#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gdh s LYS 3 N 0.00 2.46 -0.02 1.97 1.02 -1.26 -4.60 119.74 119.30 1gdh s LYS 3 Ca 0.00 1.26 0.02 0.00 0.02 0.00 0.00 55.97 57.28 1gdh s LYS 3 Cb 0.00 -1.92 -0.03 0.00 -0.52 0.00 0.00 37.83 35.36 1gdh s LYS 3 CO 0.00 -1.50 -0.07 0.15 -0.92 0.00 0.00 175.35 173.01 1gdh s LYS 4 N -4.57 2.62 0.02 1.68 1.02 -1.26 -1.13 119.74 118.11 1gdh s LYS 4 Ca 0.64 -0.66 0.02 0.00 0.02 0.00 0.00 55.97 55.98 1gdh s LYS 4 Cb -0.19 -2.53 -0.01 0.00 -0.52 0.00 0.00 37.83 34.58 1gdh s LYS 4 CO 0.50 0.62 -0.06 0.96 -0.92 0.00 0.00 175.35 176.46 1gdh s ILE 5 N -0.94 0.42 -0.20 2.17 -4.36 -0.99 -0.81 121.20 116.48 1gdh s ILE 5 Ca 0.16 -0.62 -0.14 0.00 -0.26 0.00 0.00 60.65 59.79 1gdh s ILE 5 Cb -0.11 -0.43 -0.04 0.00 1.25 0.00 0.00 42.46 43.13 1gdh s ILE 5 CO 0.06 -0.15 0.30 -0.22 0.24 0.00 0.00 174.94 175.17 1gdh s LEU 6 N -0.83 4.17 -0.29 0.37 2.96 -0.14 -1.44 118.68 123.47 1gdh s LEU 6 Ca -0.05 0.39 -0.06 0.00 -0.22 0.00 0.00 54.13 54.19 1gdh s LEU 6 Cb -0.06 -2.35 0.01 0.00 0.50 0.00 0.00 46.19 44.29 1gdh s LEU 6 CO 0.00 0.01 0.07 -0.63 -1.32 0.00 0.00 176.35 174.49 1gdh s ILE 7 N 1.00 3.89 0.07 6.68 1.01 -0.55 0.10 121.20 133.40 1gdh s ILE 7 Ca 0.15 -0.72 0.22 0.00 0.00 0.00 0.00 60.65 60.30 1gdh s ILE 7 Cb -0.14 -3.01 0.21 0.00 0.01 0.00 0.00 42.46 39.53 1gdh s ILE 7 CO 0.06 0.08 1.75 0.71 0.00 0.00 0.00 174.94 177.54 1gdh h THR 8 N 5.89 0.60 -3.98 2.92 1.35 -1.63 -1.93 112.91 116.12 1gdh h THR 8 Ca -0.31 -1.31 -0.21 0.00 -0.55 0.00 0.00 66.41 64.03 1gdh h THR 8 Cb 1.12 1.88 -0.19 0.00 -1.73 0.00 0.00 68.15 69.24 1gdh h THR 8 CO 0.60 0.26 -0.71 0.26 -0.25 0.00 0.00 175.52 175.68 1gdh s TRP 9 N -3.52 0.56 0.06 4.73 0.52 -1.26 -4.30 118.94 115.72 1gdh s TRP 9 Ca 0.01 -0.65 -0.31 0.00 0.02 0.00 0.00 56.10 55.18 1gdh s TRP 9 Cb 0.10 -0.35 -0.08 0.00 -1.15 0.00 0.00 33.47 31.99 1gdh s TRP 9 CO 0.66 -0.17 1.56 -1.25 0.02 0.00 0.00 176.95 177.77 1gdh s PRO 10 N -2.20 4.23 0.49 4.98 0.05 -1.14 -4.77 135.00 136.63 1gdh s PRO 10 Ca -0.06 2.22 0.08 0.00 0.05 0.00 0.00 61.00 63.29 1gdh s PRO 10 Cb -0.05 -3.52 0.04 0.00 0.05 0.00 0.00 34.50 31.01 1gdh s PRO 10 CO -0.02 -0.66 0.60 -0.51 0.05 0.00 0.00 177.00 176.46 1gdh s LEU 11 N 2.31 3.29 0.47 -3.56 1.43 -1.26 -5.09 118.68 116.27 1gdh s LEU 11 Ca 0.70 -0.74 -0.23 0.00 -1.03 0.00 0.00 54.13 52.84 1gdh s LEU 11 Cb -0.38 -1.99 -0.09 0.00 0.03 0.00 0.00 46.19 43.76 1gdh s LEU 11 CO 0.31 -1.00 1.04 -0.81 0.23 0.00 0.00 176.35 176.12 1gdh n PRO 12 N -1.93 1.34 -0.19 1.29 -0.04 -1.26 -4.62 135.00 129.59 1gdh n PRO 12 Ca 0.09 0.49 0.18 0.00 -0.04 0.00 0.00 63.50 64.21 1gdh n PRO 12 Cb 0.61 -2.14 0.52 0.00 -0.04 0.00 0.00 33.50 32.46 1gdh n PRO 12 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1gdh h GLU 13 N 1.37 0.37 -0.00 0.54 4.11 -1.99 0.22 114.58 119.20 1gdh h GLU 13 Ca -0.46 -0.02 -0.11 0.00 0.07 0.00 0.00 59.36 58.83 1gdh h GLU 13 Cb 1.34 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.49 1gdh h GLU 13 CO 0.56 0.24 -0.55 0.00 0.07 0.00 0.00 179.01 179.33 1gdh h ALA 14 N 1.63 1.10 0.43 1.06 0.00 -1.99 -1.15 119.26 120.34 1gdh h ALA 14 Ca 0.41 -0.50 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1gdh h ALA 14 Cb 1.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1gdh h ALA 14 CO -0.13 0.68 -0.21 0.00 0.00 0.00 0.00 179.25 179.59 1gdh h ALA 15 N 1.45 -0.58 -1.00 0.00 0.00 -0.92 -3.03 119.26 115.19 1gdh h ALA 15 Ca -0.01 -0.16 0.25 0.00 0.00 0.00 0.00 54.91 54.99 1gdh h ALA 15 Cb 0.97 0.22 -0.08 0.00 0.00 0.00 0.00 17.79 18.90 1gdh h ALA 15 CO 0.07 -0.57 0.65 0.52 0.00 0.00 0.00 179.25 179.93 1gdh h MET 16 N -1.09 0.36 0.01 0.00 2.86 -1.26 -1.53 114.93 114.28 1gdh h MET 16 Ca -0.06 -0.02 -0.23 0.00 -2.06 0.00 0.00 59.70 57.33 1gdh h MET 16 Cb 0.51 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.09 1gdh h MET 16 CO 0.10 0.24 -0.97 0.00 1.06 0.00 0.00 176.91 177.34 1gdh h ALA 17 N 1.60 0.34 -0.22 6.32 0.00 -1.28 -0.43 119.26 125.58 1gdh h ALA 17 Ca 0.54 -0.72 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1gdh h ALA 17 Cb 1.43 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 1gdh h ALA 17 CO -0.23 0.82 0.07 -0.09 0.00 0.00 0.00 179.25 179.82 1gdh h ARG 18 N 0.23 0.35 -0.50 0.00 2.43 -1.18 -2.32 114.38 113.39 1gdh h ARG 18 Ca -0.09 -0.07 0.08 0.00 -0.81 0.00 0.00 59.98 59.09 1gdh h ARG 18 Cb 1.61 -0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 31.04 1gdh h ARG 18 CO 0.17 0.44 0.13 0.00 -1.51 0.00 0.00 179.97 179.20 1gdh h ALA 19 N 0.90 0.58 0.00 2.80 0.00 -1.12 0.03 119.26 122.44 1gdh h ALA 19 Ca 0.07 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1gdh h ALA 19 Cb 0.23 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1gdh h ALA 19 CO -0.00 -0.27 