#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 0.15 4.04 0.02 -2.05 -2.28 113.55 113.43 1gd8 h SER 15 Ca 0.00 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.72 1gd8 h SER 15 Cb 0.00 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.55 1gd8 h SER 15 CO 0.00 0.08 -0.90 0.45 -1.14 0.00 0.00 176.83 175.32 1gd8 h HIS 16 N 0.00 0.80 0.46 3.45 3.86 -2.05 -2.84 115.15 118.82 1gd8 h HIS 16 Ca -0.00 -0.41 -0.02 0.00 -1.16 0.00 0.00 60.37 58.78 1gd8 h HIS 16 Cb 0.63 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.01 1gd8 h HIS 16 CO 0.00 1.22 -0.22 0.00 0.86 0.00 0.00 177.93 179.79 1gd8 h ARG 17 N 0.34 -0.59 -0.70 2.45 3.08 -1.90 -2.83 114.38 114.22 1gd8 h ARG 17 Ca -0.08 0.04 0.08 0.00 0.07 0.00 0.00 59.98 60.09 1gd8 h ARG 17 Cb 1.53 0.13 -0.04 0.00 0.08 0.00 0.00 29.97 31.67 1gd8 h ARG 17 CO 0.17 -0.30 0.46 -0.07 -1.07 0.00 0.00 179.97 179.16 1gd8 h LEU 18 N -0.84 0.59 -0.91 3.04 -0.00 -1.51 -0.07 115.31 115.61 1gd8 h LEU 18 Ca -0.06 0.01 -0.07 0.00 -0.00 0.00 0.00 57.88 57.75 1gd8 h LEU 18 Cb 0.57 -0.12 -0.02 0.00 -0.00 0.00 0.00 40.66 41.09 1gd8 h LEU 18 CO 0.10 0.37 0.01 0.00 -0.00 0.00 0.00 178.44 178.93 1gd8 h ALA 19 N 1.63 1.10 0.50 1.53 0.00 -1.48 -0.91 119.26 121.62 1gd8 h ALA 19 Ca 0.31 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1gd8 h ALA 19 Cb 0.36 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1gd8 h ALA 19 CO -0.11 0.58 -0.24 1.25 0.00 0.00 0.00 179.25 180.73 1gd8 h LEU 20 N 0.76 -0.57 -0.72 0.00 6.46 -0.94 -2.14 115.31 118.16 1gd8 h LEU 20 Ca 0.15 -0.07 0.16 0.00 -0.12 0.00 0.00 57.88 58.00 1gd8 h LEU 20 Cb 0.44 0.15 -0.12 0.00 -0.73 0.00 0.00 40.66 40.40 1gd8 h LEU 20 CO 0.02 -0.18 0.08 1.88 -0.62 0.00 0.00 178.44 179.61 1gd8 h TYR 21 N -1.02 0.09 -0.30 1.25 0.99 -0.99 0.32 116.97 117.30 1gd8 h TYR 21 Ca -0.07 0.05 0.03 0.00 2.00 0.00 0.00 58.73 60.74 1gd8 h TYR 21 Cb 0.60 0.07 -0.03 0.00 1.00 0.00 0.00 36.73 38.37 1gd8 h TYR 21 CO 0.01 -0.17 0.13 -0.09 -0.00 0.00 0.00 178.16 178.04 1gd8 h ARG 22 N 0.17 0.26 -0.25 4.88 2.43 -1.16 0.36 114.38 121.08 1gd8 h ARG 22 Ca 0.40 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.55 1gd8 h ARG 22 Cb 0.69 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.17 1gd8 h ARG 22 CO -0.58 0.18 0.13 -0.97 -1.51 0.00 0.00 179.97 177.22 1gd8 h ASN 23 N 0.27 0.32 -0.20 -3.80 -0.73 -0.29 -1.54 115.58 109.60 1gd8 h ASN 23 Ca 0.13 -0.09 -0.02 0.00 1.87 0.00 0.00 56.30 58.19 1gd8 h ASN 23 Cb 0.08 -0.08 -0.01 0.00 0.27 0.00 0.00 38.32 38.58 1gd8 h ASN 23 CO -0.12 0.32 0.06 1.56 -0.37 0.00 0.00 177.43 178.88 1gd8 h GLN 24 N 0.29 0.32 -0.61 6.67 4.20 -0.16 -2.99 115.11 122.84 1gd8 h GLN 24 Ca 0.09 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 1gd8 h GLN 24 Cb 0.08 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.78 1gd8 h GLN 24 CO -0.01 0.43 0.26 0.00 -0.67 0.00 0.00 178.83 178.84 1gd8 h ALA 25 N 0.88 1.32 0.25 3.87 0.00 -0.21 -1.23 119.26 124.13 1gd8 h ALA 25 Ca 0.06 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1gd8 h ALA 25 Cb 0.25 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1gd8 h ALA 25 CO -0.00 0.51 -0.33 0.87 0.00 0.00 0.00 179.25 180.31 1gd8 h LYS 26 N 0.86 -0.61 -0.57 0.00 1.57 -1.16 -0.13 116.57 116.53 1gd8 h LYS 26 Ca 0.21 0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 59.00 1gd8 h LYS 26 Cb 0.13 0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 1gd8 h LYS 26 CO -0.02 -0.41 0.23 0.66 -0.57 0.00 0.00 179.45 179.34 1gd8 h SER 27 N -0.63 0.75 -0.55 0.86 4.64 -1.37 -1.50 113.55 115.75 1gd8 h SER 27 Ca 0.00 -0.10 -0.12 0.00 -0.47 0.00 0.00 61.79 61.11 1gd8 h SER 27 Cb 0.61 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 1gd8 h SER 27 CO -0.11 0.68 -0.10 0.25 -0.87 0.00 0.00 176.83 176.67 1gd8 h LEU 28 N 0.82 1.05 -0.89 5.97 7.12 -0.89 -0.61 115.31 127.88 1gd8 h LEU 28 Ca 0.20 -0.35 -0.11 0.00 0.13 0.00 0.00 57.88 57.75 1gd8 h LEU 28 Cb 0.16 -0.29 -0.02 0.00 -0.53 0.00 0.00 40.66 39.99 1gd8 h LEU 28 CO -0.02 1.15 -0.52 -0.07 -0.13 0.00 0.00 178.44 178.85 1gd8 h LEU 29 N 0.93 0.00 0.00 2.25 4.07 -0.72 0.14 115.31 121.98 1gd8 h LEU 29 Ca 0.14 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 58.07 1gd8 h LEU 29 Cb 0.68 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.41 1gd8 h LEU 29 CO 0.05 0.52 -0.22 0.74 -1.08 0.00 0.00 178.44 178.45 1gd8 h THR 30 N 0.00 1.22 0.00 0.22 2.02 -1.05 -3.37 112.91 111.95 1gd8 h THR 30 Ca -0.01 -1.99 0.00 0.00 0.77 0.00 0.00 66.41 65.18 1gd8 h THR 30 Cb 0.98 2.38 0.00 0.00 -1.74 0.00 0.00 68.15 69.76 1gd8 h THR 30 CO 0.07 0.41 -0.44 1.41 0.37 0.00 0.00 175.52 177.34 1gd8 n HIS 31 N -4.62 0.09 -0.34 3.16 8.25 -0.26 -4.95 115.22 116.56 1gd8 n HIS 31 Ca -0.11 0.02 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 1gd8 n HIS 31 Cb 0.41 -0.35 0.00 0.00 1.12 0.00 0.00 29.99 31.17 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 1.48 1.91 3.41 -1.41 0.00 0.50 -4.98 105.19 106.09 1gd8 n GLY 32 Ca 0.05 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.15 1.06 0.03 1.61 1.70 -1.21 -3.36 118.95 118.63 1gd8 s ARG 33 Ca 0.00 -0.20 -0.18 0.00 -0.47 0.00 0.00 55.73 54.87 1gd8 s ARG 33 Cb 0.00 0.49 0.04 0.00 -0.57 0.00 0.00 34.95 34.90 1gd8 s ARG 33 CO 0.00 -0.38 0.41 -1.50 -1.08 0.00 0.00 175.30 172.75 1gd8 s ILE 34 N -2.43 0.05 -0.05 4.99 -1.16 0.53 -4.47 121.20 118.65 1gd8 s ILE 34 Ca -0.05 -0.45 0.03 0.00 -0.51 0.00 0.00 60.65 59.67 1gd8 s ILE 34 Cb -0.01 -0.92 0.01 0.00 0.61 0.00 0.00 42.46 42.15 1gd8 s ILE 34 CO -0.01 -0.25 -0.13 -0.89 -2.81 0.00 0.00 174.94 170.85 1gd8 s THR 35 N -2.32 1.19 0.00 4.00 2.01 -1.26 0.29 115.64 119.55 1gd8 s THR 35 Ca -0.06 -0.54 0.00 0.00 0.31 0.00 0.00 61.69 61.40 1gd8 s THR 35 Cb -0.01 -1.06 0.00 0.00 0.01 0.00 0.00 72.50 71.44 1gd8 s THR 35 CO -0.01 0.36 0.00 0.35 -0.69 0.00 0.00 174.62 174.63 1gd8 n THR 36 N 3.56 0.00 -1.57 -0.82 -2.24 -0.89 -4.99 114.28 107.32 1gd8 n THR 36 Ca -0.21 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.28 1gd8 n THR 36 Cb 0.52 0.00 0.11 0.00 -2.10 0.00 0.00 70.33 68.86 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 2.64 0.13 4.28 -4.23 -1.26 -0.71 115.64 114.27 1gd8 s THR 37 Ca 0.00 0.21 -0.19 0.00 -1.18 0.00 0.00 61.69 60.52 1gd8 s THR 37 Cb 0.00 -2.97 -0.04 0.00 1.34 0.00 0.00 72.50 70.83 1gd8 s THR 37 CO 0.00 -0.27 1.73 0.58 -0.54 0.00 0.00 174.62 176.12 1gd8 h VAL 38 N -1.22 0.90 0.44 2.29 2.07 -0.96 -1.26 116.25 118.50 1gd8 h VAL 38 Ca -0.48 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 66.98 1gd8 h VAL 38 Cb 1.29 0.77 -0.00 0.00 -1.52 0.00 0.00 31.29 31.83 1gd8 h VAL 38 CO 0.61 0.02 -0.27 -0.65 0.02 0.00 0.00 177.57 177.30 1gd8 h PRO 39 N 0.12 -0.65 -0.31 1.57 0.11 -1.93 -2.20 132.00 128.72 1gd8 h PRO 39 Ca 0.10 0.04 0.08 0.00 0.11 0.00 0.00 66.00 66.33 1gd8 h PRO 39 Cb 0.09 0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 1gd8 h PRO 39 CO -0.13 -0.43 0.22 0.87 -0.21 0.00 0.00 178.00 178.31 1gd8 h LYS 40 N -0.68 0.05 -0.28 1.05 1.57 -1.92 -1.50 116.57 114.86 1gd8 h LYS 40 Ca -0.05 -0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.56 1gd8 h LYS 40 Cb 0.55 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 1gd8 h LYS 40 CO 0.05 0.03 -0.50 0.00 -0.57 0.00 0.00 179.45 178.46 1gd8 h ALA 41 N 1.85 0.57 -0.27 3.86 0.00 -0.83 -1.65 119.26 122.79 1gd8 h ALA 41 Ca 0.14 -0.50 -0.18 0.00 0.00 0.00 0.00 54.91 54.38 1gd8 h ALA 41 Cb 0.51 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1gd8 h ALA 41 CO -0.01 0.68 -0.55 0.87 0.00 0.00 0.00 179.25 180.24 1gd8 h LYS 42 N 0.62 0.80 -0.57 0.00 1.57 -0.69 -1.30 116.57 117.00 1gd8 h LYS 42 Ca 0.03 -0.51 -0.06 0.00 -1.87 0.00 0.00 60.65 58.24 1gd8 h LYS 42 Cb 1.09 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.43 1gd8 h LYS 42 CO 0.11 1.14 0.13 0.93 -0.57 0.00 0.00 179.45 181.18 1gd8 h GLU 43 N 0.62 0.90 0.20 3.15 5.08 -1.35 -2.62 114.58 120.54 1gd8 h GLU 43 Ca 0.01 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.17 1gd8 h GLU 43 Cb 1.14 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1gd8 h GLU 43 CO 0.12 0.81 -0.09 1.25 -1.00 0.00 0.00 179.01 180.09 1gd8 h LEU 44 N 0.86 -0.22 -1.30 1.33 6.46 -1.16 -2.40 115.31 118.88 1gd8 h LEU 44 Ca 0.18 -0.19 0.19 0.00 -0.12 0.00 0.00 57.88 57.94 1gd8 h LEU 44 Cb 0.33 0.06 -0.08 0.00 -0.73 0.00 0.00 40.66 40.23 1gd8 h LEU 44 CO 0.00 0.08 0.61 -0.09 -0.62 0.00 0.00 178.44 178.42 1gd8 h ARG 45 N -0.54 0.56 -0.16 1.25 2.43 -1.10 0.40 114.38 117.22 1gd8 h ARG 45 Ca -0.03 -0.03 -0.19 0.00 -0.81 0.00 0.00 59.98 58.92 1gd8 h ARG 45 Cb 0.40 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1gd8 h ARG 45 CO 0.04 0.37 -0.67 0.78 -1.51 0.00 0.00 179.97 178.98 1gd8 h GLY 46 N 0.58 0.69 0.86 2.80 0.00 -1.36 -2.18 103.07 104.47 1gd8 h GLY 46 Ca 0.51 -0.91 -0.00 0.00 0.00 0.00 0.00 47.33 46.93 1gd8 h GLY 46 CO -0.25 0.81 -0.03 -2.75 0.00 0.00 0.00 176.54 174.31 1gd8 h PHE 47 N 0.45 -0.09 -0.30 5.60 3.57 -0.48 -2.25 116.94 123.45 1gd8 h PHE 47 Ca -0.02 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 1gd8 h PHE 47 Cb 1.26 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 40.02 1gd8 h PHE 47 CO 0.06 0.07 0.06 0.28 -2.23 0.00 0.00 178.31 176.55 1gd8 h VAL 48 N -0.23 1.23 -0.42 1.41 2.07 -1.12 -2.06 116.25 117.12 1gd8 h VAL 48 Ca -0.01 -0.77 0.07 0.00 0.82 0.00 0.00 66.70 66.81 1gd8 h VAL 48 Cb 0.20 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1gd8 h VAL 48 CO 0.02 0.25 0.29 0.44 0.02 0.00 0.00 177.57 178.59 1gd8 h ASP 49 N 0.32 0.23 -0.39 0.57 5.19 -1.40 0.88 116.42 121.82 1gd8 h ASP 49 Ca 0.09 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.42 1gd8 h ASP 49 Cb 0.32 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 39.77 1gd8 h ASP 49 CO 0.00 0.15 -0.10 -0.74 -3.12 0.00 0.00 179.24 175.44 1gd8 h HIS 50 N 0.26 0.84 -0.47 4.55 -0.00 -0.96 -1.61 115.15 117.77 1gd8 h HIS 50 Ca 0.19 -0.18 -0.11 0.00 -0.00 0.00 0.00 60.37 60.27 1gd8 h HIS 50 Cb 0.42 -0.21 -0.01 0.00 -0.00 0.00 0.00 27.41 27.61 1gd8 h HIS 50 CO -0.00 0.89 -0.13 -0.07 -0.00 0.00 0.00 177.93 178.62 1gd8 h LEU 51 N 0.56 0.92 -0.94 0.26 3.38 -0.41 -2.96 115.31 116.13 1gd8 h LEU 51 Ca 0.10 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 1gd8 h LEU 51 Cb 0.61 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1gd8 h LEU 51 CO 0.04 1.08 0.17 0.40 0.09 0.00 0.00 178.44 180.22 1gd8 h ILE 52 N 0.76 1.24 -0.65 1.22 2.04 -0.84 -1.53 117.51 119.75 1gd8 h ILE 52 Ca 0.12 -0.85 -0.00 0.00 1.00 0.00 0.00 64.86 65.13 1gd8 h ILE 52 Cb 0.68 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 1gd8 h ILE 52 CO 0.05 0.32 