#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gd8 h SER 15 N 0.00 0.00 1.04 4.04 4.64 -2.05 -1.84 113.55 119.38 1gd8 h SER 15 Ca 0.00 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.12 1gd8 h SER 15 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 1gd8 h SER 15 CO 0.00 0.22 -0.96 0.45 -0.87 0.00 0.00 176.83 175.68 1gd8 h HIS 16 N 0.00 0.00 0.04 4.77 -0.00 -2.06 -2.68 115.15 115.23 1gd8 h HIS 16 Ca -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.37 1gd8 h HIS 16 Cb 0.63 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.04 1gd8 h HIS 16 CO 0.00 0.96 -0.02 0.00 -0.00 0.00 0.00 177.93 178.87 1gd8 h ARG 17 N 0.00 -0.05 -0.81 2.45 3.08 -1.86 -2.79 114.38 114.40 1gd8 h ARG 17 Ca -0.01 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.10 1gd8 h ARG 17 Cb 1.74 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 31.75 1gd8 h ARG 17 CO 0.12 0.35 0.53 -0.07 -1.07 0.00 0.00 179.97 179.83 1gd8 h LEU 18 N -0.47 0.81 -0.80 3.04 4.07 -1.43 -0.35 115.31 120.18 1gd8 h LEU 18 Ca -0.01 -0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.95 1gd8 h LEU 18 Cb 0.43 -0.17 -0.04 0.00 1.08 0.00 0.00 40.66 41.95 1gd8 h LEU 18 CO 0.01 0.53 0.48 0.00 -1.08 0.00 0.00 178.44 178.38 1gd8 h ALA 19 N 1.55 1.02 0.23 1.53 0.00 -1.45 -1.32 119.26 120.82 1gd8 h ALA 19 Ca 0.34 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1gd8 h ALA 19 Cb 0.16 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1gd8 h ALA 19 CO -0.11 0.49 -0.11 1.25 0.00 0.00 0.00 179.25 180.76 1gd8 h LEU 20 N 1.10 -0.26 -0.74 0.00 6.46 -0.95 -2.03 115.31 118.89 1gd8 h LEU 20 Ca 0.29 -0.19 0.14 0.00 -0.12 0.00 0.00 57.88 58.00 1gd8 h LEU 20 Cb -0.04 0.07 -0.10 0.00 -0.73 0.00 0.00 40.66 39.86 1gd8 h LEU 20 CO -0.05 0.05 0.28 1.88 -0.62 0.00 0.00 178.44 179.98 1gd8 h TYR 21 N -0.60 0.46 -0.32 1.25 0.99 -0.97 0.44 116.97 118.22 1gd8 h TYR 21 Ca -0.03 0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.73 1gd8 h TYR 21 Cb 0.43 -0.09 -0.02 0.00 1.00 0.00 0.00 36.73 38.06 1gd8 h TYR 21 CO 0.02 0.04 0.17 -0.09 -0.00 0.00 0.00 178.16 178.29 1gd8 h ARG 22 N 0.41 0.46 -0.46 4.88 2.43 -1.21 0.34 114.38 121.23 1gd8 h ARG 22 Ca 0.41 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.40 1gd8 h ARG 22 Cb 0.63 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1gd8 h ARG 22 CO -0.42 0.40 -0.20 -0.91 -1.51 0.00 0.00 179.97 177.34 1gd8 h ASN 23 N 0.40 0.92 -0.29 -3.80 2.35 -0.37 -1.96 115.58 112.83 1gd8 h ASN 23 Ca 0.11 -0.33 -0.09 0.00 -0.55 0.00 0.00 56.30 55.44 1gd8 h ASN 23 Cb 0.08 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.19 1gd8 h ASN 23 CO -0.02 1.09 -0.18 1.56 -1.65 0.00 0.00 177.43 178.23 1gd8 h GLN 24 N 0.79 0.64 -0.83 0.81 4.20 0.01 -3.05 115.11 117.68 1gd8 h GLN 24 Ca 0.11 -0.30 -0.04 0.00 0.06 0.00 0.00 58.65 58.48 1gd8 h GLN 24 Cb 0.74 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.48 1gd8 h GLN 24 CO 0.06 0.89 0.37 0.00 -0.67 0.00 0.00 178.83 179.48 1gd8 h ALA 25 N 0.74 1.09 -0.22 3.87 0.00 -0.28 -1.48 119.26 122.98 1gd8 h ALA 25 Ca 0.06 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.82 1gd8 h ALA 25 Cb 0.72 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1gd8 h ALA 25 CO 0.05 0.67 0.05 0.87 0.00 0.00 0.00 179.25 180.89 1gd8 h LYS 26 N 1.19 0.13 -0.77 0.00 1.57 -1.33 0.32 116.57 117.69 1gd8 h LYS 26 Ca 0.28 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 59.05 1gd8 h LYS 26 Cb 0.16 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.40 1gd8 h LYS 26 CO -0.03 0.09 0.45 0.77 -0.57 0.00 0.00 