0.00 0.54 0.00 0.00 0.00 179.25 179.52 1gdh n ARG 20 N -5.07 0.09 -0.30 0.00 1.74 -0.19 -1.33 116.66 111.60 1gdh n ARG 20 Ca 0.05 0.19 0.08 0.00 -0.77 0.00 0.00 57.85 57.41 1gdh n ARG 20 Cb 0.23 -1.63 0.23 0.00 -1.02 0.00 0.00 32.46 30.27 1gdh n ARG 20 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1gdh n GLU 21 N -1.78 2.34 0.00 5.56 -0.58 -0.02 -4.22 120.64 121.93 1gdh n GLU 21 Ca 0.05 -1.89 0.00 0.00 -0.42 0.00 0.00 57.16 54.90 1gdh n GLU 21 Cb 0.29 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.70 1gdh n GLU 21 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1gdh n SER 22 N 0.96 0.08 -4.06 1.62 7.64 -0.82 -5.06 113.62 113.99 1gdh n SER 22 Ca 0.17 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.96 1gdh n SER 22 Cb 0.48 0.02 -0.08 0.00 -1.01 0.00 0.00 64.21 63.61 1gdh n SER 22 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1gdh s TYR 23 N -0.05 0.65 -0.57 1.43 2.02 -0.44 -4.48 117.35 115.91 1gdh s TYR 23 Ca 0.00 -0.99 -0.19 0.00 -0.37 0.00 0.00 57.07 55.51 1gdh s TYR 23 Cb 0.00 -0.23 0.08 0.00 -0.40 0.00 0.00 41.96 41.42 1gdh s TYR 23 CO 0.00 -0.69 0.71 0.34 -1.57 0.00 0.00 175.55 174.34 1gdh s ASP 24 N -3.03 6.20 -0.07 2.29 2.15 -0.28 -4.48 116.67 119.44 1gdh s ASP 24 Ca 0.24 -1.19 -0.20 0.00 0.43 0.00 0.00 52.55 51.83 1gdh s ASP 24 Cb 0.05 -2.31 -0.04 0.00 -0.30 0.00 0.00 42.92 40.31 1gdh s ASP 24 CO 0.04 -1.08 0.57 -0.69 -0.17 0.00 0.00 175.17 173.84 1gdh s VAL 25 N 2.83 5.08 -0.60 1.11 1.01 -1.26 -2.36 120.40 126.21 1gdh s VAL 25 Ca 0.14 1.16 -0.14 0.00 0.00 0.00 0.00 61.98 63.14 1gdh s VAL 25 Cb -0.22 -3.90 0.15 0.00 0.00 0.00 0.00 36.38 32.41 1gdh s VAL 25 CO 0.09 0.33 0.54 -0.63 0.00 0.00 0.00 175.10 175.43 1gdh s ILE 26 N 0.43 5.15 -0.24 2.22 1.01 -0.52 -4.99 121.20 124.26 1gdh s ILE 26 Ca 0.30 -1.79 -0.23 0.00 0.00 0.00 0.00 60.65 58.94 1gdh s ILE 26 Cb -0.17 -4.28 -0.01 0.00 0.01 0.00 0.00 42.46 38.01 1gdh s ILE 26 CO 0.14 -0.90 0.76 0.00 0.00 0.00 0.00 174.94 174.95 1gdh s ALA 27 N 1.21 3.63 0.14 9.38 0.00 -1.26 -1.48 121.76 133.37 1gdh s ALA 27 Ca 0.07 -0.22 -0.13 0.00 0.00 0.00 0.00 51.96 51.67 1gdh s ALA 27 Cb -0.25 -3.20 -0.07 0.00 0.00 0.00 0.00 23.12 19.61 1gdh s ALA 27 CO -0.00 -0.87 0.52 -1.58 0.00 0.00 0.00 175.76 173.84 1gdh s HIS 28 N 2.68 3.60 0.00 0.00 2.46 -0.73 -5.00 115.29 118.30 1gdh s HIS 28 Ca 0.32 1.01 0.00 0.00 0.47 0.00 0.00 55.06 56.86 1gdh s HIS 28 Cb -0.15 -2.33 0.00 0.00 -0.13 0.00 0.00 32.58 29.96 1gdh s HIS 28 CO 0.08 0.44 0.00 0.41 -2.47 0.00 0.00 174.74 173.20 1gdh n GLY 29 N 0.80 -1.02 0.00 1.59 0.00 -1.26 -2.91 105.19 102.39 1gdh n GLY 29 Ca -0.06 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.34 1gdh n GLY 29 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gdh n ASP 30 N -1.24 2.01 0.00 1.61 5.68 -1.26 -4.40 116.55 118.95 1gdh n ASP 30 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1gdh n ASP 30 Cb 0.00 0.37 0.00 0.00 -1.14 0.00 0.00 41.12 40.35 1gdh n ASP 30 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 1gdh n ASP 31 N -0.67 0.00 -4.32 -1.12 -0.08 -1.26 -0.95 116.55 108.16 1gdh n ASP 31 Ca 0.00 0.33 -0.45 0.00 -1.51 0.00 0.00 54.79 53.16 1gdh n ASP 31 Cb 0.03 -0.05 -0.02 0.00 2.34 0.00 0.00 41.12 43.42 1gdh n ASP 31 CO 0.00 0.00 0.00 -2.16 0.12 0.00 0.00 177.20 175.16 1gdh s PRO 32 N -1.37 3.79 1.00 -0.67 0.04 -1.26 -5.05 135.00 131.48 1gdh s PRO 32 Ca 0.00 -2.80 -0.18 0.00 0.04 0.00 0.00 61.00 58.06 1gdh s PRO 32 Cb 0.00 -4.44 -0.11 0.00 0.04 0.00 0.00 34.50 29.99 1gdh s PRO 32 CO 0.00 -1.27 -0.67 0.36 0.04 0.00 0.00 177.00 175.47 1gdh n LYS 33 N 3.39 -0.12 -1.70 4.56 2.85 -0.12 -4.79 118.16 122.23 1gdh n LYS 33 Ca 0.18 -0.03 -0.43 0.00 -1.05 0.00 0.00 58.31 56.98 1gdh n LYS 33 Cb 0.43 -1.18 -0.03 0.00 -0.65 0.00 0.00 35.03 33.60 1gdh n LYS 33 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 177.40 178.86 1gdh n ILE 34 N -2.93 0.23 -3.13 0.58 3.06 -1.26 -5.00 119.36 110.92 1gdh n ILE 34 Ca -0.00 -0.04 -0.32 0.00 -2.50 0.00 0.00 62.75 59.88 1gdh n ILE 34 Cb 0.59 -2.03 -0.06 0.00 0.54 0.00 0.00 39.64 38.68 1gdh n ILE 34 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 1gdh s THR 35 N 2.15 4.71 0.26 9.51 -4.23 -1.26 -4.99 115.64 121.79 1gdh s THR 35 Ca 0.80 0.88 -0.02 0.00 -1.18 0.00 0.00 61.69 62.16 1gdh s THR 35 Cb -0.51 -3.62 0.24 0.00 1.34 0.00 0.00 72.50 69.95 1gdh s THR 35 CO 0.36 -0.21 1.82 0.40 -0.54 0.00 0.00 174.62 176.45 1gdh h ILE 36 N 1.87 0.93 -0.49 2.99 2.04 -1.98 -0.17 117.51 122.70 1gdh h ILE 36 Ca -0.48 -0.31 -0.00 0.00 1.00 0.00 0.00 64.86 65.08 1gdh h ILE 36 Cb 1.18 -0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1gdh h ILE 36 CO 0.65 0.16 0.30 0.44 0.00 0.00 0.00 178.15 179.71 1gdh h ASP 37 N 0.90 0.58 -0.63 1.72 3.32 -1.98 0.52 