1gd8 s VAL 114 CO 0.04 0.58 0.66 -1.83 0.00 0.00 0.00 175.10 174.55 1gd8 s GLU 115 N -0.52 1.47 0.01 2.72 -1.05 -0.42 -0.46 118.70 120.45 1gd8 s GLU 115 Ca 0.08 -0.67 -0.30 0.00 -0.15 0.00 0.00 54.97 53.92 1gd8 s GLU 115 Cb -0.12 0.59 -0.04 0.00 -0.44 0.00 0.00 34.13 34.12 1gd8 s GLU 115 CO 0.02 -0.66 1.16 -0.51 0.95 0.00 0.00 175.26 176.22 1gd8 s LEU 116 N -2.81 4.34 0.39 1.83 1.43 -1.19 0.49 118.68 123.15 1gd8 s LEU 116 Ca 0.05 1.87 -0.26 0.00 -1.03 0.00 0.00 54.13 54.77 1gd8 s LEU 116 Cb -0.03 -3.57 -0.09 0.00 0.03 0.00 0.00 46.19 42.53 1gd8 s LEU 116 CO -0.05 -0.47 1.23 0.54 0.23 0.00 0.00 176.35 177.83 1gd8 s VAL 117 N 1.46 2.93 0.00 -1.59 0.11 0.10 -4.82 120.40 118.59 1gd8 s VAL 117 Ca 0.56 0.82 0.00 0.00 -2.93 0.00 0.00 61.98 60.43 1gd8 s VAL 117 Cb -0.26 -3.48 0.00 0.00 -1.53 0.00 0.00 36.38 31.11 1gd8 s VAL 117 CO 0.26 0.11 0.00 1.21 -3.33 0.00 0.00 175.10 173.35