179.45 180.16 1gd8 h SER 27 N 0.14 0.93 -0.58 0.86 0.02 -1.40 -1.61 113.55 111.91 1gd8 h SER 27 Ca 0.10 -0.07 -0.05 0.00 -0.84 0.00 0.00 61.79 60.92 1gd8 h SER 27 Cb 0.09 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 1gd8 h SER 27 CO -0.12 0.73 0.16 0.25 -1.14 0.00 0.00 176.83 176.71 1gd8 h LEU 28 N 1.05 0.87 -0.93 5.07 7.12 -0.76 -0.89 115.31 126.83 1gd8 h LEU 28 Ca 0.27 -0.22 -0.11 0.00 0.13 0.00 0.00 57.88 57.96 1gd8 h LEU 28 Cb -0.02 -0.23 -0.01 0.00 -0.53 0.00 0.00 40.66 39.87 1gd8 h LEU 28 CO -0.05 0.86 -0.43 -0.07 -0.13 0.00 0.00 178.44 178.62 1gd8 h LEU 29 N 0.83 0.24 0.00 2.25 -0.00 -0.72 0.25 115.31 118.16 1gd8 h LEU 29 Ca 0.19 -0.10 -0.00 0.00 -0.00 0.00 0.00 57.88 57.96 1gd8 h LEU 29 Cb 0.32 -0.07 -0.00 0.00 -0.00 0.00 0.00 40.66 40.91 1gd8 h LEU 29 CO -0.00 0.64 -0.05 0.74 -0.00 0.00 0.00 178.44 179.77 1gd8 h THR 30 N 0.19 0.30 0.00 0.22 2.02 -1.07 -3.37 112.91 111.19 1gd8 h THR 30 Ca 0.02 -1.23 0.00 0.00 0.77 0.00 0.00 66.41 65.97 1gd8 h THR 30 Cb 0.83 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1gd8 h THR 30 CO 0.07 0.10 -0.38 1.41 0.37 0.00 0.00 175.52 177.08 1gd8 n HIS 31 N -4.74 0.26 -0.97 3.16 8.25 -0.36 -4.93 115.22 115.90 1gd8 n HIS 31 Ca -0.02 0.08 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1gd8 n HIS 31 Cb 0.10 -0.49 0.00 0.00 1.12 0.00 0.00 29.99 30.72 1gd8 n HIS 31 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1gd8 n GLY 32 N 1.43 0.94 3.34 -1.41 0.00 0.86 -4.99 105.19 105.36 1gd8 n GLY 32 Ca 0.05 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.03 0.91 0.01 1.61 1.70 -1.17 -3.29 118.95 118.68 1gd8 s ARG 33 Ca 0.00 -0.25 -0.14 0.00 -0.47 0.00 0.00 55.73 54.86 1gd8 s ARG 33 Cb 0.00 0.41 0.02 0.00 -0.57 0.00 0.00 34.95 34.81 1gd8 s ARG 33 CO 0.00 -0.30 0.30 0.42 -1.08 0.00 0.00 175.30 174.64 1gd8 s ILE 34 N -2.15 0.07 -0.06 4.99 -1.09 0.65 -4.37 121.20 119.24 1gd8 s ILE 34 Ca -0.07 -0.56 0.01 0.00 -2.23 0.00 0.00 60.65 57.80 1gd8 s ILE 34 Cb -0.01 -0.73 0.02 0.00 -1.58 0.00 0.00 42.46 40.15 1gd8 s ILE 34 CO 0.00 -0.31 -0.08 -0.89 -1.23 0.00 0.00 174.94 172.44 1gd8 s THR 35 N -1.78 0.81 0.00 2.92 2.01 -1.26 -0.07 115.64 118.28 1gd8 s THR 35 Ca -0.10 -0.27 0.00 0.00 0.31 0.00 0.00 61.69 61.62 1gd8 s THR 35 Cb -0.04 -0.79 0.00 0.00 0.01 0.00 0.00 72.50 71.68 1gd8 s THR 35 CO 0.01 0.29 0.00 0.35 -0.69 0.00 0.00 174.62 174.58 1gd8 n THR 36 N 4.05 0.00 -1.87 -0.82 -2.24 -0.92 -5.00 114.28 107.48 1gd8 n THR 36 Ca -0.23 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.25 1gd8 n THR 36 Cb 0.51 0.00 0.05 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 -2.22 3.47 0.15 4.28 -4.23 -1.26 -0.94 115.64 114.89 1gd8 s THR 37 Ca 0.00 0.48 -0.17 0.00 -1.18 0.00 0.00 61.69 60.82 1gd8 s THR 37 Cb 0.00 -3.47 0.02 0.00 1.34 0.00 0.00 72.50 70.39 1gd8 s THR 37 CO 0.00 -0.62 1.74 0.58 -0.54 0.00 0.00 174.62 175.77 1gd8 h VAL 38 N -0.67 0.86 0.18 2.29 2.07 -1.71 -1.15 116.25 118.12 1gd8 h VAL 38 Ca -0.45 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1gd8 h VAL 38 Cb 1.25 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1gd8 h VAL 38 CO 0.64 0.04 -0.09 -0.65 0.02 0.00 0.00 177.57 177.53 1gd8 h PRO 39 N 0.20 -0.24 -0.30 1.57 0.11 -1.93 -2.15 132.00 129.26 1gd8 h PRO 39 Ca 0.15 0.02 0.05 0.00 0.11 0.00 0.00 66.00 66.33 1gd8 h PRO 39 Cb 0.16 0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.31 1gd8 h PRO 39 CO -0.19 -0.09 0.21 0.87 -0.21 0.00 0.00 178.00 178.58 1gd8 h LYS 40 N -0.33 0.21 -0.41 1.05 1.57 -1.93 -1.43 116.57 115.32 1gd8 h LYS 40 Ca -0.03 -0.01 -0.15 0.00 -1.87 0.00 0.00 60.65 58.60 1gd8 h LYS 40 Cb 0.25 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 1gd8 h LYS 40 CO 0.04 0.14 -0.32 0.00 -0.57 0.00 0.00 179.45 178.74 1gd8 h ALA 41 N 1.83 0.65 -0.33 3.86 0.00 -0.88 -1.44 119.26 122.97 1gd8 h ALA 41 Ca 0.13 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 1gd8 h ALA 41 Cb 0.25 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1gd8 h ALA 41 CO -0.02 0.67 -0.15 0.87 0.00 0.00 0.00 179.25 180.62 1gd8 h LYS 42 N 0.77 0.68 -0.52 0.00 1.57 -0.64 -1.30 116.57 117.13 1gd8 h LYS 42 Ca 0.08 -0.29 -0.06 0.00 -1.87 0.00 0.00 60.65 58.50 1gd8 h LYS 42 Cb 0.90 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.17 1gd8 h LYS 42 CO 0.08 0.88 0.06 0.93 -0.57 0.00 0.00 179.45 180.84 1gd8 h GLU 43 N 0.45 0.83 0.06 3.15 5.08 -1.26 -2.73 114.58 120.16 1gd8 h GLU 43 Ca 0.07 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1gd8 h GLU 43 Cb 0.67 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1gd8 h GLU 43 CO 0.05 0.79 -0.03 1.25 -1.00 0.00 0.00 179.01 180.07 1gd8 h LEU 44 N 0.78 -0.07 -1.12 1.33 6.46 -1.17 -2.39 115.31 119.14 1gd8 h LEU 44 Ca 0.16 -0.35 0.22 0.00 -0.12 0.00 0.00 57.88 57.79 1gd8 h LEU 44 Cb 0.39 0.02 -0.11 0.00 -0.73 0.00 0.00 40.66 40.23 1gd8 h LEU 44 CO 0.01 0.32 0.62 -0.09 -0.62 0.00 0.00 178.44 178.68 1gd8 h ARG 45 N -0.47 0.59 -0.16 1.25 2.43 -1.15 0.86 114.38 117.72 1gd8 h ARG 45 Ca -0.01 -0.04 -0.18 0.00 -0.81 0.00 0.00 59.98 58.94 1gd8 h ARG 45 Cb 0.41 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1gd8 h ARG 45 CO 0.01 0.39 -0.64 0.78 -1.51 0.00 0.00 179.97 179.00 1gd8 h GLY 46 N 0.61 0.66 0.92 2.80 0.00 -1.39 -2.03 103.07 104.63 1gd8 h GLY 46 Ca 0.59 -0.84 -0.06 0.00 0.00 0.00 0.00 47.33 47.01 1gd8 h GLY 46 CO -0.37 0.76 -0.04 -2.75 0.00 0.00 0.00 176.54 174.13 1gd8 h PHE 47 N 0.44 0.70 -0.17 5.60 3.57 -0.40 -2.46 116.94 124.22 1gd8 h PHE 47 Ca -0.01 -0.14 -0.02 0.00 3.53 0.00 0.00 57.97 61.33 1gd8 h PHE 47 Cb 1.22 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.78 1gd8 h PHE 47 CO 0.06 0.77 0.01 0.28 -2.23 0.00 0.00 178.31 177.20 1gd8 h VAL 48 N 0.43 1.24 -0.41 1.41 2.07 -0.99 -2.28 116.25 117.73 1gd8 h VAL 48 Ca 0.09 -0.79 0.05 0.00 0.82 0.00 0.00 66.70 66.87 1gd8 h VAL 48 Cb 0.52 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 1gd8 h VAL 48 CO 0.03 0.24 0.27 0.44 0.02 0.00 0.00 177.57 178.57 1gd8 h ASP 49 N 0.05 0.30 0.18 0.57 3.32 -1.38 0.65 116.42 120.12 1gd8 h ASP 49 Ca 0.05 -0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.94 1gd8 h ASP 49 Cb 0.35 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 1gd8 h ASP 49 CO 0.01 0.20 -0.58 -0.74 -1.72 0.00 0.00 179.24 176.41 1gd8 h HIS 50 N 0.35 0.52 -0.18 4.55 -0.00 -1.23 -2.14 115.15 117.02 1gd8 h HIS 50 Ca 0.17 -0.19 -0.21 0.00 -0.00 0.00 0.00 60.37 60.14 1gd8 h HIS 50 Cb 0.25 -0.10 0.01 0.00 -0.00 0.00 0.00 27.41 27.58 1gd8 h HIS 50 CO -0.00 0.89 -0.71 -0.07 -0.00 0.00 0.00 177.93 178.04 1gd8 h LEU 51 N 0.31 0.88 -1.09 0.26 3.38 -0.42 -3.04 115.31 115.59 1gd8 h LEU 51 Ca -0.00 -0.55 -0.09 0.00 0.09 0.00 0.00 57.88 57.33 1gd8 h LEU 51 Cb 1.11 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 1gd8 h LEU 51 CO 0.10 1.34 -0.34 0.40 0.09 0.00 0.00 178.44 180.02 1gd8 h ILE 52 N 0.53 1.28 -0.42 1.22 2.04 -0.92 -1.93 117.51 119.31 1gd8 h ILE 52 Ca -0.03 -1.33 -0.01 0.00 1.00 0.00 0.00 64.86 64.50 1gd8 h ILE 52 Cb 1.32 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 38.97 1gd8 h ILE 52 CO 0.15 0.40 0.24 -0.74 0.00 0.00 0.00 178.15 