#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gsc h PRO 10 N 0.00 0.61 -0.32 5.56 0.13 -1.97 -3.17 132.00 132.84 2gsc h PRO 10 Ca 0.00 -0.76 0.07 0.00 -0.87 0.00 0.00 66.00 64.44 2gsc h PRO 10 Cb 0.00 0.24 -0.01 0.00 0.13 0.00 0.00 31.00 31.35 2gsc h PRO 10 CO 0.00 1.33 0.22 1.12 -0.23 0.00 0.00 178.00 180.44 2gsc h HIS 11 N 0.30 0.11 0.00 1.56 2.07 -1.88 -2.23 115.15 115.07 2gsc h HIS 11 Ca -0.16 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.36 2gsc h HIS 11 Cb 1.82 -0.04 0.00 0.00 2.57 0.00 0.00 27.41 31.77 2gsc h HIS 11 CO 0.10 0.06 0.00 0.93 -3.07 0.00 0.00 177.93 175.95 2gsc h GLU 12 N 0.11 0.00 0.00 5.12 5.08 -1.98 0.05 114.58 122.96 2gsc h GLU 12 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2gsc h GLU 12 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2gsc h GLU 12 CO -0.02 0.00 -0.38 0.00 -1.00 0.00 0.00 179.01 177.62 2gsc h ARG 13 N 0.00 0.00 -6.44 2.33 3.08 -1.58 -3.45 114.38 108.32 2gsc h ARG 13 Ca 0.00 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.51 2gsc h ARG 13 Cb 0.18 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.23 2gsc h ARG 13 CO 0.00 0.00 0.61 -0.51 -1.07 0.00 0.00 179.97 179.00 2gsc s LEU 14 N -4.90 4.35 0.22 3.04 1.43 0.00 -4.93 118.68 117.89 2gsc s LEU 14 Ca 0.07 1.99 -0.08 0.00 -1.03 0.00 0.00 54.13 55.08 2gsc s LEU 14 Cb 0.11 -3.57 0.34 0.00 0.03 0.00 0.00 46.19 43.10 2gsc s LEU 14 CO 0.69 -0.52 1.73 0.44 0.23 0.00 0.00 176.35 178.92 2gsc h ASP 15 N 7.01 0.17 -0.92 2.29 5.19 -1.90 -0.95 116.42 127.32 2gsc h ASP 15 Ca -0.40 0.10 0.06 0.00 -0.62 0.00 0.00 57.03 56.18 2gsc h ASP 15 Cb 1.20 0.10 -0.06 0.00 0.18 0.00 0.00 39.33 40.75 2gsc h ASP 15 CO 0.83 0.09 0.59 0.00 -3.12 0.00 0.00 179.24 177.63 2gsc h ALA 16 N 1.48 1.50 -0.08 3.45 0.00 -1.92 0.14 119.26 123.84 2gsc h ALA 16 Ca 0.35 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 2gsc h ALA 16 Cb 0.49 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2gsc h ALA 16 CO -0.37 0.36 -0.20 2.35 0.00 0.00 0.00 179.25 181.39 2gsc h TRP 17 N 1.04 0.36 -0.01 0.00 7.01 -1.60 -2.15 115.95 120.60 2gsc h TRP 17 Ca 0.39 -0.14 0.00 0.00 2.11 0.00 0.00 58.89 61.26 2gsc h TRP 17 Cb 0.20 -0.06 -0.00 0.00 -2.10 0.00 0.00 29.16 27.19 2gsc h TRP 17 CO -0.00 0.81 0.01 0.00 -2.79 0.00 0.00 178.44 176.47 2gsc h ARG 18 N -0.19 0.02 0.00 2.65 3.08 -0.75 -0.12 114.38 119.06 2gsc h ARG 18 Ca -0.00 -0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 2gsc h ARG 18 Cb 0.80 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.84 2gsc h ARG 18 CO 0.04 0.02 -0.27 -0.44 -1.07 0.00 0.00 179.97 178.25 2gsc h ASP 19 N 0.01 0.00 0.41 7.04 3.32 -0.84 -1.77 116.42 124.59 2gsc h ASP 19 Ca 0.01 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.80 2gsc h ASP 19 Cb 0.00 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.56 2gsc h ASP 19 CO -0.00 0.27 -1.11 0.77 -1.72 0.00 0.00 179.24 177.45 2gsc h SER 20 N 0.00 0.56 -0.40 6.45 4.64 -0.94 -1.92 113.55 121.93 2gsc h SER 20 Ca -0.00 -0.51 -0.02 0.00 -0.47 0.00 0.00 61.79 60.78 2gsc h SER 20 Cb 0.50 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 2gsc h SER 20 CO 0.03 1.35 0.17 0.24 -0.87 0.00 0.00 176.83 177.75 2gsc h MET 21 N 0.18 0.60 -0.79 4.77 2.86 -0.89 -1.00 114.93 120.65 2gsc h MET 21 Ca -0.12 -0.10 0.04 0.00 -2.06 0.00 0.00 59.70 57.46 2gsc h MET 21 Cb 1.79 -0.10 -0.05 0.00 0.06 0.00 0.00 31.60 33.29 2gsc h MET 21 CO 0.19 0.55 0.49 1.49 1.06 0.00 0.00 176.91 180.70 2gsc h GLU 22 N 0.51 0.91 -0.53 1.72 4.81 -1.35 -1.56 114.58 119.10 2gsc h GLU 22 Ca 0.14 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.36 2gsc h GLU 22 Cb 0.17 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.30 2gsc h GLU 22 CO -0.01 0.60 0.27 1.25 -0.73 0.00 0.00 179.01 180.39 2gsc h LEU 23 N 0.94 0.40 -0.76 1.64 5.85 -0.95 -2.13 115.31 120.29 2gsc h LEU 23 Ca 0.33 0.03 0.02 0.00 0.84 0.00 0.00 57.88 59.10 2gsc h LEU 23 Cb 0.08 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2gsc