116.42 120.84 1gdh h ASP 37 Ca 0.44 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.43 1gdh h ASP 37 Cb 0.39 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 1gdh h ASP 37 CO -0.25 0.44 0.28 -0.33 -1.72 0.00 0.00 179.24 177.66 1gdh h GLU 38 N 0.67 0.95 -0.11 3.56 5.08 -1.45 0.36 114.58 123.65 1gdh h GLU 38 Ca 0.18 -0.14 -0.08 0.00 -1.00 0.00 0.00 59.36 58.31 1gdh h GLU 38 Cb -0.04 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.04 1gdh h GLU 38 CO -0.04 0.76 -0.25 1.98 -1.00 0.00 0.00 179.01 180.47 1gdh h MET 39 N 0.94 0.35 -0.09 2.33 4.05 0.58 0.11 114.93 123.21 1gdh h MET 39 Ca 0.23 -0.24 0.02 0.00 -0.28 0.00 0.00 59.70 59.43 1gdh h MET 39 Cb 0.15 0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 30.96 1gdh h MET 39 CO -0.02 0.85 -0.06 0.82 0.23 0.00 0.00 176.91 178.72 1gdh h ILE 40 N -0.09 0.81 0.00 1.77 1.08 -0.23 0.44 117.51 121.30 1gdh h ILE 40 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1gdh h ILE 40 Cb 0.85 0.81 0.00 0.00 -3.07 0.00 0.00 36.82 35.41 1gdh h ILE 40 CO 0.05 0.00 0.00 1.21 -0.69 0.00 0.00 178.15 178.72 1gdh n GLU 41 N -5.19 0.00 0.05 2.37 4.07 0.10 -3.08 120.64 118.96 1gdh n GLU 41 Ca -0.04 0.58 0.21 0.00 -0.06 0.00 0.00 57.16 57.84 1gdh n GLU 41 Cb 0.12 -1.41 0.73 0.00 -0.06 0.00 0.00 31.44 30.82 1gdh n GLU 41 CO 0.00 0.00 0.00 1.15 -0.06 0.00 0.00 177.13 178.22 1gdh h THR 42 N 0.00 0.44 -0.54 6.31 2.02 -0.52 0.51 112.91 121.13 1gdh h THR 42 Ca 0.00 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.33 1gdh h THR 42 Cb 0.00 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 1gdh h THR 42 CO 0.00 0.00 0.38 0.00 0.37 0.00 0.00 175.52 176.27 1gdh h ALA 43 N 1.53 2.44 0.00 6.16 0.00 -0.05 -1.67 119.26 127.67 1gdh h ALA 43 Ca 0.23 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1gdh h ALA 43 Cb 1.15 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1gdh h ALA 43 CO -0.00 -0.59 -0.17 0.87 0.00 0.00 0.00 179.25 179.35 1gdh h LYS 44 N 0.05 0.00 -0.02 0.00 6.56 -1.00 -2.21 116.57 119.96 1gdh h LYS 44 Ca 0.26 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.85 1gdh h LYS 44 Cb 0.96 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.62 1gdh h LYS 44 CO -0.02 0.17 -0.29 0.43 -2.06 0.00 0.00 179.45 177.69 1gdh n SER 45 N -3.60 1.99 -4.51 0.86 7.64 -0.63 -4.95 113.62 110.41 1gdh n SER 45 Ca -0.01 -1.49 -0.26 0.00 1.01 0.00 0.00 58.87 58.12 1gdh n SER 45 Cb 0.31 0.26 -0.10 0.00 -1.01 0.00 0.00 64.21 63.67 1gdh n SER 45 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1gdh s VAL 46 N -2.34 2.82 -0.19 0.44 -7.23 -0.83 -4.90 120.40 108.18 1gdh s VAL 46 Ca 0.23 -1.95 0.22 0.00 -1.81 0.00 0.00 61.98 58.67 1gdh s VAL 46 Cb 0.19 -2.41 -0.08 0.00 0.56 0.00 0.00 36.38 34.64 1gdh s VAL 46 CO 0.48 -0.20 0.91 0.47 -0.31 0.00 0.00 175.10 176.45 1gdh n ASP 47 N -0.13 0.70 -3.64 4.85 8.00 0.01 -4.67 116.55 121.67 1gdh n ASP 47 Ca -0.10 0.28 -0.15 0.00 0.71 0.00 0.00 54.79 55.53 1gdh n ASP 47 Cb 0.57 0.68 -0.08 0.00 -0.02 0.00 0.00 41.12 42.27 1gdh n ASP 47 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gdh s ALA 48 N -3.33 -1.36 -0.10 2.24 0.00 -1.07 -4.13 121.76 114.01 1gdh s ALA 48 Ca -0.02 1.11 -0.04 0.00 0.00 0.00 0.00 51.96 53.01 1gdh s ALA 48 Cb 0.10 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.93 1gdh s ALA 48 CO 0.81 -0.31 0.05 -0.51 0.00 0.00 0.00 175.76 175.80 1gdh s LEU 49 N -0.78 3.84 -0.26 0.00 1.43 -1.04 -0.97 118.68 120.89 1gdh s LEU 49 Ca -0.08 0.25 0.02 0.00 -1.03 0.00 0.00 54.13 53.29 1gdh s LEU 49 Cb -0.03 -1.90 0.07 0.00 0.03 0.00 0.00 46.19 44.36 1gdh s LEU 49 CO 0.06 0.39 -0.07 -0.22 0.23 0.00 0.00 176.35 176.74 1gdh s LEU 50 N -0.92 3.30 0.33 1.79 0.20 0.11 -1.57 118.68 121.93 1gdh s LEU 50 Ca 0.14 -1.43 0.09 0.00 0.69 0.00 0.00 54.13 53.61 1gdh s LEU 50 Cb -0.12 -1.42 -0.05 0.00 -0.43 0.00 0.00 46.19 44.18 1gdh s LEU 50 CO 0.03 -0.24 0.05 0.27 -0.29 0.00 0.00 176.35 176.17 1gdh s ILE 51 N 1.18 2.84 0.48 6.68 -4.36 -0.36 -1.71 121.20 125.95 1gdh s ILE 51 Ca -0.05 -1.88 0.08 0.00 -0.26 0.00 0.00 60.65 58.54 1gdh s ILE 51 Cb -0.19 -2.85 0.02 0.00 1.25 0.00 0.00 42.46 40.68 1gdh s ILE 51 CO -0.06 -0.21 0.51 0.42 0.24 0.00 0.00 174.94 175.84 1gdh s THR 52 N -2.47 2.42 -1.27 8.37 -4.23 -1.26 0.06 115.64 117.26 1gdh s THR 52 Ca 0.35 -1.23 0.08 0.00 -1.18 0.00 0.00 61.69 59.72 1gdh s THR 52 Cb -0.02 -2.64 0.12 0.00 1.34 0.00 0.00 72.50 71.30 1gdh s THR 52 CO 0.20 0.00 1.19 0.00 -0.54 0.00 0.00 174.62 175.47 1gdh n LEU 53 N -1.81 0.00 0.19 4.79 -0.00 -1.26 -2.10 117.00 116.81 1gdh n LEU 53 Ca 0.06 0.36 0.09 0.00 -0.00 0.00 0.00 56.01 56.52 1gdh n LEU 53 Cb 0.62 -0.36 0.14 0.00 -0.00 0.00 0.00 43.42 43.81 1gdh n LEU 53 CO 0.40 -0.26 0.69 0.78 -0.00 0.00 0.00 177.39 179.01 1gdh h ASN 54 