178.19 1gd8 h HIS 53 N 0.17 0.57 -0.18 1.37 -0.00 -1.32 -0.60 115.15 115.17 1gd8 h HIS 53 Ca 0.02 -0.01 -0.12 0.00 -0.00 0.00 0.00 60.37 60.27 1gd8 h HIS 53 Cb 0.70 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 27.91 1gd8 h HIS 53 CO 0.01 0.42 -0.39 -0.07 -0.00 0.00 0.00 177.93 177.90 1gd8 h LEU 54 N 0.55 0.42 -1.12 0.26 3.38 -1.39 -1.45 115.31 115.95 1gd8 h LEU 54 Ca 0.15 -0.18 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 1gd8 h LEU 54 Cb 0.03 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1gd8 h LEU 54 CO -0.03 0.78 -0.36 0.00 0.09 0.00 0.00 178.44 178.92 1gd8 h ALA 55 N 1.25 1.27 -0.05 1.53 0.00 -1.06 0.51 119.26 122.71 1gd8 h ALA 55 Ca 0.03 -0.36 -0.22 0.00 0.00 0.00 0.00 54.91 54.36 1gd8 h ALA 55 Cb 0.84 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.56 1gd8 h ALA 55 CO 0.07 0.51 -0.88 0.87 0.00 0.00 0.00 179.25 179.82 1gd8 h LYS 56 N 0.13 0.55 0.00 0.00 1.57 -0.69 -2.37 116.57 115.76 1gd8 h LYS 56 Ca 0.01 -0.52 -0.02 0.00 -1.87 0.00 0.00 60.65 58.25 1gd8 h LYS 56 Cb 0.69 0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.13 1gd8 h LYS 56 CO 0.05 1.15 -0.11 -0.09 -0.57 0.00 0.00 179.45 179.89 1gd8 h ARG 57 N 0.34 0.00 -6.23 3.15 9.65 -0.93 -3.47 114.38 116.89 1gd8 h ARG 57 Ca -0.07 0.00 -0.11 0.00 -1.10 0.00 0.00 59.98 58.70 1gd8 h ARG 57 Cb 1.50 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 30.08 1gd8 h ARG 57 CO 0.16 0.11 -0.22 0.41 2.80 0.00 0.00 179.97 183.23 1gd8 n GLY 58 N -0.45 -0.23 3.53 2.80 0.00 0.14 -4.96 105.19 106.03 1gd8 n GLY 58 Ca -0.01 0.10 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.28 2.88 0.22 1.61 -4.77 -1.26 -4.99 116.67 107.08 1gd8 s ASP 59 Ca 0.04 -1.64 -0.14 0.00 -3.30 0.00 0.00 52.55 47.52 1gd8 s ASP 59 Cb -0.02 0.44 0.26 0.00 -1.09 0.00 0.00 42.92 42.51 1gd8 s ASP 59 CO 0.19 -0.89 1.60 0.17 0.70 0.00 0.00 175.17 176.95 1gd8 h LEU 60 N 1.78 -0.77 -0.29 2.11 -0.00 -2.00 -0.51 115.31 115.64 1gd8 h LEU 60 Ca -0.37 0.22 -0.19 0.00 -0.00 0.00 0.00 57.88 57.54 1gd8 h LEU 60 Cb 1.27 0.48 0.00 0.00 -0.00 0.00 0.00 40.66 42.41 1gd8 h LEU 60 CO 0.60 -0.25 -0.59 0.45 -0.00 0.00 0.00 178.44 178.65 1gd8 h HIS 61 N -0.03 1.08 -0.12 0.17 3.86 -1.99 -2.97 115.15 115.15 1gd8 h HIS 61 Ca 0.33 -0.40 -0.00 0.00 -1.16 0.00 0.00 60.37 59.13 1gd8 h HIS 61 Cb 0.53 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.80 1gd8 h HIS 61 CO -0.59 1.23 0.06 0.00 0.86 0.00 0.00 177.93 179.49 1gd8 h ALA 62 N 0.68 0.16 0.00 2.45 0.00 -1.73 -2.10 119.26 118.72 1gd8 h ALA 62 Ca 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1gd8 h ALA 62 Cb 1.20 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1gd8 h ALA 62 CO 0.13 -0.28 -0.03 -0.09 0.00 0.00 0.00 179.25 178.97 1gd8 h ARG 63 N 0.08 0.00 0.02 0.00 2.43 -1.15 -1.02 114.38 114.74 1gd8 h ARG 63 Ca 0.04 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1gd8 h ARG 63 Cb 0.11 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1gd8 h ARG 63 CO -0.01 0.03 -0.01 -0.09 -1.51 0.00 0.00 179.97 178.38 1gd8 h ARG 64 N 0.00 -0.03 -0.06 0.20 2.43 -1.23 -2.90 114.38 112.78 1gd8 h ARG 64 Ca -0.00 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 1gd8 h ARG 64 Cb 0.07 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1gd8 h ARG 64 CO 0.00 0.52 -0.38 -0.07 -1.51 0.00 0.00 179.97 178.54 1gd8 h LEU 65 N -0.61 0.13 -0.59 3.80 -0.00 -1.01 -1.91 115.31 115.12 1gd8 h LEU 65 Ca -0.00 -0.05 -0.12 0.00 -0.00 0.00 0.00 57.88 57.71 1gd8 h LEU 65 Cb 0.57 -0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 41.18 1gd8 h