h LEU 23 CO -0.14 0.27 0.49 0.58 -0.34 0.00 0.00 178.44 179.31 2gsc h VAL 24 N 0.53 1.15 -0.80 1.05 2.07 -0.41 -1.08 116.25 118.75 2gsc h VAL 24 Ca 0.23 -0.34 0.01 0.00 0.82 0.00 0.00 66.70 67.42 2gsc h VAL 24 Cb 0.13 0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 29.94 2gsc h VAL 24 CO -0.15 0.18 0.52 -0.08 0.02 0.00 0.00 177.57 178.06 2gsc h GLU 25 N 0.98 1.07 -0.94 1.57 4.81 -1.02 -2.02 114.58 119.03 2gsc h GLU 25 Ca 0.30 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.45 2gsc h GLU 25 Cb -0.04 -0.24 -0.05 0.00 0.63 0.00 0.00 28.75 29.06 2gsc h GLU 25 CO -0.09 0.71 0.57 0.52 -0.73 0.00 0.00 179.01 179.99 2gsc h MET 26 N 1.09 1.27 0.35 1.92 2.86 -0.58 -2.28 114.93 119.57 2gsc h MET 26 Ca 0.29 -0.11 -0.02 0.00 -2.06 0.00 0.00 59.70 57.80 2gsc h MET 26 Cb -0.11 -0.27 0.00 0.00 0.06 0.00 0.00 31.60 31.28 2gsc h MET 26 CO -0.06 0.89 -0.17 0.82 1.06 0.00 0.00 176.91 179.45 2gsc h ILE 27 N 1.30 0.66 -1.00 -1.22 1.08 -0.65 0.18 117.51 117.86 2gsc h ILE 27 Ca 0.34 -0.15 0.12 0.00 -0.39 0.00 0.00 64.86 64.78 2gsc h ILE 27 Cb -0.06 0.74 -0.08 0.00 -3.07 0.00 0.00 36.82 34.35 2gsc h ILE 27 CO -0.06 0.03 0.63 1.88 -0.69 0.00 0.00 178.15 179.94 2gsc h TYR 28 N -0.55 1.14 -0.08 1.37 -1.99 -1.28 0.16 116.97 115.74 2gsc h TYR 28 Ca -0.05 0.03 -0.18 0.00 2.00 0.00 0.00 58.73 60.53 2gsc h TYR 28 Cb 0.41 -0.36 -0.00 0.00 2.00 0.00 0.00 36.73 38.77 2gsc h TYR 28 CO -0.03 0.46 -0.72 0.00 -0.00 0.00 0.00 178.16 177.87 2gsc h ARG 29 N 1.01 0.41 -0.30 4.88 3.08 -1.29 -2.91 114.38 119.26 2gsc h ARG 29 Ca 0.49 -0.33 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 2gsc h ARG 29 Cb 0.46 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 2gsc h ARG 29 CO -0.26 0.97 0.12 1.25 -1.07 0.00 0.00 179.97 180.98 2gsc h LEU 30 N 0.28 0.41 0.00 3.04 6.46 0.51 -3.14 115.31 122.88 2gsc h LEU 30 Ca -0.03 -0.16 0.00 0.00 -0.12 0.00 0.00 57.88 57.57 2gsc h LEU 30 Cb 1.29 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 41.12 2gsc h LEU 30 CO 0.12 0.46 0.00 0.35 -0.62 0.00 0.00 178.44 178.75 2gsc n THR 31 N -4.75 0.33 -0.03 1.05 -2.24 0.45 -3.26 114.28 105.83 2gsc n THR 31 Ca -0.02 0.08 -0.09 0.00 -2.27 0.00 0.00 64.05 61.75 2gsc n THR 31 Cb 0.13 -0.75 0.06 0.00 -2.10 0.00 0.00 70.33 67.67 2gsc n THR 31 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2gsc h GLU 32 N 0.00 0.65 -0.41 -0.78 5.08 -1.46 -3.16 114.58 114.50 2gsc h GLU 32 Ca 0.00 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 2gsc h GLU 32 Cb 0.16 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2gsc h GLU 32 CO 0.00 0.97 0.00 1.33 -1.00 0.00 0.00 179.01 180.31 2gsc n VAL 33 N -4.01 0.54 -1.11 3.13 0.24 -1.20 -4.93 118.33 110.99 2gsc n VAL 33 Ca -0.02 -0.63 -0.31 0.00 -2.04 0.00 0.00 64.34 61.34 2gsc n VAL 33 Cb 0.55 0.49 0.11 0.00 -1.47 0.00 0.00 33.84 33.53 2gsc n VAL 33 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2gsc s PHE 34 N -1.46 2.25 0.69 6.34 0.40 -1.20 -4.97 117.98 120.03 2gsc s PHE 34 Ca 0.35 1.64 -0.17 0.00 -0.60 0.00 0.00 56.93 58.15 2gsc s PHE 34 Cb 0.19 -3.17 0.01 0.00 0.51 0.00 0.00 43.02 40.57 2gsc s PHE 34 CO 0.26 -2.15 1.25 -2.14 0.70 0.00 0.00 175.22 173.14 2gsc s PRO 35 N -4.74 2.36 0.44 0.24 0.02 -1.26 -4.89 135.00 127.17 2gsc s PRO 35 Ca 0.64 1.92 0.27 0.00 0.02 0.00 0.00 61.00 63.84 2gsc s PRO 35 Cb -0.20 -1.84 0.78 0.00 0.02 0.00 0.00 34.50 33.26 2gsc s PRO 35 CO 0.55 -1.70 1.76 -0.44 -0.33 0.00 0.00 177.00 176.84 2gsc h ASP 36 N 0.16 0.00 -0.66 2.53 3.32 -1.95 -2.60 116.42 117.21 2gsc h ASP 36 Ca -0.49 0.00 0.19 0.00 0.02 0.00 0.00 57.03 56.75 2gsc h ASP 36 Cb 1.32 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.84 2gsc h ASP 36 CO 0.51 0.00 0.49 -0.61 -1.72 0.00 0.00 179.24 177.92 2gsc h GLN 37 N 0.00 0.00 -0.02 3.56 -0.00 -2.04 -3.03 115.11 113.57 2gsc h GLN 37 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2gsc h GLN 37 Cb 0.77 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.25 