N 0.00 0.00 -3.01 1.45 2.35 -1.95 -3.40 115.58 111.01 1gdh h ASN 54 Ca 0.00 0.00 -0.65 0.00 -0.55 0.00 0.00 56.30 55.10 1gdh h ASN 54 Cb 0.10 0.00 -0.16 0.00 0.05 0.00 0.00 38.32 38.32 1gdh h ASN 54 CO 0.00 0.18 0.34 -1.61 -1.65 0.00 0.00 177.43 174.70 1gdh s GLU 55 N -3.14 3.16 -0.99 0.81 8.01 -0.89 -5.02 118.70 120.64 1gdh s GLU 55 Ca 0.06 -0.77 -0.22 0.00 0.01 0.00 0.00 54.97 54.05 1gdh s GLU 55 Cb 0.06 -4.15 0.07 0.00 -4.31 0.00 0.00 34.13 25.80 1gdh s GLU 55 CO 0.69 -1.51 1.36 -1.59 0.01 0.00 0.00 175.26 174.22 1gdh s LYS 56 N 3.41 3.59 -1.39 1.61 0.00 -1.26 -4.85 119.74 120.85 1gdh s LYS 56 Ca 0.21 -1.29 -0.13 0.00 0.00 0.00 0.00 55.97 54.76 1gdh s LYS 56 Cb -0.17 -5.24 0.09 0.00 0.00 0.00 0.00 37.83 32.51 1gdh s LYS 56 CO 0.12 -2.09 2.08 0.00 0.00 0.00 0.00 175.35 175.47 1gdh s ARG 58 N 2.25 1.41 0.28 0.00 1.81 -1.26 -2.45 118.95 120.99 1gdh s ARG 58 Ca 0.45 1.04 0.00 0.00 -1.72 0.00 0.00 55.73 55.50 1gdh s ARG 58 Cb 0.12 -1.81 0.65 0.00 -0.45 0.00 0.00 34.95 33.46 1gdh s ARG 58 CO -0.05 -2.20 1.43 0.36 -0.68 0.00 0.00 175.30 174.16 1gdh n LYS 59 N -3.88 -0.07 -0.20 3.54 2.85 -1.26 0.53 118.16 119.66 1gdh n LYS 59 Ca 0.08 1.38 0.01 0.00 -1.05 0.00 0.00 58.31 58.73 1gdh n LYS 59 Cb 0.54 -2.17 0.11 0.00 -0.65 0.00 0.00 35.03 32.86 1gdh n LYS 59 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1gdh h GLU 60 N 0.00 0.35 0.01 -1.58 3.07 -1.98 -0.44 114.58 114.01 1gdh h GLU 60 Ca 0.54 -0.02 -0.25 0.00 -0.50 0.00 0.00 59.36 59.13 1gdh h GLU 60 Cb 1.07 -0.08 0.01 0.00 -0.84 0.00 0.00 28.75 28.91 1gdh h GLU 60 CO -0.87 0.23 -1.01 0.28 -1.40 0.00 0.00 179.01 176.24 1gdh h VAL 61 N 0.36 1.34 -0.70 3.13 2.07 -0.23 -2.57 116.25 119.65 1gdh h VAL 61 Ca 0.32 -2.36 -0.00 0.00 0.82 0.00 0.00 66.70 65.48 1gdh h VAL 61 Cb 0.42 2.42 -0.03 0.00 -1.52 0.00 0.00 31.29 32.58 1gdh h VAL 61 CO -0.34 0.72 0.43 0.40 0.02 0.00 0.00 177.57 178.80 1gdh h ILE 62 N 0.31 1.19 0.00 4.57 1.08 -0.28 0.33 117.51 124.72 1gdh h ILE 62 Ca -0.11 -0.41 0.00 0.00 -0.39 0.00 0.00 64.86 63.96 1gdh h ILE 62 Cb 1.65 0.20 0.00 0.00 -3.07 0.00 0.00 36.82 35.60 1gdh h ILE 62 CO 0.19 0.20 0.00 0.44 -0.69 0.00 0.00 178.15 178.28 1gdh h ASP 63 N 0.96 0.00 0.62 1.72 3.32 -0.97 -2.60 116.42 119.47 1gdh h ASP 63 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1gdh h ASP 63 Cb -0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1gdh h ASP 63 CO -0.05 0.00 -0.38 -1.14 -1.72 0.00 0.00 179.24 175.95 1gdh n ARG 64 N -3.06 0.00 -2.50 3.56 0.63 0.06 -4.93 116.66 110.42 1gdh n ARG 64 Ca 0.02 -0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.53 1gdh n ARG 64 Cb 0.36 -1.50 -0.03 0.00 0.45 0.00 0.00 32.46 31.74 1gdh n ARG 64 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1gdh s ILE 65 N -3.00 4.11 0.18 5.15 1.01 -0.90 -4.96 121.20 122.78 1gdh s ILE 65 Ca 0.12 1.61 -0.30 0.00 0.00 0.00 0.00 60.65 62.07 1gdh s ILE 65 Cb 0.18 -4.03 -0.17 0.00 0.01 0.00 0.00 42.46 38.45 1gdh s ILE 65 CO 0.66 0.18 0.71 -2.65 0.00 0.00 0.00 174.94 173.83 1gdh n PRO 66 N 3.39 0.26 0.01 2.79 -0.02 -1.26 -4.84 135.00 135.33 1gdh n PRO 66 Ca 0.06 0.09 0.09 0.00 -2.02 0.00 0.00 63.50 61.73 1gdh n PRO 66 Cb 0.47 -1.25 0.40 0.00 -0.02 0.00 0.00 33.50 33.10 1gdh n PRO 66 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1gdh n GLU 67 N 1.09 0.02 -0.26 -0.52 2.13 -1.26 -2.15 120.64 119.70 1gdh n GLU 67 Ca 0.17 0.21 0.05 0.00 0.66 0.00 0.00 57.16 58.24 1gdh n GLU 67 Cb 0.23 -1.54 0.18 0.00 0.27 0.00 0.00 31.44 30.59 1gdh n GLU 67 CO 0.00 0.00 0.00 -0.97 -0.41 0.00 0.00 177.13 175.75 1gdh h ASN 68 N 0.00 0.36 -3.44 4.31 -0.00 -1.92 -3.42 115.58 111.46 1gdh h ASN 68 Ca 0.00 0.10 -0.61 0.00 -0.00 0.00 0.00 56.30 55.79 1gdh h ASN 68 Cb 0.33 0.05 -0.11 0.00 -0.00 0.00 0.00 38.32 38.59 1gdh h ASN 68 CO 0.00 0.16 0.22 -0.63 -0.00 0.00 0.00 177.43 177.18 1gdh s ILE 69 N -6.02 4.96 -0.22 2.57 1.09 -0.91 -4.91 121.20 117.76 1gdh s ILE 69 Ca -0.12 1.21 0.12 0.00 -1.10 0.00 0.00 60.65 60.76 1gdh s ILE 69 Cb 0.20 -3.97 0.44 0.00 -1.06 0.00 0.00 42.46 38.08 1gdh s ILE 69 CO 0.77 0.01 1.20 0.29 -0.10 0.00 0.00 174.94 177.10 1gdh n LYS 70 N 5.77 2.08 -3.65 2.79 4.01 -1.26 -4.90 118.16 123.00 1gdh n LYS 70 Ca 0.01 -3.45 -0.03 0.00 -0.51 0.00 0.00 58.31 54.32 1gdh n LYS 70 Cb 0.49 -1.65 -0.06 0.00 -0.51 0.00 0.00 35.03 33.31 1gdh n LYS 70 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1gdh s ILE 72 N 2.58 0.85 -0.14 0.00 1.01 -0.43 -2.51 121.20 122.56 1gdh s ILE 72 Ca -0.06 -0.69 -0.14 0.00 0.00 0.00 0.00 60.65 59.76 1gdh s ILE 72 Cb -0.11 -1.23 -0.05 0.00 0.01 0.00 0.00 42.46 41.09 1gdh s ILE 72 CO -0.18 -0.10 0.30 -0.55 0.00 0.00 0.00 174.94 174.40 1gdh s SER 73 N 1.72 6.47 -0.18 3.58 0.15 -0.61 -1.79 113.70 123.05 1gdh s SER 73 Ca -0.02 0.55 -0.04 0.00 0.70 0.00 0.00 55.95 57.15 1gdh s SER 73 Cb -0.17 -2.18 -0.02 0.00 -1.71 0.00 0.00 66.02 61.93 1gdh s SER 73 CO -0.07 0.14 -0.03 0.28 1.20 0.00 0.00 173.24 174.76 1gdh s THR 74 N 0.23 3.83 -1.30 6.45 -1.32 -0.37 -1.22 115.64 121.94 1gdh s THR 74 Ca 0.17 -0.37 -0.15 0.00 -1.21 0.00 0.00 61.69 60.13 1gdh s THR 74 Cb -0.13 -2.70 0.10 0.00 -1.51 0.00 0.00 72.50 68.26 1gdh s THR 74 CO 0.05 0.47 1.75 0.00 -2.21 0.00 0.00 174.62 174.68 1gdh n TYR 75 N 3.88 4.38 -3.59 9.09 9.36 0.11 -3.01 117.16 137.38 1gdh n TYR 75 Ca -0.17 -3.00 -0.04 0.00 3.32 0.00 0.00 57.90 58.00 1gdh n TYR 75 Cb 0.52 -2.43 -0.02 0.00 -0.63 0.00 0.00 39.34 36.79 1gdh n TYR 75 CO 0.00 0.00 0.00 -1.12 0.22 0.00 0.00 176.86 175.96 1gdh s SER 76 N 3.30 -0.16 -0.06 2.98 0.01 -1.26 -4.32 113.70 114.19 1gdh s SER 76 Ca 0.48 -0.02 0.06 0.00 1.31 0.00 0.00 55.95 57.78 1gdh s SER 76 Cb 0.04 0.19 -0.24 0.00 0.21 0.00 0.00 66.02 66.22 1gdh s SER 76 CO 0.02 -0.31 0.61 0.40 0.41 0.00 0.00 173.24 174.37 1gdh h ILE 77 N 2.00 0.82 -1.15 1.44 5.03 -1.88 0.14 117.51 123.92 1gdh h ILE 77 Ca -0.13 -2.62 -0.46 0.00 -0.12 0.00 0.00 64.86 61.52 1gdh h ILE 77 Cb 1.18 2.48 0.01 0.00 -3.03 0.00 0.00 36.82 37.46 1gdh h ILE 77 CO 0.24 0.64 -0.21 -0.83 -0.68 0.00 0.00 178.15 177.31 1gdh s GLY 78 N -5.22 1.91 -0.27 5.37 0.00 -1.26 -4.71 107.32 103.13 1gdh s GLY 78 Ca -0.10 -1.85 0.21 0.00 0.00 0.00 0.00 44.72 42.98 1gdh s GLY 78 CO 0.81 -1.61 1.20 1.97 0.00 0.00 0.00 173.10 175.47 1gdh n PHE 79 N -1.96 0.54 0.56 1.90 1.16 -1.26 -4.86 117.46 113.54 1gdh n PHE 79 Ca 0.10 -2.03 0.09 0.00 -1.87 0.00 0.00 57.45 53.74 1gdh n PHE 79 Cb 0.61 0.15 0.38 0.00 -1.61 0.00 0.00 39.48 39.01 1gdh n PHE 79 CO 0.00 0.00 0.00 -0.25 -1.87 0.00 0.00 176.76 174.64 1gdh n ASP 80 N -0.79 0.11 -0.82 5.98 9.92 -1.26 -2.62 116.55 127.07 1gdh n ASP 80 Ca 0.02 0.52 0.10 0.00 -0.53 0.00 0.00 54.79 54.90 1gdh n ASP 80 Cb 0.82 -0.55 0.11 0.00 -0.64 0.00 0.00 41.12 40.86 1gdh n ASP 80 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1gdh n HIS 81 N -1.61 0.13 -4.79 1.24 1.44 -1.26 -4.92 115.22 105.44 1gdh n HIS 81 Ca 0.04 -0.08 -0.27 0.00 -2.01 0.00 0.00 57.72 55.40 1gdh n HIS 81 Cb 0.21 -0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.15 1gdh n HIS 81 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1gdh s ILE 82 N -1.50 1.42 -0.64 0.61 1.01 -1.08 0.20 121.20 121.22 1gdh s ILE 82 Ca 0.25 -0.66 -0.26 0.00 0.00 0.00 0.00 60.65 59.98 1gdh s ILE 82 Cb 0.17 -1.25 0.04 0.00 0.01 0.00 0.00 42.46 41.43 1gdh s ILE 82 CO 0.24 0.42 1.11 -0.62 0.00 0.00 0.00 174.94 176.09 1gdh s ASP 83 N 0.41 6.27 0.24 3.58 -1.08 -1.02 -4.89 116.67 120.18 1gdh s ASP 83 Ca -0.12 -0.42 0.12 0.00 -0.52 0.00 0.00 52.55 51.60 1gdh s ASP 83 Cb -0.15 -2.50 0.11 0.00 -1.46 0.00 0.00 42.92 38.92 1gdh s ASP 83 CO 0.04 -1.53 1.46 -0.07 0.52 0.00 0.00 175.17 175.59 1gdh h LEU 84 N 11.94 0.00 0.52 -1.34 -0.00 -1.92 -2.43 115.31 122.08 1gdh h LEU 84 Ca -0.27 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.59 1gdh h LEU 84 Cb 1.06 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.72 1gdh h LEU 84 CO 1.19 0.68 -0.29 0.44 -0.00 0.00 0.00 178.44 180.47 1gdh h ASP 85 N 0.00 -0.70 -0.74 -0.43 3.32 -1.98 -0.82 116.42 115.06 1gdh h ASP 85 Ca -0.01 0.03 0.15 0.00 0.02 0.00 0.00 57.03 57.22 1gdh h ASP 85 Cb 1.40 0.20 -0.14 0.00 0.22 0.00 0.00 39.33 41.00 1gdh h ASP 85 CO 0.09 -0.46 -0.20 0.00 -1.72 0.00 0.00 179.24 176.96 1gdh h ALA 86 N -1.55 0.47 -0.88 3.45 0.00 -1.98 0.76 119.26 119.53 1gdh h ALA 86 Ca -0.07 0.29 0.05 0.00 0.00 0.00 0.00 54.91 55.17 1gdh h ALA 86 Cb 0.58 0.58 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 1gdh h ALA 86 CO 0.09 -0.42 0.58 0.00 0.00 0.00 0.00 179.25 179.50 1gdh h LYS 88 N 1.06 0.33 -0.50 0.00 2.10 0.20 0.57 116.57 120.33 1gdh h LYS 88 Ca 0.36 -0.17 0.06 0.00 -2.00 0.00 0.00 60.65 58.90 1gdh h LYS 88 Cb 0.09 0.01 -0.05 0.00 -0.90 0.00 0.00 32.23 31.37 1gdh h LYS 88 CO -0.12 0.72 0.20 0.00 -2.00 0.00 0.00 179.45 178.25 1gdh h ALA 89 N 0.60 0.62 0.00 0.07 0.00 -0.97 -0.94 119.26 118.65 1gdh h ALA 89 Ca 0.02 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1gdh h ALA 89 Cb 0.65 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1gdh h ALA 89 CO 0.03 -0.18 0.00 -2.13 0.00 0.00 0.00 179.25 176.97 1gdh n ARG 90 N -4.97 0.22 -1.71 0.00 3.00 -0.93 -4.88 116.66 107.39 1gdh n ARG 90 Ca 0.05 0.11 -0.11 0.00 -0.00 0.00 0.00 57.85 57.90 1gdh n ARG 90 Cb 0.18 -1.50 -0.03 0.00 0.00 0.00 0.00 32.46 31.11 1gdh n ARG 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1gdh n GLY 91 N 0.42 0.66 3.61 5.14 0.00 -0.36 -4.99 105.19 109.68 1gdh n GLY 91 Ca 0.08 -0.47 -0.43 0.00 0.00 0.00 0.00 46.02 45.21 1gdh n GLY 91 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gdh