LEU 65 CO 0.01 0.50 -0.13 0.58 -0.00 0.00 0.00 178.44 179.39 1gd8 h VAL 66 N 0.11 1.27 -0.34 1.22 2.07 -1.26 -2.31 116.25 117.00 1gd8 h VAL 66 Ca 0.01 -1.28 -0.15 0.00 0.82 0.00 0.00 66.70 66.10 1gd8 h VAL 66 Cb 0.72 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1gd8 h VAL 66 CO 0.05 0.45 -0.39 0.25 0.02 0.00 0.00 177.57 177.95 1gd8 h LEU 67 N 0.87 0.87 -1.55 2.57 6.46 -1.33 0.36 115.31 123.56 1gd8 h LEU 67 Ca 0.13 -0.40 -0.05 0.00 -0.12 0.00 0.00 57.88 57.45 1gd8 h LEU 67 Cb 0.69 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.37 1gd8 h LEU 67 CO 0.05 1.16 -0.22 -0.09 -0.62 0.00 0.00 178.44 178.71 1gd8 h ARG 68 N 0.67 0.00 0.13 1.25 2.43 -1.22 -3.06 114.38 114.59 1gd8 h ARG 68 Ca 0.05 0.00 -0.34 0.00 -0.81 0.00 0.00 59.98 58.88 1gd8 h ARG 68 Cb 0.96 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 1gd8 h ARG 68 CO 0.09 0.22 -1.80 -0.44 -1.51 0.00 0.00 179.97 176.53 1gd8 h ASP 69 N 0.00 0.44 -3.49 -3.80 5.19 -1.20 -3.43 116.42 110.13 1gd8 h ASP 69 Ca -0.00 -0.91 -0.72 0.00 -0.62 0.00 0.00 57.03 54.79 1gd8 h ASP 69 Cb 0.40 -0.14 -0.26 0.00 0.18 0.00 0.00 39.33 39.51 1gd8 h ASP 69 CO 0.03 1.79 -0.47 -0.22 -3.12 0.00 0.00 179.24 177.24 1gd8 s LEU 70 N -7.24 5.01 -0.38 1.55 0.20 0.13 -4.84 118.68 113.10 1gd8 s LEU 70 Ca -0.21 -1.27 -0.06 0.00 0.69 0.00 0.00 54.13 53.29 1gd8 s LEU 70 Cb 0.06 -2.02 -0.19 0.00 -0.43 0.00 0.00 46.19 43.61 1gd8 s LEU 70 CO 0.78 -0.48 3.03 0.00 -0.29 0.00 0.00 176.35 179.39 1gd8 n GLN 71 N 4.98 2.11 -3.58 1.98 1.13 -1.23 -4.31 117.38 118.45 1gd8 n GLN 71 Ca -0.11 -1.15 -0.10 0.00 -1.94 0.00 0.00 57.00 53.69 1gd8 n GLN 71 Cb 0.44 -2.13 -0.10 0.00 0.11 0.00 0.00 30.24 28.56 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 2.27 0.09 0.03 1.08 3.68 -1.26 -5.06 116.67 117.50 1gd8 s ASP 72 Ca 0.58 0.67 -0.27 0.00 2.13 0.00 0.00 52.55 55.65 1gd8 s ASP 72 Cb 0.24 1.09 -0.17 0.00 -1.45 0.00 0.00 42.92 42.63 1gd8 s ASP 72 CO -0.01 -0.25 1.39 0.58 0.13 0.00 0.00 175.17 177.01 1gd8 h VAL 73 N 6.21 0.58 -1.01 1.11 2.07 -1.96 -2.21 116.25 121.03 1gd8 h VAL 73 Ca -0.16 -0.34 0.23 0.00 0.82 0.00 0.00 66.70 67.25 1gd8 h VAL 73 Cb 1.12 0.74 -0.11 0.00 -1.52 0.00 0.00 31.29 31.52 1gd8 h VAL 73 CO 0.16 0.06 0.62 0.11 0.02 0.00 0.00 177.57 178.54 1gd8 h LYS 74 N -0.76 0.57 0.03 1.57 6.56 -1.99 0.15 116.57 122.71 1gd8 h LYS 74 Ca -0.06 -0.03 -0.17 0.00 -1.06 0.00 0.00 60.65 59.33 1gd8 h LYS 74 Cb 0.52 -0.13 0.02 0.00 -0.57 0.00 0.00 32.23 32.07 1gd8 h LYS 74 CO 0.09 0.38 -0.69 -0.07 -2.06 0.00 0.00 179.45 177.10 1gd8 h LEU 75 N 0.59 0.56 -1.65 2.94 3.38 -1.97 -1.09 115.31 118.06 1gd8 h LEU 75 Ca 0.61 -0.80 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 1gd8 h LEU 75 Cb 1.19 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1gd8 h LEU 75 CO -0.41 1.29 0.14 0.58 0.09 0.00 0.00 178.44 180.13 1gd8 h VAL 76 N -0.11 1.09 0.18 1.22 2.07 -0.70 0.73 116.25 120.74 1gd8 h VAL 76 Ca -0.09 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 1gd8 h VAL 76 Cb 1.42 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 1gd8 h VAL 76 CO 0.13 0.10 -0.09 -0.09 0.02 0.00 0.00 177.57 177.65 1gd8 h ARG 77 N 0.37 -0.23 -0.56 1.57 2.43 -0.68 -2.83 114.38 114.46 1gd8 h ARG 77 Ca 0.10 0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.38 1gd8 h ARG 77 Cb 0.03 0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 29.55 1gd8 h ARG 77 CO -0.02 0.08 0.12 -0.22 -1.51 0.00 0.00 179.97 178.42 1gd8 h LYS 78 N -0.55 0.25 -0.03 0.20 3.64 -0.36 -1.85 116.57 117.87 1gd8 h LYS 78 Ca -0.02 