2gsc h GLN 37 CO 0.00 0.00 -0.05 -1.91 0.00 0.00 0.00 178.83 176.87 2gsc n GLU 38 N -4.27 1.75 -0.34 1.69 4.07 -0.98 -4.63 120.64 117.92 2gsc n GLU 38 Ca 0.13 -1.59 0.23 0.00 -0.06 0.00 0.00 57.16 55.87 2gsc n GLU 38 Cb 0.75 -1.38 0.48 0.00 -0.06 0.00 0.00 31.44 31.23 2gsc n GLU 38 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2gsc h ARG 39 N 3.70 0.40 -0.42 5.31 3.08 -1.63 0.80 114.38 125.61 2gsc h ARG 39 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2gsc h ARG 39 Cb 0.81 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.77 2gsc h ARG 39 CO 0.00 0.26 0.00 0.66 -1.07 0.00 0.00 179.97 179.82 2gsc n TYR 40 N -4.74 0.63 0.00 3.04 4.02 -1.26 -2.70 117.16 116.15 2gsc n TYR 40 Ca 0.27 -0.53 0.00 0.00 -0.01 0.00 0.00 57.90 57.63 2gsc n TYR 40 Cb 0.90 -0.05 0.00 0.00 -0.02 0.00 0.00 39.34 40.17 2gsc n TYR 40 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2gsc n GLY 41 N 0.67 0.42 0.29 2.72 0.00 0.26 -4.65 105.19 104.90 2gsc n GLY 41 Ca 0.15 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.14 2gsc n GLY 41 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2gsc h LEU 42 N 0.00 0.81 -0.47 0.99 6.46 -1.88 -0.60 115.31 120.61 2gsc h LEU 42 Ca 0.00 -0.01 -0.07 0.00 -0.12 0.00 0.00 57.88 57.68 2gsc h LEU 42 Cb 0.00 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 39.73 2gsc h LEU 42 CO 0.00 0.57 0.02 0.71 -0.62 0.00 0.00 178.44 179.12 2gsc h THR 43 N 0.96 1.26 -0.34 1.05 1.35 -1.74 0.54 112.91 115.98 2gsc h THR 43 Ca 0.30 -1.02 -0.04 0.00 -0.55 0.00 0.00 66.41 65.10 2gsc h THR 43 Cb -0.02 0.99 -0.02 0.00 -1.73 0.00 0.00 68.15 67.37 2gsc h THR 43 CO -0.10 0.35 0.04 0.00 -0.25 0.00 0.00 175.52 175.57 2gsc h ALA 44 N 0.93 1.43 -0.21 6.62 0.00 -1.36 -2.08 119.26 124.59 2gsc h ALA 44 Ca 0.14 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 2gsc h ALA 44 Cb 0.47 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2gsc h ALA 44 CO 0.02 0.41 -0.42 1.96 0.00 0.00 0.00 179.25 181.22 2gsc h GLN 45 N 0.50 0.66 -0.80 0.00 4.20 -0.33 -1.79 115.11 117.56 2gsc h GLN 45 Ca 0.11 -0.43 0.01 0.00 0.06 0.00 0.00 58.65 58.40 2gsc h GLN 45 Cb 0.26 0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.06 2gsc h GLN 45 CO 0.00 1.04 0.52 -0.07 -0.67 0.00 0.00 178.83 179.66 2gsc h LEU 46 N 0.36 0.92 -0.61 1.46 3.38 0.13 -2.00 115.31 118.95 2gsc h LEU 46 Ca 0.01 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.80 2gsc h LEU 46 Cb 1.02 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 2gsc h LEU 46 CO 0.09 0.68 -0.49 0.03 0.09 0.00 0.00 178.44 178.84 2gsc h ARG 47 N 1.08 0.51 -0.25 1.13 3.08 -1.35 -1.51 114.38 117.07 2gsc h ARG 47 Ca 0.29 -0.29 -0.14 0.00 0.07 0.00 0.00 59.98 59.91 2gsc h ARG 47 Cb -0.11 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 29.96 2gsc h ARG 47 CO -0.06 0.89 -0.38 -0.09 -1.07 0.00 0.00 179.97 179.26 2gsc h ARG 48 N 0.40 0.70 -0.39 0.04 2.43 -1.16 -1.97 114.38 114.44 2gsc h ARG 48 Ca 0.02 -0.42 0.02 0.00 -0.81 0.00 0.00 59.98 58.79 2gsc h ARG 48 Cb 1.01 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.57 2gsc h ARG 48 CO 0.09 1.04 0.22 0.00 -1.51 0.00 0.00 179.97 179.81 2gsc h ALA 49 N 0.66 0.49 0.07 2.80 0.00 -1.32 -2.70 119.26 119.26 2gsc h ALA 49 Ca 0.02 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2gsc h ALA 49 Cb 0.97 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2gsc h ALA 49 CO 0.09 -0.12 -0.03 0.00 0.00 0.00 0.00 179.25 179.18 2gsc h ALA 50 N 1.18 -0.10 -0.34 0.00 0.00 -1.26 -2.76 119.26 115.99 2gsc h ALA 50 Ca 0.16 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 55.03 2gsc h ALA 50 Cb 0.02 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2gsc h ALA 50 CO -0.08 -0.43 0.26 0.28 0.00 0.00 0.00 179.25 179.28 2gsc h VAL 51 N -0.34 0.74 0.00 0.00 2.07 -1.39 -2.15 116.25 115.18 2gsc h VAL 51 Ca -0.01 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.39 2gsc h VAL 51 Cb 0.30 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 