0.39 -0.74 0.00 0.00 0.00 178.15 178.17 1gd8 h HIS 53 N 0.91 0.85 -0.59 1.37 2.76 -1.16 -0.64 115.15 118.65 1gd8 h HIS 53 Ca 0.20 -0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.30 1gd8 h HIS 53 Cb 0.30 -0.28 -0.02 0.00 1.55 0.00 0.00 27.41 28.95 1gd8 h HIS 53 CO 0.02 0.58 0.11 -0.07 -1.30 0.00 0.00 177.93 177.27 1gd8 h LEU 54 N 0.88 0.93 -1.51 0.26 3.38 -1.32 -1.66 115.31 116.28 1gd8 h LEU 54 Ca 0.23 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1gd8 h LEU 54 Cb -0.03 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1gd8 h LEU 54 CO -0.04 0.95 -0.25 0.00 0.09 0.00 0.00 178.44 179.18 1gd8 h ALA 55 N 1.02 1.37 -0.18 1.53 0.00 -0.96 0.47 119.26 122.50 1gd8 h ALA 55 Ca 0.18 -0.23 -0.19 0.00 0.00 0.00 0.00 54.91 54.68 1gd8 h ALA 55 Cb 0.40 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.16 1gd8 h ALA 55 CO 0.01 0.31 -0.62 0.87 0.00 0.00 0.00 179.25 179.82 1gd8 h LYS 56 N 0.00 0.75 0.00 0.00 1.57 -0.59 -2.44 116.57 115.85 1gd8 h LYS 56 Ca -0.00 -0.56 -0.01 0.00 -1.87 0.00 0.00 60.65 58.21 1gd8 h LYS 56 Cb 0.51 0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.92 1gd8 h LYS 56 CO 0.03 1.18 -0.06 -0.09 -0.57 0.00 0.00 179.45 179.94 1gd8 h ARG 57 N 0.47 0.00 -4.25 3.15 2.43 -0.81 -3.48 114.38 111.89 1gd8 h ARG 57 Ca -0.03 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.04 1gd8 h ARG 57 Cb 1.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1gd8 h ARG 57 CO 0.13 0.06 -0.26 0.41 -1.51 0.00 0.00 179.97 178.80 1gd8 n GLY 58 N -0.10 -0.13 3.40 2.80 0.00 0.11 -4.98 105.19 106.29 1gd8 n GLY 58 Ca -0.00 0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.31 2.19 0.22 1.61 -4.77 -1.26 -5.00 116.67 108.35 1gd8 s ASP 59 Ca 0.04 -1.70 -0.13 0.00 -3.30 0.00 0.00 52.55 47.47 1gd8 s ASP 59 Cb -0.00 0.52 0.27 0.00 -1.09 0.00 0.00 42.92 42.62 1gd8 s ASP 59 CO 0.20 -0.98 1.62 0.17 0.70 0.00 0.00 175.17 176.87 1gd8 h LEU 60 N 1.98 -0.63 -0.17 2.11 -0.00 -2.00 -0.64 115.31 115.96 1gd8 h LEU 60 Ca -0.31 0.20 -0.23 0.00 -0.00 0.00 0.00 57.88 57.55 1gd8 h LEU 60 Cb 1.25 0.42 0.01 0.00 -0.00 0.00 0.00 40.66 42.34 1gd8 h LEU 60 CO 0.48 -0.22 -0.91 0.45 -0.00 0.00 0.00 178.44 178.23 1gd8 h HIS 61 N 0.00 0.77 -0.15 0.17 3.86 -2.00 -3.10 115.15 114.70 1gd8 h HIS 61 Ca 0.33 -0.39 -0.01 0.00 -1.16 0.00 0.00 60.37 59.14 1gd8 h HIS 61 Cb 0.50 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.87 1gd8 h HIS 61 CO -0.55 1.21 0.07 0.00 0.86 0.00 0.00 177.93 179.52 1gd8 h ALA 62 N 0.67 0.19 -0.02 2.45 0.00 -1.74 -2.21 119.26 118.60 1gd8 h ALA 62 Ca -0.08 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1gd8 h ALA 62 Cb 1.54 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.27 1gd8 h ALA 62 CO 0.17 -0.24 0.01 -0.09 0.00 0.00 0.00 179.25 179.10 1gd8 h ARG 63 N 0.10 0.00 -0.03 0.00 2.43 -1.22 -0.95 114.38 114.71 1gd8 h ARG 63 Ca 0.05 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.18 1gd8 h ARG 63 Cb 0.14 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1gd8 h ARG 63 CO -0.01 0.00 -0.13 -0.09 -1.51 0.00 0.00 179.97 178.23 1gd8 h ARG 64 N 0.00 0.15 -0.24 0.20 2.43 -1.36 -2.88 114.38 112.68 1gd8 h ARG 64 Ca 0.01 -0.12 -0.09 0.00 -0.81 0.00 0.00 59.98 58.97 1gd8 h ARG 64 Cb 0.03 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1gd8 h ARG 64 CO -0.00 0.76 -0.24 -0.07 -1.51 0.00 0.00 179.97 178.91 1gd8 h LEU 65 N -0.44 0.44 -0.59 3.80 -0.00 -0.99 -1.88 115.31 115.66 1gd8 h LEU 65 Ca -0.01 -0.14 -0.12 0.00 -0.00 0.00 0.00 57.88 57.61 1gd8 h LEU 65 Cb 0.78 -0.12 -0.02 