s ILE 92 N -2.48 4.56 -0.07 -0.61 1.01 0.19 -4.91 121.20 118.89 1gdh s ILE 92 Ca 0.00 1.33 -0.28 0.00 0.00 0.00 0.00 60.65 61.70 1gdh s ILE 92 Cb 0.00 -4.35 -0.02 0.00 0.01 0.00 0.00 42.46 38.09 1gdh s ILE 92 CO 0.00 -0.52 0.92 -0.54 0.00 0.00 0.00 174.94 174.80 1gdh s LYS 93 N 3.53 4.45 0.03 2.79 1.02 -1.19 -4.08 119.74 126.29 1gdh s LYS 93 Ca 0.40 1.26 0.07 0.00 0.02 0.00 0.00 55.97 57.72 1gdh s LYS 93 Cb -0.12 -3.50 -0.03 0.00 -0.52 0.00 0.00 37.83 33.65 1gdh s LYS 93 CO 0.18 -0.17 -0.18 0.08 -0.92 0.00 0.00 175.35 174.34 1gdh s VAL 94 N 1.51 2.79 0.24 3.17 1.01 -1.19 -1.32 120.40 126.61 1gdh s VAL 94 Ca 0.46 -1.16 0.01 0.00 0.00 0.00 0.00 61.98 61.29 1gdh s VAL 94 Cb -0.19 -2.16 -0.05 0.00 0.00 0.00 0.00 36.38 33.98 1gdh s VAL 94 CO 0.20 0.36 0.10 -0.83 0.00 0.00 0.00 175.10 174.93 1gdh s GLY 95 N -1.38 1.66 0.11 4.51 0.00 -0.74 -0.72 107.32 110.77 1gdh s GLY 95 Ca 0.14 -1.83 0.02 0.00 0.00 0.00 0.00 44.72 43.06 1gdh s GLY 95 CO 0.05 -1.56 0.08 1.16 0.00 0.00 0.00 173.10 172.83 1gdh n ASN 96 N -0.42 -0.03 -3.62 1.64 6.94 -0.61 -1.24 115.26 117.92 1gdh n ASN 96 Ca -0.00 -1.71 -0.28 0.00 -0.02 0.00 0.00 54.58 52.57 1gdh n ASN 96 Cb 0.66 0.51 -0.12 0.00 -2.36 0.00 0.00 39.78 38.47 1gdh n ASN 96 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1gdh s ALA 97 N -2.43 2.12 -0.59 -2.53 0.00 0.49 -4.59 121.76 114.23 1gdh s ALA 97 Ca 0.12 -2.72 0.15 0.00 0.00 0.00 0.00 51.96 49.51 1gdh s ALA 97 Cb 0.01 -1.82 0.76 0.00 0.00 0.00 0.00 23.12 22.06 1gdh s ALA 97 CO 0.08 -2.05 1.66 -0.35 0.00 0.00 0.00 175.76 175.11 1gdh n PRO 98 N 3.07 4.37 -4.37 0.00 -0.04 -1.26 -3.27 135.00 133.50 1gdh n PRO 98 Ca 0.18 -2.93 -0.19 0.00 -0.04 0.00 0.00 63.50 60.52 1gdh n PRO 98 Cb 0.39 -2.12 -0.10 0.00 -0.04 0.00 0.00 33.50 31.63 1gdh n PRO 98 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1gdh s HIS 99 N -2.39 1.73 0.00 0.54 3.76 -1.26 -4.85 115.29 112.81 1gdh s HIS 99 Ca 0.51 -0.79 0.00 0.00 -0.15 0.00 0.00 55.06 54.63 1gdh s HIS 99 Cb 0.37 -0.98 0.00 0.00 1.11 0.00 0.00 32.58 33.08 1gdh s HIS 99 CO 0.18 0.14 0.00 0.41 -0.85 0.00 0.00 174.74 174.62 1gdh n GLY 100 N -0.48 0.77 0.23 -2.22 0.00 -1.26 -4.21 105.19 98.02 1gdh n GLY 100 Ca -0.06 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.98 1gdh n GLY 100 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1gdh n VAL 101 N -2.21 0.69 0.21 1.61 0.24 -1.26 -4.26 118.33 113.34 1gdh n VAL 101 Ca 0.00 -0.84 -0.10 0.00 -2.04 0.00 0.00 64.34 61.35 1gdh n VAL 101 Cb 0.00 0.68 -0.05 0.00 -1.47 0.00 0.00 33.84 33.00 1gdh n VAL 101 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1gdh h THR 102 N 0.82 0.13 -0.79 3.34 2.02 -1.96 -2.68 112.91 113.80 1gdh h THR 102 Ca 0.00 -0.60 -0.01 0.00 0.77 0.00 0.00 66.41 66.58 1gdh h THR 102 Cb 0.46 0.21 -0.04 0.00 -1.74 0.00 0.00 68.15 67.05 1gdh h THR 102 CO 0.00 0.03 0.46 0.58 0.37 0.00 0.00 175.52 176.96 1gdh h VAL 103 N -1.11 1.22 -0.05 3.16 2.07 -1.92 -1.12 116.25 118.51 1gdh h VAL 103 Ca -0.06 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 1gdh h VAL 103 Cb 0.50 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1gdh h VAL 103 CO 0.10 0.24 -0.01 0.00 0.02 0.00 0.00 177.57 177.92 1gdh h ALA 104 N 1.25 1.90 0.10 1.67 0.00 -1.84 0.18 119.26 122.53 1gdh h ALA 104 Ca 0.28 -0.04 -0.32 0.00 0.00 0.00 0.00 54.91 54.83 1gdh h ALA 104 Cb -0.02 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1gdh h ALA 104 CO -0.05 0.08 -1.67 1.15 0.00 0.00 0.00 179.25 178.76 1gdh h THR 105 N 0.07 0.98 -0.24 0.00 2.02 -1.06 -2.97 112.91 111.71 1gdh h THR 105 Ca 0.02 -2.67 0.02 0.00 0.77 0.00 0.00 66.41 64.55 1gdh h THR 105 Cb 0.06 2.65 -0.03 0.00 -1.74 0.00 0.00 68.15 69.10 1gdh h THR 105 CO 0.00 0.79 0.08 0.00 0.37 0.00 0.00 175.52 176.76 1gdh h ALA 106 N 0.46 0.26 -0.75 6.16 0.00 -0.17 0.02 119.26 125.25 1gdh h ALA 106 Ca -0.29 0.03 0.13 0.00 0.00 0.00 0.00 54.91 54.77 1gdh h ALA 106 Cb 2.02 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 19.74 1gdh h ALA 106 CO 0.13 -0.34 0.33 0.93 0.00 0.00 0.00 179.25 180.30 1gdh h GLU 107 N 0.19 0.48 -0.05 0.00 5.08 -0.71 0.62 114.58 120.18 1gdh h GLU 107 Ca 0.10 -0.03 -0.18 0.00 -1.00 0.00 0.00 59.36 58.25 1gdh h GLU 107 Cb 0.07 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1gdh h GLU 107 CO -0.11 0.32 -0.75 0.82 -1.00 0.00 0.00 179.01 178.29 1gdh h ILE 108 N 0.50 1.41 -0.63 3.13 1.08 -1.25 -0.24 117.51 121.50 1gdh h ILE 108 Ca 0.40 -2.25 -0.04 0.00 -0.39 0.00 0.00 64.86 62.59 1gdh h ILE 108 Cb 0.57 2.20 -0.03 0.00 -3.07 0.00 0.00 36.82 36.49 1gdh h ILE 108 CO -0.37 0.67 0.25 0.00 -0.69 0.00 0.00 178.15 178.00 1gdh h ALA 109 N 1.00 0.82 0.11 1.87 0.00 0.18 -1.31 119.26 121.93 1gdh h ALA 109 Ca -0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1gdh