2gsc h VAL 51 CO 0.02 0.00 -0.57 -1.28 0.02 0.00 0.00 177.57 175.75 2gsc h SER 52 N 0.00 0.00 0.20 0.57 0.87 -1.17 -3.02 113.55 111.00 2gsc h SER 52 Ca 0.16 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 2gsc h SER 52 Cb 0.68 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.65 2gsc h SER 52 CO -0.00 0.57 -0.10 0.40 -0.53 0.00 0.00 176.83 177.17 2gsc h ILE 53 N 0.00 0.00 -1.00 2.23 2.04 -1.38 -2.07 117.51 117.33 2gsc h ILE 53 Ca -0.01 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.90 2gsc h ILE 53 Cb 1.05 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.07 2gsc h ILE 53 CO 0.07 0.00 0.65 1.55 0.00 0.00 0.00 178.15 180.43 2gsc h PRO 54 N -0.28 1.19 -0.63 2.37 0.13 -1.72 -2.58 132.00 130.48 2gsc h PRO 54 Ca -0.03 -0.07 0.12 0.00 -0.87 0.00 0.00 66.00 65.15 2gsc h PRO 54 Cb 0.21 -0.27 -0.09 0.00 0.13 0.00 0.00 31.00 30.98 2gsc h PRO 54 CO 0.04 0.79 0.15 0.77 -0.23 0.00 0.00 178.00 179.52 2gsc h SER 55 N 1.23 0.02 -0.13 1.44 0.02 -1.54 0.13 113.55 114.73 2gsc h SER 55 Ca 0.41 0.12 -0.10 0.00 -0.84 0.00 0.00 61.79 61.38 2gsc h SER 55 Cb 0.07 0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.76 2gsc h SER 55 CO -0.14 0.01 -0.31 0.78 -1.14 0.00 0.00 176.83 176.02 2gsc h ASN 56 N 0.28 0.49 -0.50 3.07 2.35 -1.21 -1.65 115.58 118.42 2gsc h ASN 56 Ca 0.34 -0.58 0.10 0.00 -0.55 0.00 0.00 56.30 55.61 2gsc h ASN 56 Cb 0.51 -0.14 -0.10 0.00 0.05 0.00 0.00 38.32 38.64 2gsc h ASN 56 CO -0.42 0.98 -0.17 0.40 -1.65 0.00 0.00 177.43 176.57 2gsc h ILE 57 N 0.03 0.42 -0.76 2.81 2.04 -1.18 0.44 117.51 121.30 2gsc h ILE 57 Ca -0.00 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 2gsc h ILE 57 Cb 0.92 0.42 -0.05 0.00 -0.74 0.00 0.00 36.82 37.37 2gsc h ILE 57 CO 0.07 0.00 0.47 0.00 0.00 0.00 0.00 178.15 178.68 2gsc h ALA 58 N 1.38 1.03 -0.80 1.87 0.00 -0.63 -1.44 119.26 120.67 2gsc h ALA 58 Ca 0.24 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 2gsc h ALA 58 Cb 0.42 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2gsc h ALA 58 CO -0.54 0.21 0.37 0.93 0.00 0.00 0.00 179.25 180.22 2gsc h GLU 59 N 0.87 1.15 0.13 0.00 5.08 -0.82 -3.14 114.58 117.85 2gsc h GLU 59 Ca 0.33 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.51 2gsc h GLU 59 Cb 0.12 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.17 2gsc h GLU 59 CO -0.15 0.89 -0.06 0.78 -1.00 0.00 0.00 179.01 179.47 2gsc h GLY 60 N 1.16 -0.18 0.06 -3.84 0.00 0.07 -2.73 103.07 97.62 2gsc h GLY 60 Ca 0.27 0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.67 2gsc h GLY 60 CO -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 176.54 176.44 2gsc n ALA 61 N -2.18 2.03 -0.03 3.60 0.00 -0.67 -1.75 120.51 121.52 2gsc n ALA 61 Ca -0.08 -0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.46 2gsc n ALA 61 Cb 0.11 -1.02 0.26 0.00 0.00 0.00 0.00 19.45 18.79 2gsc n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gsc n ALA 62 N -0.53 2.38 -2.81 0.00 0.00 -1.03 -4.68 120.51 113.85 2gsc n ALA 62 Ca 0.01 -1.14 0.00 0.00 0.00 0.00 0.00 53.44 52.31 2gsc n ALA 62 Cb 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.60 2gsc n ALA 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2gsc n ARG 63 N 1.49 0.00 0.00 0.00 5.12 -0.72 -5.12 116.66 117.43 2gsc n ARG 63 Ca 0.21 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.13 2gsc n ARG 63 Cb 0.60 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.90 2gsc n ARG 63 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2gsc n ASP 68 N 0.00 0.00 -0.22 0.55 2.03 -1.26 -5.16 116.55 112.49 2gsc n ASP 68 Ca 0.00 0.00 -0.06 0.00 0.52 0.00 0.00 54.79 55.25 2gsc n ASP 68 Cb 0.00 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.44 2gsc n ASP 68 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 2gsc h TYR 69 N 0.00 0.86 -0.61 -0.67 5.03 -1.95 -3.11 116.97 116.51 2gsc h TYR 69 Ca 0.00 -0.02 0.01 0.00 2.58 0.00 0.00 58.73 61.30 2gsc h TYR 69 Cb 0.00 -0.28 -0.03 0.00 1.55 0.00 0.00 