0.00 -0.00 0.00 0.00 40.66 41.31 1gd8 h LEU 65 CO 0.03 0.68 -0.18 0.58 -0.00 0.00 0.00 178.44 179.55 1gd8 h VAL 66 N 0.39 1.27 -0.37 1.22 2.07 -1.25 -2.34 116.25 117.24 1gd8 h VAL 66 Ca 0.06 -1.32 -0.15 0.00 0.82 0.00 0.00 66.70 66.10 1gd8 h VAL 66 Cb 0.64 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1gd8 h VAL 66 CO 0.05 0.46 -0.38 0.25 0.02 0.00 0.00 177.57 177.96 1gd8 h LEU 67 N 0.82 0.94 -1.37 2.57 6.46 -1.35 0.42 115.31 123.80 1gd8 h LEU 67 Ca 0.12 -0.43 0.02 0.00 -0.12 0.00 0.00 57.88 57.47 1gd8 h LEU 67 Cb 0.73 -0.26 -0.04 0.00 -0.73 0.00 0.00 40.66 40.36 1gd8 h LEU 67 CO 0.06 1.21 0.44 -0.09 -0.62 0.00 0.00 178.44 179.44 1gd8 h ARG 68 N 0.73 0.82 0.15 1.25 2.43 -1.22 -2.99 114.38 115.55 1gd8 h ARG 68 Ca 0.06 -0.05 -0.32 0.00 -0.81 0.00 0.00 59.98 58.86 1gd8 h ARG 68 Cb 0.96 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.33 1gd8 h ARG 68 CO 0.09 0.54 -1.64 -0.44 -1.51 0.00 0.00 179.97 177.01 1gd8 h ASP 69 N 0.84 0.51 -3.48 -3.80 5.19 -1.20 -3.42 116.42 111.06 1gd8 h ASP 69 Ca 0.26 -0.91 -0.72 0.00 -0.62 0.00 0.00 57.03 55.04 1gd8 h ASP 69 Cb -0.00 -0.17 -0.26 0.00 0.18 0.00 0.00 39.33 39.08 1gd8 h ASP 69 CO -0.07 1.73 -0.47 -0.22 -3.12 0.00 0.00 179.24 177.10 1gd8 s LEU 70 N -7.38 5.07 0.00 1.55 0.20 0.15 -4.76 118.68 113.50 1gd8 s LEU 70 Ca -0.18 -1.33 -0.02 0.00 0.69 0.00 0.00 54.13 53.28 1gd8 s LEU 70 Cb 0.05 -2.02 -0.10 0.00 -0.43 0.00 0.00 46.19 43.69 1gd8 s LEU 70 CO 0.81 -0.50 2.59 0.00 -0.29 0.00 0.00 176.35 178.96 1gd8 n GLN 71 N 4.97 1.36 -3.64 1.98 1.13 -1.22 -4.30 117.38 117.66 1gd8 n GLN 71 Ca -0.11 -0.39 -0.25 0.00 -1.94 0.00 0.00 57.00 54.31 1gd8 n GLN 71 Cb 0.44 -1.40 -0.17 0.00 0.11 0.00 0.00 30.24 29.22 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 2.01 2.25 0.07 1.08 3.68 -1.26 -5.05 116.67 119.45 1gd8 s ASP 72 Ca 0.26 -0.54 -0.34 0.00 2.13 0.00 0.00 52.55 54.06 1gd8 s ASP 72 Cb 0.12 -0.28 -0.18 0.00 -1.45 0.00 0.00 42.92 41.13 1gd8 s ASP 72 CO 0.00 -0.33 1.61 0.58 0.13 0.00 0.00 175.17 177.16 1gd8 h VAL 73 N 6.43 0.21 -1.03 1.11 2.07 -1.96 -1.76 116.25 121.33 1gd8 h VAL 73 Ca -0.15 0.00 0.26 0.00 0.82 0.00 0.00 66.70 67.63 1gd8 h VAL 73 Cb 1.14 0.21 -0.11 0.00 -1.52 0.00 0.00 31.29 31.02 1gd8 h VAL 73 CO 0.28 0.00 0.64 0.11 0.02 0.00 0.00 177.57 178.61 1gd8 h LYS 74 N -1.00 0.47 -0.02 1.57 6.56 -1.98 0.21 116.57 122.37 1gd8 h LYS 74 Ca -0.09 -0.03 -0.07 0.00 -1.06 0.00 0.00 60.65 59.40 1gd8 h LYS 74 Cb 0.80 -0.11 0.00 0.00 -0.57 0.00 0.00 32.23 32.35 1gd8 h LYS 74 CO 0.12 0.31 -0.25 -0.07 -2.06 0.00 0.00 179.45 177.50 1gd8 h LEU 75 N 0.49 0.26 -1.40 2.94 3.38 -1.95 -1.22 115.31 117.81 1gd8 h LEU 75 Ca 0.62 -0.71 0.04 0.00 0.09 0.00 0.00 57.88 57.92 1gd8 h LEU 75 Cb 1.38 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 42.01 1gd8 h LEU 75 CO -0.39 0.94 0.44 0.58 0.09 0.00 0.00 178.44 180.10 1gd8 h VAL 76 N -0.39 1.08 0.43 1.22 2.07 -0.37 0.15 116.25 120.44 1gd8 h VAL 76 Ca -0.02 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 1gd8 h VAL 76 Cb 0.96 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1gd8 h VAL 76 CO 0.05 0.14 -0.21 -0.09 0.02 0.00 0.00 177.57 177.49 1gd8 h ARG 77 N 0.77 -0.56 -0.41 1.57 2.43 -0.60 -2.68 114.38 114.91 1gd8 h ARG 77 Ca 0.27 0.04 0.08 0.00 -0.81 0.00 0.00 59.98 59.56 1gd8 h ARG 77 Cb 0.11 0.13 -0.08 0.00 -0.42 0.00 0.00 29.97 29.71 1gd8 h ARG 77 CO -0.08 -0.27 -0.13 -0.22 -1.51 0.00 0.00 179.97 177.76 1gd8 h LYS 78 N -0.79 -0.04 -0.12 0.20 3.64 -0.37 -2.07 116.57 117.02 1gd8 h LYS 78 Ca -0.06 