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.37 1gd8 h LYS 78 Cb 0.42 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.12 1gd8 h LYS 78 CO 0.04 0.17 -0.47 -0.07 -2.27 0.00 0.00 179.45 176.85 1gd8 h LEU 79 N 0.26 -1.44 -0.16 5.20 3.38 -0.85 0.38 115.31 122.07 1gd8 h LEU 79 Ca 0.28 0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.41 1gd8 h LEU 79 Cb 0.40 0.56 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1gd8 h LEU 79 CO -0.36 -0.48 0.05 -0.26 0.09 0.00 0.00 178.44 177.48 1gd8 h PHE 80 N -0.60 0.27 -0.01 1.13 -1.00 -1.23 0.43 116.94 115.92 1gd8 h PHE 80 Ca 0.04 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.79 1gd8 h PHE 80 Cb 0.68 -0.08 0.00 0.00 3.61 0.00 0.00 35.95 40.16 1gd8 h PHE 80 CO -0.48 0.37 -0.21 -0.25 -1.61 0.00 0.00 178.31 176.13 1gd8 n ASP 81 N -4.83 1.54 0.06 2.17 10.43 -0.72 -4.29 116.55 120.91 1gd8 n ASP 81 Ca -0.05 -1.27 0.00 0.00 2.57 0.00 0.00 54.79 56.04 1gd8 n ASP 81 Cb 0.15 0.16 0.00 0.00 1.84 0.00 0.00 41.12 43.27 1gd8 n ASP 81 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34 1gd8 n GLU 82 N -0.13 0.00 -0.07 -1.24 2.13 0.13 -4.83 120.64 116.63 1gd8 n GLU 82 Ca 0.13 0.00 -0.12 0.00 0.66 0.00 0.00 57.16 57.83 1gd8 n GLU 82 Cb 0.40 -0.17 -0.06 0.00 0.27 0.00 0.00 31.44 31.88 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 1.31 -0.05 6.31 1.08 -1.07 -3.24 117.51 121.86 1gd8 h ILE 83 Ca 0.00 -1.18 0.02 0.00 -0.39 0.00 0.00 64.86 63.31 1gd8 h ILE 83 Cb 0.00 1.66 -0.02 0.00 -3.07 0.00 0.00 36.82 35.39 1gd8 h ILE 83 CO 0.00 0.36 -0.05 0.00 -0.69 0.00 0.00 178.15 177.77 1gd8 h ALA 84 N 0.69 -0.00 -0.93 1.87 0.00 -0.36 -2.70 119.26 117.82 1gd8 h ALA 84 Ca 0.04 0.02 0.15 0.00 0.00 0.00 0.00 54.91 55.12 1gd8 h ALA 84 Cb 0.60 0.10 -0.09 0.00 0.00 0.00 0.00 17.79 18.39 1gd8 h ALA 84 CO 0.03 -0.53 0.54 -1.35 0.00 0.00 0.00 179.25 177.95 1gd8 h PRO 85 N -0.06 0.76 0.00 0.00 0.11 -1.75 -0.40 132.00 130.67 1gd8 h PRO 85 Ca 0.04 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.10 1gd8 h PRO 85 Cb 0.11 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.05 1gd8 h PRO 85 CO -0.08 0.50 -0.02 -0.09 -0.21 0.00 0.00 178.00 178.10 1gd8 h ARG 86 N 0.78 0.00 -0.27 1.05 2.43 -1.51 -2.35 114.38 114.51 1gd8 h ARG 86 Ca 0.50 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.56 1gd8 h ARG 86 Cb 0.65 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.13 1gd8 h ARG 86 CO -0.33 0.02 -0.10 0.66 -1.51 0.00 0.00 179.97 178.70 1gd8 n TYR 87 N -3.89 0.86 0.35 2.20 0.53 -0.18 -4.50 117.16 112.53 1gd8 n TYR 87 Ca -0.03 -1.41 0.13 0.00 -1.02 0.00 0.00 57.90 55.57 1gd8 n TYR 87 Cb 0.10 -0.41 0.54 0.00 -1.03 0.00 0.00 39.34 38.55 1gd8 n TYR 87 CO 0.00 0.00 0.00 -0.09 -1.02 0.00 0.00 176.86 175.75 1gd8 h ARG 88 N 1.07 0.00 0.06 -0.72 9.65 -1.14 -2.85 114.38 120.44 1gd8 h ARG 88 Ca 0.14 0.00 -0.33 0.00 -1.10 0.00 0.00 59.98 58.69 1gd8 h ARG 88 Cb 1.50 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 30.05 1gd8 h ARG 88 CO 0.29 0.00 -1.82 -0.40 2.80 0.00 0.00 179.97 180.83 1gd8 n ASP 89 N -2.37 2.00 -4.78 -3.80 5.68 -1.26 -4.95 116.55 107.07 1gd8 n ASP 89 Ca 0.01 0.27 -0.35 0.00 -0.50 0.00 0.00 54.79 54.22 1gd8 n ASP 89 Cb 0.21 -0.86 -0.01 0.00 -1.14 0.00 0.00 41.12 39.32 1gd8 n ASP 89 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 1gd8 s ARG 90 N -2.48 3.60 -0.39 0.11 3.52 -1.08 -5.00 118.95 117.23 1gd8 s ARG 90 Ca -0.27 1.58 0.10 0.00 -0.13 0.00 0.00 55.73 57.01 1gd8 s ARG 90 Cb 0.07 -2.14 0.44 0.00 -1.56 0.00 0.00 34.95 31.76 1gd8 s ARG 90 CO 0.67 -0.64 1.06 0.94 -0.81 0.00 