36.73 37.97 2gsc h TYR 69 CO 0.00 0.61 0.40 0.77 -1.32 0.00 0.00 178.16 178.62 2gsc h SER 70 N 0.86 0.69 -0.73 -2.11 0.02 -1.96 -2.70 113.55 107.61 2gsc h SER 70 Ca 0.22 -0.02 0.07 0.00 -0.84 0.00 0.00 61.79 61.23 2gsc h SER 70 Cb 0.03 -0.17 -0.06 0.00 0.14 0.00 0.00 62.40 62.34 2gsc h SER 70 CO -0.04 0.50 0.41 -0.09 -1.14 0.00 0.00 176.83 176.47 2gsc h ARG 71 N 0.82 0.70 -0.64 3.45 2.43 -1.98 0.01 114.38 119.17 2gsc h ARG 71 Ca 0.23 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.31 2gsc h ARG 71 Cb -0.08 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.28 2gsc h ARG 71 CO -0.05 0.47 0.23 0.74 -1.51 0.00 0.00 179.97 179.84 2gsc h PHE 72 N 0.72 0.97 -0.12 2.20 0.04 -1.46 -1.98 116.94 117.32 2gsc h PHE 72 Ca 0.34 -0.07 -0.13 0.00 2.80 0.00 0.00 57.97 60.91 2gsc h PHE 72 Cb 0.26 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 38.11 2gsc h PHE 72 CO -0.08 0.76 -0.50 -0.07 -0.60 0.00 0.00 178.31 177.82 2gsc h LEU 73 N 0.93 0.34 -0.59 1.54 3.38 -1.07 -2.19 115.31 117.64 2gsc h LEU 73 Ca 0.21 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 58.03 2gsc h LEU 73 Cb 0.22 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 2gsc h LEU 73 CO -0.01 0.78 0.38 -1.28 0.09 0.00 0.00 178.44 178.40 2gsc h SER 74 N 0.25 0.65 -0.53 -0.43 0.87 -0.64 -0.53 113.55 113.19 2gsc h SER 74 Ca 0.01 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2gsc h SER 74 Cb 0.97 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 62.75 2gsc h SER 74 CO 0.08 0.46 0.31 0.40 -0.53 0.00 0.00 176.83 177.55 2gsc h ILE 75 N 0.77 1.17 -0.98 2.23 2.04 -1.21 -1.80 117.51 119.73 2gsc h ILE 75 Ca 0.23 -0.41 0.01 0.00 1.00 0.00 0.00 64.86 65.69 2gsc h ILE 75 Cb -0.05 0.48 -0.05 0.00 -0.74 0.00 0.00 36.82 36.46 2gsc h ILE 75 CO -0.07 0.18 0.65 0.00 0.00 0.00 0.00 178.15 178.91 2gsc h ALA 76 N 1.14 1.25 -0.08 1.87 0.00 -1.03 -1.50 119.26 120.91 2gsc h ALA 76 Ca 0.19 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2gsc h ALA 76 Cb 0.02 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 2gsc h ALA 76 CO -0.03 0.62 -0.50 -0.09 0.00 0.00 0.00 179.25 179.25 2gsc h ARG 77 N 1.32 0.22 -0.56 0.00 2.43 -0.78 -1.73 114.38 115.27 2gsc h ARG 77 Ca 0.36 -0.12 -0.10 0.00 -0.81 0.00 0.00 59.98 59.32 2gsc h ARG 77 Cb -0.13 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.41 2gsc h ARG 77 CO -0.08 0.67 -0.03 0.78 -1.51 0.00 0.00 179.97 179.79 2gsc h GLY 78 N 1.35 1.07 1.55 2.80 0.00 -0.88 -2.86 103.07 106.10 2gsc h GLY 78 Ca 0.01 -0.79 -0.08 0.00 0.00 0.00 0.00 47.33 46.46 2gsc h GLY 78 CO 0.08 0.73 -0.17 1.76 0.00 0.00 0.00 176.54 178.94 2gsc h SER 79 N 0.90 0.53 -0.31 0.19 0.02 -0.96 -1.27 113.55 112.65 2gsc h SER 79 Ca 0.16 -0.16 0.02 0.00 -0.84 0.00 0.00 61.79 60.97 2gsc h SER 79 Cb 0.57 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 2gsc h SER 79 CO 0.03 0.72 0.15 0.25 -1.14 0.00 0.00 176.83 176.84 2gsc h LEU 80 N 0.49 0.22 -0.68 5.07 6.46 -1.22 0.11 115.31 125.75 2gsc h LEU 80 Ca 0.08 0.02 -0.02 0.00 -0.12 0.00 0.00 57.88 57.83 2gsc h LEU 80 Cb 0.57 -0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.45 2gsc h LEU 80 CO 0.04 0.16 0.33 0.28 -0.62 0.00 0.00 178.44 178.63 2gsc h SER 81 N 0.31 0.89 -0.58 1.25 0.02 -1.27 0.14 113.55 114.31 2gsc h SER 81 Ca 0.13 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2gsc h SER 81 Cb 0.05 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.33 2gsc h SER 81 CO -0.09 0.77 0.33 -0.08 -1.14 0.00 0.00 176.83 176.62 2gsc h GLU 82 N 0.94 0.80 0.05 3.45 4.81 -0.90 -0.36 114.58 123.37 2gsc h GLU 82 Ca 0.23 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 2gsc h GLU 82 Cb 0.11 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.33 2gsc h GLU 82 CO -0.03 0.59 -0.03 1.25 -0.73 0.00 0.00 179.01 180.07 2gsc h LEU 83 N 0.78 -0.06 -1.16 1.64 6.46 -0.49 -0.67 115.31 121.80 2gsc h LEU 83 Ca 0.21 -0.04 0.06 0.00 -0.12 0.00 0.00 57.88 57.99 2gsc h LEU 83 Cb 0.02 0.02 -0.06 0.00 -0.73 0.00 