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.37 1gd8 h LYS 78 Cb 0.54 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.32 1gd8 h LYS 78 CO 0.10 -0.03 -0.18 1.25 -2.27 0.00 0.00 179.45 178.32 1gd8 h LEU 79 N -0.04 -0.55 0.13 5.20 6.46 -0.72 0.16 115.31 125.95 1gd8 h LEU 79 Ca 0.20 0.10 -0.01 0.00 -0.12 0.00 0.00 57.88 58.05 1gd8 h LEU 79 Cb 0.35 0.26 0.00 0.00 -0.73 0.00 0.00 40.66 40.53 1gd8 h LEU 79 CO -0.45 -0.23 -0.06 -0.26 -0.62 0.00 0.00 178.44 176.83 1gd8 h PHE 80 N -0.23 -0.16 -0.47 1.25 -1.00 -1.11 0.33 116.94 115.56 1gd8 h PHE 80 Ca 0.10 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.87 1gd8 h PHE 80 Cb 0.37 0.05 0.00 0.00 3.61 0.00 0.00 35.95 39.98 1gd8 h PHE 80 CO -0.29 0.04 0.00 -0.40 -1.61 0.00 0.00 178.31 176.06 1gd8 n ASP 81 N -5.09 3.38 0.04 2.17 5.68 -0.82 -4.30 116.55 117.62 1gd8 n ASP 81 Ca -0.09 -1.97 0.00 0.00 -0.50 0.00 0.00 54.79 52.23 1gd8 n ASP 81 Cb 0.16 -0.31 0.00 0.00 -1.14 0.00 0.00 41.12 39.83 1gd8 n ASP 81 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 1gd8 n GLU 82 N 1.40 0.00 -0.07 0.11 2.13 0.52 -4.82 120.64 119.90 1gd8 n GLU 82 Ca 0.20 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.91 1gd8 n GLU 82 Cb 0.58 -0.11 -0.05 0.00 0.27 0.00 0.00 31.44 32.13 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 1.26 0.20 6.31 1.08 -1.23 -3.24 117.51 121.89 1gd8 h ILE 83 Ca 0.00 -0.90 0.01 0.00 -0.39 0.00 0.00 64.86 63.58 1gd8 h ILE 83 Cb 0.00 1.42 -0.02 0.00 -3.07 0.00 0.00 36.82 35.14 1gd8 h ILE 83 CO 0.00 0.28 -0.24 0.00 -0.69 0.00 0.00 178.15 177.49 1gd8 h ALA 84 N 0.79 -0.48 -1.00 1.87 0.00 -0.55 -2.67 119.26 117.23 1gd8 h ALA 84 Ca 0.06 -0.06 0.18 0.00 0.00 0.00 0.00 54.91 55.08 1gd8 h ALA 84 Cb 0.41 0.37 -0.10 0.00 0.00 0.00 0.00 17.79 18.47 1gd8 h ALA 84 CO 0.01 -0.80 0.62 -1.35 0.00 0.00 0.00 179.25 177.73 1gd8 h PRO 85 N -0.50 0.78 0.00 0.00 0.11 -1.75 -1.01 132.00 129.64 1gd8 h PRO 85 Ca 0.01 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 1gd8 h PRO 85 Cb 0.48 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.41 1gd8 h PRO 85 CO -0.08 0.52 -0.00 -0.09 -0.21 0.00 0.00 178.00 178.13 1gd8 h ARG 86 N 0.81 0.00 -0.38 1.05 2.43 -1.50 -2.53 114.38 114.25 1gd8 h ARG 86 Ca 0.56 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.61 1gd8 h ARG 86 Cb 0.82 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.30 1gd8 h ARG 86 CO -0.35 0.00 0.03 0.66 -1.51 0.00 0.00 179.97 178.80 1gd8 n TYR 87 N -4.27 1.25 0.29 2.20 4.02 -0.40 -4.52 117.16 115.73 1gd8 n TYR 87 Ca -0.03 -1.23 0.19 0.00 -0.01 0.00 0.00 57.90 56.82 1gd8 n TYR 87 Cb 0.09 -0.45 0.82 0.00 -0.02 0.00 0.00 39.34 39.78 1gd8 n TYR 87 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 1gd8 h ARG 88 N 1.55 0.00 0.12 -0.72 2.43 -1.27 -2.66 114.38 113.82 1gd8 h ARG 88 Ca 0.14 0.00 -0.30 0.00 -0.81 0.00 0.00 59.98 59.01 1gd8 h ARG 88 Cb 1.69 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.23 1gd8 h ARG 88 CO 0.38 0.01 -1.58 0.38 -1.51 0.00 0.00 179.97 177.65 1gd8 h ASP 89 N 0.00 0.40 -4.13 -3.80 3.04 -1.82 -3.47 116.42 106.64 1gd8 h ASP 89 Ca -0.00 -0.86 -0.49 0.00 -3.24 0.00 0.00 57.03 52.44 1gd8 h ASP 89 Cb 0.38 -0.13 0.05 0.00 -1.04 0.00 0.00 39.33 38.60 1gd8 h ASP 89 CO 0.00 1.69 0.39 -0.60 -2.04 0.00 0.00 179.24 178.68 1gd8 s ARG 90 N -2.50 3.46 -0.34 4.15 3.52 -1.01 -4.99 118.95 121.24 1gd8 s ARG 90 Ca -0.20 1.36 0.10 0.00 -0.13 0.00 0.00 55.73 56.85 1gd8 s ARG 90 Cb 0.05 -2.04 0.45 0.00 -1.56 0.00 0.00 34.95 31.85 1gd8 s ARG 90 CO 0.77 -0.71 