0.00 175.30 176.51 1gd8 n GLN 91 N -0.97 2.58 0.00 5.12 7.27 -1.26 -4.94 117.38 125.18 1gd8 n GLN 91 Ca 0.10 -4.03 0.00 0.00 0.07 0.00 0.00 57.00 53.14 1gd8 n GLN 91 Cb 0.51 -1.88 0.00 0.00 2.41 0.00 0.00 30.24 31.28 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 -0.34 1.87 3.96 1.69 0.00 -1.26 -5.04 105.19 106.06 1gd8 n GLY 92 Ca 0.28 -2.00 -0.27 0.00 0.00 0.00 0.00 46.02 44.03 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 -1.62 -0.28 0.20 -0.02 0.00 -1.26 -4.84 105.19 97.36 1gd8 n GLY 93 Ca 0.00 0.15 0.13 0.00 0.00 0.00 0.00 46.02 46.29 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 -1.81 0.00 -4.08 1.61 -1.99 -1.96 -3.45 116.97 105.29 1gd8 h TYR 94 Ca -0.62 0.00 -0.69 0.00 2.00 0.00 0.00 58.73 59.42 1gd8 h TYR 94 Cb 1.37 0.00 -0.29 0.00 2.00 0.00 0.00 36.73 39.81 1gd8 h TYR 94 CO 0.51 0.00 -0.85 -0.08 -0.00 0.00 0.00 178.16 177.74 1gd8 s THR 95 N -3.24 2.36 -0.13 -2.88 -1.32 -1.26 -0.26 115.64 108.90 1gd8 s THR 95 Ca 0.07 -0.97 -0.05 0.00 -1.21 0.00 0.00 61.69 59.53 1gd8 s THR 95 Cb 0.07 -1.88 -0.04 0.00 -1.51 0.00 0.00 72.50 69.15 1gd8 s THR 95 CO 0.63 0.57 0.06 -0.60 -2.21 0.00 0.00 174.62 173.08 1gd8 s ARG 96 N -0.33 3.46 -0.20 7.08 3.52 0.19 -4.84 118.95 127.83 1gd8 s ARG 96 Ca 0.02 -0.30 -0.01 0.00 -0.13 0.00 0.00 55.73 55.30 1gd8 s ARG 96 Cb -0.12 -3.05 0.01 0.00 -1.56 0.00 0.00 34.95 30.22 1gd8 s ARG 96 CO 0.02 0.58 -0.12 0.08 -0.81 0.00 0.00 175.30 175.05 1gd8 s VAL 97 N -0.50 2.73 -0.23 7.11 1.01 -1.26 -1.12 120.40 128.15 1gd8 s VAL 97 Ca 0.10 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.37 1gd8 s VAL 97 Cb -0.12 -2.21 0.05 0.00 0.00 0.00 0.00 36.38 34.09 1gd8 s VAL 97 CO 0.02 0.47 -0.13 -0.76 0.00 0.00 0.00 175.10 174.70 1gd8 s LEU 98 N 1.38 2.88 0.28 3.92 1.43 0.71 -4.94 118.68 124.34 1gd8 s LEU 98 Ca 0.05 -1.11 -0.29 0.00 -1.03 0.00 0.00 54.13 51.75 1gd8 s LEU 98 Cb -0.14 -1.47 -0.10 0.00 0.03 0.00 0.00 46.19 44.51 1gd8 s LEU 98 CO -0.08 -0.13 1.31 -0.75 0.23 0.00 0.00 176.35 176.93 1gd8 s LYS 99 N 1.21 4.38 0.27 1.70 2.20 -1.26 -0.36 119.74 127.87 1gd8 s LYS 99 Ca -0.04 2.15 0.04 0.00 -0.36 0.00 0.00 55.97 57.76 1gd8 s LYS 99 Cb -0.17 -3.12 -0.03 0.00 -1.51 0.00 0.00 37.83 32.99 1gd8 s LYS 99 CO -0.08 -0.21 0.41 -0.51 -0.36 0.00 0.00 175.35 174.61 1gd8 s LEU 100 N -1.05 4.22 0.09 5.43 1.43 -0.24 -4.90 118.68 123.66 1gd8 s LEU 100 Ca 0.52 0.12 -0.06 0.00 -1.03 0.00 0.00 54.13 53.68 1gd8 s LEU 100 Cb -0.38 -2.94 -0.23 0.00 0.03 0.00 0.00 46.19 42.67 1gd8 s LEU 100 CO 0.46 -0.16 1.18 0.00 0.23 0.00 0.00 176.35 178.06 1gd8 h ALA 101 N 1.05 0.15 -2.19 4.21 0.00 -1.95 -3.41 119.26 117.12 1gd8 h ALA 101 Ca -0.51 -0.82 -0.47 0.00 0.00 0.00 0.00 54.91 53.12 1gd8 h ALA 101 Cb 1.23 0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.06 1gd8 h ALA 101 CO 0.60 0.87 0.34 -2.00 0.00 0.00 0.00 179.25 179.06 1gd8 s GLU 102 N -2.88 3.98 0.41 0.00 2.12 -1.26 -4.96 118.70 116.11 1gd8 s GLU 102 Ca -0.06 0.93 0.03 0.00 0.36 0.00 0.00 54.97 56.23 1gd8 s GLU 102 Cb 0.07 -2.17 -0.04 0.00 0.26 0.00 0.00 34.13 32.25 1gd8 s GLU 102 CO 0.89 -0.20 0.07 -0.98 -0.54 0.00 0.00 175.26 174.50 1gd8 s ARG 103 N -3.89 1.92 -0.14 4.30 1.70 -1.26 -3.29 118.95 118.30 1gd8 s ARG 103 Ca 0.58 -2.16 -0.29 0.00 -0.47 0.00 0.00 55.73 53.39 1gd8 s ARG 103 Cb -0.10 -0.96 -0.01 0.00 -0.57 0.00 0.00 34.95 33.31 1gd8 s ARG 103 CO 0.28 -0.35 1.02 -0.98 -1.08 0.00 0.00 175.30 174.19 1gd8 s ARG 104 N -3.79 4.38 0.65 3.89 1.70 -0.93 -4.78 118.95 120.06 1gd8 s ARG 104 Ca 0.24 1.39 0.34 0.00 -0.47 0.00 0.00 55.73 57.22 