0.00 40.66 39.91 2gsc h LEU 83 CO -0.04 -0.00 0.58 -0.78 -0.62 0.00 0.00 178.44 177.58 2gsc h ASP 84 N -0.12 0.90 -0.51 1.25 1.82 -0.50 0.29 116.42 119.55 2gsc h ASP 84 Ca -0.01 0.00 -0.08 0.00 -0.39 0.00 0.00 57.03 56.55 2gsc h ASP 84 Cb 0.10 -0.19 -0.02 0.00 0.68 0.00 0.00 39.33 39.90 2gsc h ASP 84 CO 0.01 0.58 -0.00 0.74 -1.61 0.00 0.00 179.24 178.96 2gsc h THR 85 N 1.02 1.26 0.00 2.25 2.02 -0.74 -2.43 112.91 116.29 2gsc h THR 85 Ca 0.38 -1.10 -0.12 0.00 0.77 0.00 0.00 66.41 66.34 2gsc h THR 85 Cb 0.19 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 2gsc h THR 85 CO -0.14 0.39 -0.58 1.56 0.37 0.00 0.00 175.52 177.12 2gsc h GLN 86 N 0.78 0.00 -0.53 6.66 4.20 0.07 -2.06 115.11 124.24 2gsc h GLN 86 Ca 0.15 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.78 2gsc h GLN 86 Cb 0.53 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.29 2gsc h GLN 86 CO 0.03 0.58 0.04 0.28 -0.67 0.00 0.00 178.83 179.08 2gsc h VAL 87 N 0.00 1.26 -0.65 -0.54 2.07 -0.45 -1.86 116.25 116.08 2gsc h VAL 87 Ca -0.01 -1.03 -0.04 0.00 0.82 0.00 0.00 66.70 66.44 2gsc h VAL 87 Cb 1.13 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 2gsc h VAL 87 CO 0.07 0.37 0.23 1.56 0.02 0.00 0.00 177.57 179.82 2gsc h GLN 88 N 0.78 0.97 -0.34 1.57 4.20 -1.04 -0.91 115.11 120.34 2gsc h GLN 88 Ca 0.16 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 2gsc h GLN 88 Cb 0.47 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2gsc h GLN 88 CO 0.02 0.81 0.14 0.82 -0.67 0.00 0.00 178.83 179.95 2gsc h ILE 89 N 0.94 1.18 -0.48 2.54 2.04 -1.25 0.36 117.51 122.84 2gsc h ILE 89 Ca 0.22 -0.55 0.10 0.00 1.00 0.00 0.00 64.86 65.62 2gsc h ILE 89 Cb 0.23 0.92 -0.09 0.00 -0.74 0.00 0.00 36.82 37.15 2gsc h ILE 89 CO -0.01 0.20 -0.07 0.00 0.00 0.00 0.00 178.15 178.27 2gsc h ALA 90 N 0.98 0.38 0.02 1.87 0.00 -0.98 0.99 119.26 122.53 2gsc h ALA 90 Ca 0.11 0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.20 2gsc h ALA 90 Cb 0.18 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2gsc h ALA 90 CO -0.01 -0.42 -0.06 0.00 0.00 0.00 0.00 179.25 178.75 2gsc h ALA 91 N 1.46 -0.09 0.00 0.00 0.00 -0.70 -1.79 119.26 118.14 2gsc h ALA 91 Ca 0.24 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 2gsc h ALA 91 Cb 0.36 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2gsc h ALA 91 CO -0.46 -0.57 -0.25 0.00 0.00 0.00 0.00 179.25 177.98 2gsc h ARG 92 N -0.12 0.00 -0.00 0.00 3.08 -0.46 -2.37 114.38 114.50 2gsc h ARG 92 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2gsc h ARG 92 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2gsc h ARG 92 CO -0.05 0.25 -0.05 1.28 -1.07 0.00 0.00 179.97 180.33 2gsc n LEU 93 N -4.22 0.31 0.00 3.04 4.77 0.30 -4.92 117.00 116.28 2gsc n LEU 93 Ca -0.02 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2gsc n LEU 93 Cb 0.30 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2gsc n LEU 93 CO 0.37 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 2gsc n GLY 94 N 1.21 0.47 0.03 -0.72 0.00 -0.89 -4.95 105.19 100.35 2gsc n GLY 94 Ca 0.17 -0.77 0.12 0.00 0.00 0.00 0.00 46.02 45.54 2gsc n GLY 94 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2gsc n TYR 95 N -2.89 0.30 -4.53 1.61 4.01 -0.69 -4.84 117.16 110.12 2gsc n TYR 95 Ca 0.00 0.09 -0.21 0.00 -0.16 0.00 0.00 57.90 57.62 2gsc n TYR 95 Cb 0.00 -0.50 -0.15 0.00 -0.31 0.00 0.00 39.34 38.38 2gsc n TYR 95 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 2gsc s SER 96 N -3.62 1.40 0.16 7.72 1.04 -1.24 -4.70 113.70 114.46 2gsc s SER 96 Ca 0.09 -0.22 -0.21 0.00 0.48 0.00 0.00 55.95 56.09 2gsc s SER 96 Cb 0.16 -0.16 -0.08 0.00 0.10 0.00 0.00 66.02 66.04 2gsc s SER 96 CO 0.68 0.15 0.69 0.00 0.98 0.00 0.00 173.24 175.74 2gsc s ARG 97 N -0.28 4.34 0.04 4.02 1.70 -1.26 -4.80 118.95 122.71 2gsc s ARG 97 Ca 0.05 0.92 -0.09 0.00 -0.47 0.00 0.00 55.73 56.14 2gsc s ARG 97 Cb -0.05 -3.11 -0.02 0.00 -0.57 0.00 0.00 34.95 31.20 2gsc s ARG 97 CO -0.00 0.53 0.50 -1.13 -1.08 0.00 0.00 175.30 174.12 2gsc n SER 98 N 1.29 -0.30 -0.33 -2.89 3.41 -1.26 -0.58 113.62 112.97 2gsc n SER 98 Ca -0.06 0.57 0.21 0.00 -0.26 0.00 0.00 58.87 59.33 2gsc n SER 98 Cb 0.50 -0.10 0.46 0.00 -0.26 0.00 0.00 64.21 64.81 2gsc n SER 98 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2gsc h GLU 99 N 0.00 0.45 0.15 4.33 4.11 -1.99 0.34 114.58 121.97 2gsc h GLU 99 Ca 0.04 -0.03 -0.32 0.00 0.07 0.00 0.00 59.36 59.13 2gsc h GLU 99 Cb 0.11 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2gsc h GLU 99 CO -0.26 0.30 -1.55 -0.44 0.07 0.00 0.00 179.01 177.13 2gsc h ASP 100 N 0.47 0.49 -0.56 3.06 3.32 -1.24 -2.93 116.42 119.03 2gsc h ASP 100 Ca 0.60 -0.66 0.03 0.00 0.02 0.00 0.00 57.03 57.03 2gsc h ASP 100 Cb 1.38 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 40.73 2gsc h ASP 100 CO -0.34 1.54 0.33 -0.78 -1.72 0.00 0.00 179.24 178.27 2gsc h ASP 101 N 0.09 0.53 -0.29 6.45 3.58 -0.06 -2.35 116.42 124.36 2gsc h ASP 101 Ca -0.26 0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.15 2gsc h ASP 101 Cb 2.05 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 42.99 2gsc h ASP 101 CO 0.18 0.37 -0.01 1.56 -2.88 0.00 0.00 179.24 178.46 2gsc h GLN 102 N 0.65 0.52 -0.63 0.28 1.08 -0.50 -1.62 115.11 114.88 2gsc h GLN 102 Ca 0.23 -0.17 0.11 0.00 -1.45 0.00 0.00 58.65 57.37 2gsc h GLN 102 Cb 0.05 -0.04 -0.08 0.00 -0.05 0.00 0.00 27.48 27.35 2gsc h GLN 102 CO -0.11 0.67 0.20 0.77 -0.95 0.00 0.00 178.83 179.42 2gsc h SER 103 N 0.30 0.15 -0.23 1.46 0.02 -1.38 -1.20 113.55 112.66 2gsc h SER 103 Ca 0.08 0.10 -0.10 0.00 -0.84 0.00 0.00 61.79 61.02 2gsc h SER 103 Cb 0.45 0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.08 2gsc h SER 103 CO 0.02 0.08 -0.26 0.58 -1.14 0.00 0.00 176.83 176.11 2gsc h VAL 104 N 0.36 1.32 -0.33 2.27 2.07 -1.33 -2.41 116.25 118.19 2gsc h VAL 104 Ca 0.33 -1.44 0.05 0.00 0.82 0.00 0.00 66.70 66.46 2gsc h VAL 104 Cb 0.46 1.71 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 2gsc h VAL 104 CO -0.36 0.45 0.07 0.03 0.02 0.00 0.00 177.57 177.78 2gsc h ARG 105 N 0.29 0.19 -0.44 1.57 2.47 -1.01 0.88 114.38 118.33 2gsc h ARG 105 Ca 0.03 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.74 2gsc h ARG 105 Cb 0.83 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 29.08 2gsc h ARG 105 CO 0.06 0.12 0.26 0.00 0.56 0.00 0.00 179.97 180.98 2gsc h ARG 106 N 0.19 0.60 -0.76 0.04 3.08 -1.23 -1.24 114.38 115.07 2gsc h ARG 106 Ca 0.16 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.13 2gsc h ARG 106 Cb 0.17 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.06 2gsc h ARG 106 CO -0.20 0.44 0.40 0.37 -1.07 0.00 0.00 179.97 179.92 2gsc h GLN 107 N 0.58 1.05 -0.68 0.04 5.75 -1.06 0.29 115.11 121.08 2gsc h GLN 107 Ca 0.16 -0.12 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 2gsc h GLN 107 Cb 0.00 -0.21 -0.03 0.00 1.07 0.00 0.00 27.48 28.31 2gsc h GLN 107 CO -0.03 0.78 0.42 0.28 -2.65 0.00 0.00 178.83 177.63 2gsc h VAL 108 N 1.06 1.19 -0.56 2.39 2.07 -0.37 -0.08 116.25 121.95 2gsc h VAL 108 Ca 0.27 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.34 2gsc h VAL 108 Cb 0.04 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.03 2gsc h VAL 108 CO -0.04 0.19 0.17 0.44 0.02 0.00 0.00 177.57 178.36 2gsc h ASP 109 N 0.92 0.81 0.19 0.57 3.32 -0.53 -0.53 116.42 121.18 2gsc h ASP 109 Ca 0.24 -0.21 0.01 0.00 0.02 0.00 0.00 57.03 57.09 2gsc h ASP 109 Cb -0.05 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.27 2gsc h ASP 109 CO -0.05 0.80 -0.22 0.25 -1.72 0.00 0.00 179.24 178.31 2gsc h LEU 110 N 0.78 -0.59 -0.90 1.55 5.85 -0.70 -1.59 115.31 119.71 2gsc h LEU 110 Ca 0.18 0.06 0.07 0.00 0.84 0.00 0.00 57.88 59.03 2gsc h LEU 110 Cb 0.28 0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.46 2gsc h LEU 110 CO -0.01 -0.32 0.56 0.58 -0.34 0.00 0.00 178.44 178.91 2gsc h VAL 111 N -0.46 1.03 -0.47 1.05 2.07 -0.87 -1.79 116.25 116.82 2gsc h VAL 111 Ca 0.01 -0.34 0.04 0.00 