1.12 1.04 -0.81 0.00 0.00 175.30 176.70 1gd8 n GLN 91 N -1.52 3.00 0.00 5.12 1.13 -1.26 -4.95 117.38 118.89 1gd8 n GLN 91 Ca 0.10 -4.09 0.00 0.00 -1.94 0.00 0.00 57.00 51.06 1gd8 n GLN 91 Cb 0.52 -2.05 0.00 0.00 0.11 0.00 0.00 30.24 28.82 1gd8 n GLN 91 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1gd8 n GLY 92 N -0.53 2.02 3.87 1.08 0.00 -1.26 -5.05 105.19 105.31 1gd8 n GLY 92 Ca 0.33 -1.97 -0.24 0.00 0.00 0.00 0.00 46.02 44.14 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 -1.67 -0.26 0.14 -0.02 0.00 -1.26 -4.85 105.19 97.28 1gd8 n GLY 93 Ca 0.00 0.14 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 -1.85 0.00 -3.56 1.61 -1.99 -1.96 -3.44 116.97 105.78 1gd8 h TYR 94 Ca -0.62 0.00 -0.67 0.00 2.00 0.00 0.00 58.73 59.44 1gd8 h TYR 94 Cb 1.37 0.00 -0.27 0.00 2.00 0.00 0.00 36.73 39.83 1gd8 h TYR 94 CO 0.48 0.00 -0.79 0.95 -0.00 0.00 0.00 178.16 178.81 1gd8 s THR 95 N -3.15 2.87 -0.13 -2.88 -4.23 -1.26 -0.61 115.64 106.24 1gd8 s THR 95 Ca 0.09 -0.75 -0.05 0.00 -1.18 0.00 0.00 61.69 59.80 1gd8 s THR 95 Cb 0.10 -2.16 -0.04 0.00 1.34 0.00 0.00 72.50 71.74 1gd8 s THR 95 CO 0.64 0.55 0.04 -0.60 -0.54 0.00 0.00 174.62 174.70 1gd8 s ARG 96 N 0.03 3.50 -0.19 3.99 3.52 0.18 -4.84 118.95 125.14 1gd8 s ARG 96 Ca -0.05 -0.36 0.00 0.00 -0.13 0.00 0.00 55.73 55.19 1gd8 s ARG 96 Cb -0.15 -3.02 0.02 0.00 -1.56 0.00 0.00 34.95 30.24 1gd8 s ARG 96 CO 0.05 0.50 -0.17 0.08 -0.81 0.00 0.00 175.30 174.94 1gd8 s VAL 97 N -0.28 2.31 -0.24 7.11 1.01 -1.26 -1.24 120.40 127.81 1gd8 s VAL 97 Ca 0.07 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.19 1gd8 s VAL 97 Cb -0.12 -2.00 0.05 0.00 0.00 0.00 0.00 36.38 34.30 1gd8 s VAL 97 CO 0.02 0.50 -0.13 -0.76 0.00 0.00 0.00 175.10 174.72 1gd8 s LEU 98 N 1.32 3.12 0.21 3.92 1.43 0.73 -4.94 118.68 124.47 1gd8 s LEU 98 Ca 0.05 -1.20 -0.30 0.00 -1.03 0.00 0.00 54.13 51.65 1gd8 s LEU 98 Cb -0.13 -1.54 -0.09 0.00 0.03 0.00 0.00 46.19 44.45 1gd8 s LEU 98 CO -0.11 -0.14 1.37 -0.54 0.23 0.00 0.00 176.35 177.16 1gd8 s LYS 99 N 1.16 4.33 0.35 1.70 1.02 -1.26 -0.20 119.74 126.84 1gd8 s LYS 99 Ca -0.05 2.16 0.07 0.00 0.02 0.00 0.00 55.97 58.17 1gd8 s LYS 99 Cb -0.18 -3.17 -0.02 0.00 -0.52 0.00 0.00 37.83 33.94 1gd8 s LYS 99 CO -0.07 -0.34 0.36 -0.51 -0.92 0.00 0.00 175.35 173.87 1gd8 s LEU 100 N -0.07 3.65 0.22 3.17 1.43 -0.34 -4.91 118.68 121.83 1gd8 s LEU 100 Ca 0.59 -0.46 0.17 0.00 -1.03 0.00 0.00 54.13 53.40 1gd8 s LEU 100 Cb -0.39 -2.33 0.02 0.00 0.03 0.00 0.00 46.19 43.52 1gd8 s LEU 100 CO 0.39 -0.43 1.21 0.00 0.23 0.00 0.00 176.35 177.74 1gd8 h ALA 101 N 1.11 0.68 -2.42 4.21 0.00 -1.96 -3.41 119.26 117.47 1gd8 h ALA 101 Ca -0.44 -0.47 -0.50 0.00 0.00 0.00 0.00 54.91 53.50 1gd8 h ALA 101 Cb 1.26 0.06 0.09 0.00 0.00 0.00 0.00 17.79 19.19 1gd8 h ALA 101 CO 0.56 0.56 0.39 -2.00 0.00 0.00 0.00 179.25 178.77 1gd8 s GLU 102 N -3.03 2.77 0.31 0.00 2.12 -1.26 -5.00 118.70 114.61 1gd8 s GLU 102 Ca 0.01 0.63 0.04 0.00 0.36 0.00 0.00 54.97 56.01 1gd8 s GLU 102 Cb 0.08 -2.00 -0.06 0.00 0.26 0.00 0.00 34.13 32.41 1gd8 s GLU 102 CO 0.76 -1.13 0.05 1.03 -0.54 0.00 0.00 175.26 175.43 1gd8 s ARG 103 N -5.23 1.60 -0.22 4.30 0.52 -1.26 -3.44 118.95 115.22 1gd8 s ARG 103 Ca 0.58 -1.87 -0.29 0.00 -0.52 0.00 0.00 55.73 53.63 1gd8 s ARG 103 Cb -0.12 -0.83 -0.02 0.00 0.52 0.00 0.00 34.95 34.49 1gd8 s ARG 103 CO 0.53 -0.17 1.51 0.50 0.02 0.00 0.00 175.30 177.70 1gd8 s ARG 104 N -3.88 3.90 -0.98 3.54 3.52 0.09 -4.85 118.95 120.29 1gd8 s ARG 104 Ca 0.35 1.61 -0.24 0.00 -0.13 0.00 