h ALA 109 Cb 1.32 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1gdh h ALA 109 CO 0.12 0.45 -0.05 1.98 0.00 0.00 0.00 179.25 181.75 1gdh h MET 110 N 0.89 -0.14 -0.83 0.00 1.85 -0.68 -1.61 114.93 114.41 1gdh h MET 110 Ca 0.21 0.01 0.20 0.00 -0.61 0.00 0.00 59.70 59.51 1gdh h MET 110 Cb 0.22 0.03 -0.12 0.00 0.43 0.00 0.00 31.60 32.16 1gdh h MET 110 CO -0.02 -0.01 0.26 1.25 -0.40 0.00 0.00 176.91 177.99 1gdh h LEU 111 N -0.24 0.10 -0.50 3.39 5.85 -1.03 0.84 115.31 123.72 1gdh h LEU 111 Ca -0.02 0.16 -0.17 0.00 0.84 0.00 0.00 57.88 58.70 1gdh h LEU 111 Cb 0.19 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 1gdh h LEU 111 CO 0.02 -0.06 -0.72 -0.07 -0.34 0.00 0.00 178.44 177.27 1gdh h LEU 112 N 0.29 0.24 -0.13 2.25 3.38 -0.51 0.12 115.31 120.96 1gdh h LEU 112 Ca 0.50 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 58.26 1gdh h LEU 112 Cb 0.93 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.60 1gdh h LEU 112 CO -0.56 0.88 -0.08 -0.07 0.09 0.00 0.00 178.44 178.70 1gdh h LEU 113 N 0.13 0.29 0.08 1.67 3.38 -0.35 -2.42 115.31 118.09 1gdh h LEU 113 Ca -0.02 -0.43 -0.00 0.00 0.09 0.00 0.00 57.88 57.51 1gdh h LEU 113 Cb 1.28 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1gdh h LEU 113 CO 0.11 0.66 -0.04 0.25 0.09 0.00 0.00 178.44 179.51 1gdh h LEU 114 N -0.08 -0.09 -2.61 1.67 5.85 -0.86 -0.93 115.31 118.26 1gdh h LEU 114 Ca 0.03 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 1gdh h LEU 114 Cb 0.56 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.61 1gdh h LEU 114 CO 0.02 0.11 -0.01 1.23 -0.34 0.00 0.00 178.44 179.44 1gdh h GLY 115 N -0.28 0.00 0.43 3.75 0.00 -0.85 0.11 103.07 106.23 1gdh h GLY 115 Ca -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.05 1gdh h GLY 115 CO 0.02 0.00 -1.41 1.76 0.00 0.00 0.00 176.54 176.90 1gdh h SER 116 N 0.00 0.29 -0.80 0.19 0.02 -1.04 -0.01 113.55 112.21 1gdh h SER 116 Ca -0.00 -0.81 0.05 0.00 -0.84 0.00 0.00 61.79 60.19 1gdh h SER 116 Cb 0.09 -0.10 -0.05 0.00 0.14 0.00 0.00 62.40 62.48 1gdh h SER 116 CO 0.00 1.61 0.52 0.00 -1.14 0.00 0.00 176.83 177.82 1gdh h ALA 117 N -0.12 1.57 -0.51 3.77 0.00 -0.78 -2.96 119.26 120.24 1gdh h ALA 117 Ca -0.32 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1gdh h ALA 117 Cb 1.68 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1gdh h ALA 117 CO 0.01 0.33 0.00 0.54 0.00 0.00 0.00 179.25 180.13 1gdh n ARG 118 N -4.47 2.57 -3.46 0.00 5.12 0.34 -2.15 116.66 114.60 1gdh n ARG 118 Ca 0.11 -2.37 -0.25 0.00 -1.93 0.00 0.00 57.85 53.41 1gdh n ARG 118 Cb 0.16 -1.49 0.04 0.00 -1.16 0.00 0.00 32.46 30.01 1gdh n ARG 118 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1gdh n ARG 119 N 1.38 -5.61 -0.26 5.56 1.74 -0.13 -4.83 116.66 114.51 1gdh n ARG 119 Ca 0.20 0.74 0.07 0.00 -0.77 0.00 0.00 57.85 58.08 1gdh n ARG 119 Cb 0.57 -5.64 0.31 0.00 -1.02 0.00 0.00 32.46 26.69 1gdh n ARG 119 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1gdh h ALA 120 N 0.99 1.65 -0.11 7.54 0.00 -1.56 -1.01 119.26 126.77 1gdh h ALA 120 Ca -0.54 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 1gdh h ALA 120 Cb 1.36 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 1gdh h ALA 120 CO 0.59 0.20 0.03 0.78 0.00 0.00 0.00 179.25 180.85 1gdh h GLY 121 N 0.86 0.18 1.99 0.00 0.00 -1.86 -1.24 103.07 103.01 1gdh h GLY 121 Ca 0.38 -0.11 -0.07 0.00 0.00 0.00 0.00 47.33 47.53 1gdh h GLY 121 CO -0.15 0.10 -0.35 0.83 0.00 0.00 0.00 176.54 176.97 1gdh h GLU 122 N -0.02 0.01 0.98 4.80 5.08 -1.61 -1.69 114.58 122.12 1gdh h GLU 122 Ca 0.03 -0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.34 1gdh h GLU 122 Cb 0.22 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.48 1gdh h GLU 122 CO -0.00 0.35 -0.47 0.78 -1.00 0.00 0.00 179.01 178.67 1gdh h GLY 123 N 1.04 -1.37 -0.20 -3.84 0.00 -1.02 -1.64 103.07 96.03 1gdh h GLY 123 Ca -0.00 0.51 0.16 0.00 0.00 0.00 0.00 47.33 48.00 1gdh h GLY 123 CO 0.05 -0.50 0.09 0.83 0.00 0.00 0.00 176.54 177.00 1gdh h GLU 124 N -1.33 0.17 -0.55 4.80 4.39 -0.95 -0.96 114.58 120.15 1gdh h GLU 124 Ca -0.13 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.55 1gdh h GLU 124 Cb 1.01 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.60 1gdh h GLU 124 CO 0.22 0.11 0.32 -0.22 -1.16 0.00 0.00 179.01 178.28 1gdh h LYS 125 N 0.17 0.76 -0.46 2.33 3.64 -1.25 -1.04 116.57 120.72 1gdh h LYS 125 Ca 0.41 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.71 1gdh h LYS 125 Cb 0.71 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.36 1gdh h LYS 125 CO -0.58 0.56 0.27 1.98 -2.27 0.00 0.00 179.45 179.41 1gdh h MET 126 N 0.74 0.62 0.06 1.90 4.05 -0.18 0.07 114.93 122.19 1gdh h MET 126 Ca 0.20 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.56 