1gd8 s ARG 104 Cb 0.04 -3.57 1.84 0.00 -0.57 0.00 0.00 34.95 32.70 1gd8 s ARG 104 CO 0.12 -0.40 2.08 -0.09 -1.08 0.00 0.00 175.30 175.93 1gd8 h ARG 105 N 7.19 0.00 0.00 3.89 2.43 -1.97 0.80 114.38 126.71 1gd8 h ARG 105 Ca -0.28 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1gd8 h ARG 105 Cb 1.12 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 1gd8 h ARG 105 CO 0.89 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 179.76 1gd8 n GLY 106 N -1.24 -2.79 0.91 2.80 0.00 -1.26 -4.38 105.19 99.24 1gd8 n GLY 106 Ca -0.01 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.32 2.89 -2.36 1.61 3.85 -1.19 -5.00 116.55 116.03 1gd8 n ASP 107 Ca 0.00 -1.95 -0.02 0.00 -0.71 0.00 0.00 54.79 52.11 1gd8 n ASP 107 Cb 0.00 0.04 0.01 0.00 -1.35 0.00 0.00 41.12 39.82 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 1.35 -0.64 3.43 6.12 0.00 0.28 -5.00 105.19 110.74 1gd8 n GLY 108 Ca 0.14 0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.99 1gd8 n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gd8 s ALA 109 N -3.06 2.68 -0.08 4.61 0.00 -1.24 -4.81 121.76 119.86 1gd8 s ALA 109 Ca 0.07 -0.92 -0.29 0.00 0.00 0.00 0.00 51.96 50.81 1gd8 s ALA 109 Cb -0.01 -1.13 -0.06 0.00 0.00 0.00 0.00 23.12 21.92 1gd8 s ALA 109 CO 0.40 0.39 1.83 -1.25 0.00 0.00 0.00 175.76 177.13 1gd8 s PRO 110 N -0.17 3.94 0.44 0.00 0.04 -1.26 -2.20 135.00 135.79 1gd8 s PRO 110 Ca -0.00 2.19 -0.03 0.00 0.04 0.00 0.00 61.00 63.20 1gd8 s PRO 110 Cb -0.13 -4.11 -0.03 0.00 0.04 0.00 0.00 34.50 30.27 1gd8 s PRO 110 CO 0.03 -1.15 0.71 -0.51 0.04 0.00 0.00 177.00 176.11 1gd8 s LEU 111 N 5.02 3.74 -0.09 -3.56 1.43 -1.21 -2.05 118.68 121.97 1gd8 s LEU 111 Ca 0.82 0.74 -0.09 0.00 -1.03 0.00 0.00 54.13 54.56 1gd8 s LEU 111 Cb -0.34 -3.65 0.02 0.00 0.03 0.00 0.00 46.19 42.24 1gd8 s LEU 111 CO 0.34 -0.51 0.26 0.00 0.23 0.00 0.00 176.35 176.67 1gd8 s ALA 112 N -2.60 -0.64 -0.23 4.21 0.00 -0.12 -1.08 121.76 121.31 1gd8 s ALA 112 Ca 0.45 0.65 -0.11 0.00 0.00 0.00 0.00 51.96 52.95 1gd8 s ALA 112 Cb -0.10 -0.35 -0.05 0.00 0.00 0.00 0.00 23.12 22.62 1gd8 s ALA 112 CO 0.42 -0.14 0.19 -1.17 0.00 0.00 0.00 175.76 175.06 1gd8 s LEU 113 N -0.07 4.13 -0.09 0.00 1.98 0.51 -2.16 118.68 122.98 1gd8 s LEU 113 Ca -0.02 0.18 0.01 0.00 -2.89 0.00 0.00 54.13 51.41 1gd8 s LEU 113 Cb -0.02 -2.16 -0.02 0.00 0.66 0.00 0.00 46.19 44.64 1gd8 s LEU 113 CO 0.01 0.06 -0.12 -0.69 -1.89 0.00 0.00 176.35 173.72 1gd8 s VAL 114 N 1.03 3.24 0.26 1.68 1.01 0.90 -0.21 120.40 128.32 1gd8 s VAL 114 Ca 0.09 -0.63 -0.18 0.00 0.00 0.00 0.00 61.98 61.26 1gd8 s VAL 114 Cb -0.13 -2.33 0.01 0.00 0.00 0.00 0.00 36.38 33.93 1gd8 s VAL 114 CO 0.04 0.56 0.63 -1.83 0.00 0.00 0.00 175.10 174.50 1gd8 s GLU 115 N -0.27 1.67 -0.01 2.72 -1.05 -0.27 -0.26 118.70 121.23 1gd8 s GLU 115 Ca 0.02 -1.05 -0.28 0.00 -0.15 0.00 0.00 54.97 53.51 1gd8 s GLU 115 Cb -0.13 0.56 -0.03 0.00 -0.44 0.00 0.00 34.13 34.09 1gd8 s GLU 115 CO 0.03 -0.74 0.91 -0.51 0.95 0.00 0.00 175.26 175.90 1gd8 s LEU 116 N -2.94 4.36 0.47 1.83 1.43 -1.21 0.56 118.68 123.19 1gd8 s LEU 116 Ca 0.14 1.55 -0.23 0.00 -1.03 0.00 0.00 54.13 54.57 1gd8 s LEU 116 Cb -0.04 -3.46 -0.07 0.00 0.03 0.00 0.00 46.19 42.65 1gd8 s LEU 116 CO 0.06 -0.22 1.21 0.54 0.23 0.00 0.00 176.35 178.17 1gd8 s VAL 117 N 0.95 2.90 0.00 -1.59 0.11 0.64 -4.81 120.40 118.59 1gd8 s VAL 117 Ca 0.49 0.68 0.00 0.00 -2.93 0.00 0.00 61.98 60.21 1gd8 s VAL 117 Cb -0.20 -3.35 0.00 0.00 -1.53 0.00 0.00 36.38 31.30 1gd8 s VAL 117 CO 0.26 -0.00 0.00 1.21 -3.33 0.00 0.00 175.10 173.23