0.00 55.73 57.32 1gd8 s ARG 104 Cb 0.08 -3.97 -0.02 0.00 -1.56 0.00 0.00 34.95 29.48 1gd8 s ARG 104 CO 0.14 -1.16 1.82 0.50 -0.81 0.00 0.00 175.30 175.79 1gd8 s ARG 105 N 4.39 2.85 0.00 5.12 3.00 -1.26 -0.37 118.95 132.67 1gd8 s ARG 105 Ca 0.66 -0.65 0.00 0.00 -1.00 0.00 0.00 55.73 54.75 1gd8 s ARG 105 Cb -0.23 -5.17 0.00 0.00 0.00 0.00 0.00 34.95 29.55 1gd8 s ARG 105 CO 0.26 -3.13 0.00 0.41 0.00 0.00 0.00 175.30 172.85 1gd8 n GLY 106 N 6.69 -2.54 0.55 8.12 0.00 -1.26 -4.92 105.19 111.83 1gd8 n GLY 106 Ca 0.39 0.81 0.09 0.00 0.00 0.00 0.00 46.02 47.31 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 0.00 2.08 -2.38 1.61 5.68 -1.22 -4.99 116.55 117.33 1gd8 n ASP 107 Ca 0.00 -1.54 -0.09 0.00 -0.50 0.00 0.00 54.79 52.66 1gd8 n ASP 107 Cb 0.00 0.24 0.05 0.00 -1.14 0.00 0.00 41.12 40.27 1gd8 n ASP 107 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gd8 n GLY 108 N 1.10 -0.05 3.77 6.12 0.00 0.50 -4.99 105.19 111.63 1gd8 n GLY 108 Ca 0.09 -0.09 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.20 3.40 -0.02 4.61 0.00 -1.24 -4.66 121.76 120.64 1gd8 s ALA 109 Ca 0.05 0.44 -0.30 0.00 0.00 0.00 0.00 51.96 52.15 1gd8 s ALA 109 Cb -0.01 -3.04 -0.06 0.00 0.00 0.00 0.00 23.12 20.02 1gd8 s ALA 109 CO 0.41 0.26 1.54 -1.25 0.00 0.00 0.00 175.76 176.72 1gd8 s PRO 110 N -1.28 4.22 0.38 0.00 0.04 -1.26 -0.73 135.00 136.37 1gd8 s PRO 110 Ca 0.39 2.10 -0.06 0.00 0.04 0.00 0.00 61.00 63.47 1gd8 s PRO 110 Cb -0.23 -3.75 -0.05 0.00 0.04 0.00 0.00 34.50 30.51 1gd8 s PRO 110 CO 0.27 -0.72 0.67 -0.51 0.04 0.00 0.00 177.00 176.76 1gd8 s LEU 111 N 3.14 3.88 -0.07 -3.56 1.43 -1.22 -0.35 118.68 121.92 1gd8 s LEU 111 Ca 0.69 0.85 -0.09 0.00 -1.03 0.00 0.00 54.13 54.55 1gd8 s LEU 111 Cb -0.33 -3.73 0.02 0.00 0.03 0.00 0.00 46.19 42.18 1gd8 s LEU 111 CO 0.28 -0.36 0.24 0.00 0.23 0.00 0.00 176.35 176.73 1gd8 s ALA 112 N -2.36 -0.58 -0.24 4.21 0.00 0.11 -1.20 121.76 121.70 1gd8 s ALA 112 Ca 0.46 0.57 -0.11 0.00 0.00 0.00 0.00 51.96 52.88 1gd8 s ALA 112 Cb -0.10 -0.30 -0.05 0.00 0.00 0.00 0.00 23.12 22.66 1gd8 s ALA 112 CO 0.35 -0.14 0.20 -1.17 0.00 0.00 0.00 175.76 175.00 1gd8 s LEU 113 N -0.15 4.11 -0.12 0.00 0.20 0.72 -2.10 118.68 121.34 1gd8 s LEU 113 Ca -0.03 0.15 -0.02 0.00 0.69 0.00 0.00 54.13 54.93 1gd8 s LEU 113 Cb -0.03 -2.16 -0.03 0.00 -0.43 0.00 0.00 46.19 43.55 1gd8 s LEU 113 CO 0.01 0.04 -0.06 -0.69 -0.29 0.00 0.00 176.35 175.36 1gd8 s VAL 114 N 1.16 3.75 0.21 1.68 1.01 0.14 -0.19 120.40 128.15 1gd8 s VAL 114 Ca 0.09 -0.43 -0.22 0.00 0.00 0.00 0.00 61.98 61.42 1gd8 s VAL 114 Cb -0.14 -2.60 0.05 0.00 0.00 0.00 0.00 36.38 33.69 1gd8 s VAL 114 CO 0.05 0.53 0.67 -1.83 0.00 0.00 0.00 175.10 174.52 1gd8 s GLU 115 N -0.03 1.49 0.16 2.72 -1.05 -0.37 -0.35 118.70 121.27 1gd8 s GLU 115 Ca 0.00 -0.70 -0.30 0.00 -0.15 0.00 0.00 54.97 53.83 1gd8 s GLU 115 Cb -0.13 0.59 -0.07 0.00 -0.44 0.00 0.00 34.13 34.08 1gd8 s GLU 115 CO 0.03 -0.67 0.95 -0.51 0.95 0.00 0.00 175.26 176.01 1gd8 s LEU 116 N -2.82 4.56 0.44 1.83 1.02 -1.21 0.49 118.68 122.98 1gd8 s LEU 116 Ca 0.06 1.85 -0.23 0.00 0.02 0.00 0.00 54.13 55.82 1gd8 s LEU 116 Cb -0.03 -3.59 -0.08 0.00 0.02 0.00 0.00 46.19 42.51 1gd8 s LEU 116 CO -0.04 0.02 1.13 0.54 0.02 0.00 0.00 176.35 178.02 1gd8 s VAL 117 N -0.46 3.31 0.00 -1.59 0.11 0.22 -4.78 120.40 117.20 1gd8 s VAL 117 Ca 0.45 0.99 0.00 0.00 -2.93 0.00 0.00 61.98 60.49 1gd8 s VAL 117 Cb -0.24 -3.51 0.00 0.00 -1.53 0.00 0.00 36.38 31.10 1gd8 s VAL 117 CO 0.31 -0.00 0.00 1.21 -3.33 0.00 0.00 175.10 173.29