0.82 0.00 0.00 66.70 67.22 2gsc h VAL 111 Cb 0.44 -0.06 -0.04 0.00 -1.52 0.00 0.00 31.29 30.11 2gsc h VAL 111 CO -0.07 0.18 0.25 0.15 0.02 0.00 0.00 177.57 178.10 2gsc h PHE 112 N 1.00 0.45 -0.20 1.57 3.57 -0.85 -0.91 116.94 121.57 2gsc h PHE 112 Ca 0.40 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.90 2gsc h PHE 112 Cb 0.21 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 2gsc h PHE 112 CO -0.03 0.23 0.08 0.00 -2.23 0.00 0.00 178.31 176.36 2gsc h ALA 113 N 1.25 0.26 -0.17 2.41 0.00 -0.74 -1.49 119.26 120.78 2gsc h ALA 113 Ca 0.20 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2gsc h ALA 113 Cb 0.10 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2gsc h ALA 113 CO -0.13 -0.14 -0.28 0.87 0.00 0.00 0.00 179.25 179.57 2gsc h LYS 114 N 0.17 0.31 0.08 0.00 1.79 -1.19 -1.69 116.57 116.04 2gsc h LYS 114 Ca 0.07 -0.11 -0.27 0.00 -2.18 0.00 0.00 60.65 58.15 2gsc h LYS 114 Cb 0.19 -0.02 0.01 0.00 -1.58 0.00 0.00 32.23 30.83 2gsc h LYS 114 CO -0.00 0.57 -1.13 1.25 -1.08 0.00 0.00 179.45 179.05 2gsc h LEU 115 N 0.28 0.67 -0.13 2.94 5.85 -1.05 -2.36 115.31 121.51 2gsc h LEU 115 Ca 0.04 -0.60 -0.24 0.00 0.84 0.00 0.00 57.88 57.92 2gsc h LEU 115 Cb 0.64 -0.21 0.01 0.00 0.37 0.00 0.00 40.66 41.47 2gsc h LEU 115 CO 0.05 1.42 -0.98 0.71 -0.34 0.00 0.00 178.44 179.30 2gsc h THR 116 N 0.22 1.38 -0.33 1.05 1.35 -1.15 0.47 112.91 115.90 2gsc h THR 116 Ca -0.14 -2.44 0.01 0.00 -0.55 0.00 0.00 66.41 63.30 2gsc h THR 116 Cb 1.80 2.44 -0.02 0.00 -1.73 0.00 0.00 68.15 70.64 2gsc h THR 116 CO 0.20 0.73 0.22 0.00 -0.25 0.00 0.00 175.52 176.43 2gsc h ALA 117 N 0.66 1.82 0.01 6.62 0.00 -1.38 0.29 119.26 127.29 2gsc h ALA 117 Ca -0.09 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.63 2gsc h ALA 117 Cb 1.62 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 19.31 2gsc h ALA 117 CO 0.17 0.15 -0.65 1.25 0.00 0.00 0.00 179.25 180.17 2gsc h LEU 118 N 0.40 0.55 -0.54 0.00 5.85 -1.19 -2.82 115.31 117.55 2gsc h LEU 118 Ca 0.13 -0.78 0.01 0.00 0.84 0.00 0.00 57.88 58.08 2gsc h LEU 118 Cb 0.02 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 2gsc h LEU 118 CO -0.03 1.26 0.35 0.24 -0.34 0.00 0.00 178.44 179.93 2gsc h MET 119 N -0.10 0.70 -0.49 1.25 2.86 -0.46 -2.15 114.93 116.53 2gsc h MET 119 Ca -0.09 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.49 2gsc h MET 119 Cb 1.37 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 32.85 2gsc h MET 119 CO 0.13 0.46 0.22 -0.91 1.06 0.00 0.00 176.91 177.87 2gsc h ASN 120 N 0.72 0.62 1.17 1.22 2.35 -0.51 -2.00 115.58 119.14 2gsc h ASN 120 Ca 0.20 -0.06 -0.11 0.00 -0.55 0.00 0.00 56.30 55.78 2gsc h ASN 120 Cb -0.07 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.13 2gsc h ASN 120 CO -0.05 0.54 -0.54 0.00 -1.65 0.00 0.00 177.43 175.73 2gsc h ALA 121 N 1.56 0.74 -0.17 -0.83 0.00 -1.26 -2.81 119.26 116.49 2gsc h ALA 121 Ca 0.17 -0.49 -0.20 0.00 0.00 0.00 0.00 54.91 54.39 2gsc h ALA 121 Cb 0.10 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.81 2gsc h ALA 121 CO -0.02 0.67 -0.66 -0.07 0.00 0.00 0.00 179.25 179.17 2gsc h LEU 122 N 0.00 0.88 -1.35 0.00 3.38 -0.93 -2.11 115.31 115.18 2gsc h LEU 122 Ca -0.01 -0.61 -0.05 0.00 0.09 0.00 0.00 57.88 57.30 2gsc h LEU 122 Cb 1.27 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 2gsc h LEU 122 CO 0.07 1.34 -0.15 0.03 0.09 0.00 0.00 178.44 179.82 2gsc h ARG 123 N 0.47 0.24 0.00 1.13 3.08 -1.39 -2.43 114.38 115.49 2gsc h ARG 123 Ca -0.03 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 59.81 2gsc h ARG 123 Cb 1.29 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.29 2gsc h ARG 123 CO 0.14 0.40 -0.67 0.00 -1.07 0.00 0.00 179.97 178.77 2gsc h ARG 124 N 0.23 0.00 0.00 0.04 3.08 -1.51 -3.52 114.38 112.70 2gsc h ARG 124 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 2gsc h ARG 124 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2gsc h ARG 124 CO 0.03 0.67 0.00 0.54 -1.07 0.00 0.00 179.97 180.14