1gdh h MET 126 Cb 0.01 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 30.68 1gdh h MET 126 CO -0.03 0.44 -0.03 0.82 0.23 0.00 0.00 176.91 178.34 1gdh h ILE 127 N 0.63 0.78 -0.70 1.77 2.04 -1.19 -1.35 117.51 119.49 1gdh h ILE 127 Ca 0.17 -1.44 0.12 0.00 1.00 0.00 0.00 64.86 64.70 1gdh h ILE 127 Cb -0.02 1.44 -0.08 0.00 -0.74 0.00 0.00 36.82 37.42 1gdh h ILE 127 CO -0.03 0.25 0.29 0.03 0.00 0.00 0.00 178.15 178.69 1gdh h ARG 128 N -0.97 0.45 0.00 2.37 2.47 -1.12 0.60 114.38 118.18 1gdh h ARG 128 Ca -0.01 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.68 1gdh h ARG 128 Cb 0.47 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.69 1gdh h ARG 128 CO 0.01 0.30 0.00 -2.37 0.56 0.00 0.00 179.97 178.47 1gdh n THR 129 N -4.97 0.08 -3.06 2.04 5.66 0.00 -4.90 114.28 109.12 1gdh n THR 129 Ca 0.12 0.02 -0.22 0.00 -3.05 0.00 0.00 64.05 60.92 1gdh n THR 129 Cb 0.35 -0.63 0.03 0.00 -1.55 0.00 0.00 70.33 68.52 1gdh n THR 129 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1gdh n ARG 130 N -1.09 -4.45 -0.75 1.09 1.74 0.20 -4.90 116.66 108.50 1gdh n ARG 130 Ca 0.16 0.82 0.00 0.00 -0.77 0.00 0.00 57.85 58.07 1gdh n ARG 130 Cb 0.12 -5.64 0.27 0.00 -1.02 0.00 0.00 32.46 26.19 1gdh n ARG 130 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1gdh n SER 131 N -2.45 4.02 -4.56 0.55 7.64 -0.52 -4.95 113.62 113.35 1gdh n SER 131 Ca -0.10 -3.25 -0.42 0.00 1.01 0.00 0.00 58.87 56.12 1gdh n SER 131 Cb 0.61 -0.65 -0.07 0.00 -1.01 0.00 0.00 64.21 63.09 1gdh n SER 131 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 1gdh s TRP 132 N -2.98 3.16 -2.11 1.43 -0.00 -1.21 -4.94 118.94 112.30 1gdh s TRP 132 Ca 0.48 0.28 0.15 0.00 -0.00 0.00 0.00 56.10 57.00 1gdh s TRP 132 Cb 0.40 -3.07 0.50 0.00 -0.00 0.00 0.00 33.47 31.29 1gdh s TRP 132 CO 0.09 -0.61 1.38 -0.35 -0.00 0.00 0.00 176.95 177.46 1gdh n PRO 133 N 5.95 1.73 0.00 5.86 -0.04 -1.26 -5.01 135.00 142.22 1gdh n PRO 133 Ca -0.02 -1.11 0.00 0.00 -0.04 0.00 0.00 63.50 62.32 1gdh n PRO 133 Cb 0.49 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.63 1gdh n PRO 133 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1gdh n GLY 134 N 1.06 1.08 3.72 0.55 0.00 -1.26 -5.01 105.19 105.33 1gdh n GLY 134 Ca 0.13 -1.92 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 1gdh n GLY 134 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1gdh s TRP 135 N -2.23 3.08 0.14 1.61 -0.00 -1.26 -5.03 118.94 115.25 1gdh s TRP 135 Ca 0.00 0.67 0.04 0.00 -0.00 0.00 0.00 56.10 56.81 1gdh s TRP 135 Cb 0.00 -3.90 -0.04 0.00 -0.00 0.00 0.00 33.47 29.52 1gdh s TRP 135 CO 0.00 -3.31 -0.10 -1.21 -0.00 0.00 0.00 176.95 172.33 1gdh s GLU 136 N 1.10 1.03 0.54 5.86 2.02 -1.26 -5.05 118.70 122.94 1gdh s GLU 136 Ca 0.69 -1.41 0.32 0.00 0.02 0.00 0.00 54.97 54.59 1gdh s GLU 136 Cb -0.43 -0.61 1.48 0.00 0.10 0.00 0.00 34.13 34.67 1gdh s GLU 136 CO 0.31 0.08 2.04 -1.00 0.02 0.00 0.00 175.26 176.71 1gdh h PRO 137 N 2.90 0.00 -0.32 0.39 0.13 -2.06 -2.94 132.00 130.09 1gdh h PRO 137 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1gdh h PRO 137 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1gdh h PRO 137 CO 0.62 0.08 0.00 1.28 -0.23 0.00 0.00 178.00 179.74 1gdh n LEU 138 N -3.30 4.21 -4.60 1.56 4.77 -1.26 -4.95 117.00 113.43 1gdh n LEU 138 Ca -0.01 -2.98 -0.39 0.00 -0.03 0.00 0.00 56.01 52.60 1gdh n LEU 138 Cb 0.27 -0.56 -0.09 0.00 -2.33 0.00 0.00 43.42 40.71 1gdh n LEU 138 CO 0.28 0.67 0.08 -0.70 -1.33 0.00 0.00 177.39 176.39 1gdh s GLU 139 N -2.77 3.96 -1.39 3.23 2.12 -1.11 -4.31 118.70 118.43 1gdh s GLU 139 Ca 0.44 0.01 -0.04 0.00 0.36 0.00 0.00 54.97 55.74 1gdh s GLU 139 Cb 0.35 -3.67 0.00 0.00 0.26 0.00 0.00 34.13 31.07 1gdh s GLU 139 CO 0.10 -0.32 0.41 1.28 -0.54 0.00 0.00 175.26 176.20 1gdh n LEU 140 N 5.37 -2.03 -4.65 2.70 4.77 -1.26 -4.92 117.00 116.98 1gdh n LEU 140 Ca -0.08 -1.06 -0.42 0.00 -0.03 0.00 0.00 56.01 54.42 1gdh n LEU 140 Cb 0.50 -2.13 -0.04 0.00 -2.33 0.00 0.00 43.42 39.42 1gdh n LEU 140 CO 0.38 0.46 0.61 -0.69 -1.33 0.00 0.00 177.39 176.82 1gdh s VAL 141 N -3.94 4.86 0.00 4.08 1.01 -1.26 -4.88 120.40 120.26 1gdh s VAL 141 Ca 0.08 1.54 0.00 0.00 0.00 0.00 0.00 61.98 63.60 1gdh s VAL 141 Cb -0.03 -4.10 0.00 0.00 0.00 0.00 0.00 36.38 32.25 1gdh s VAL 141 CO 0.90 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 176.58 1gdh n GLY 142 N 3.71 0.70 3.48 4.51 0.00 -1.26 -5.04 105.19 111.28 1gdh n GLY 142 Ca 0.05 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 1gdh n GLY 142 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1gdh s GLU 143 N 3.45 1.12 0.49 1.61 -1.05 -0.92 -5.03 118.70 118.38 1gdh s GLU 143 Ca 0.00 -0.13 -0.07 0.00 -0.15 0.00 0.00 54.97 54.62 1gdh s GLU 143 Cb 0.00 0.52 -0.04 0.00 -0.44 0.00 0.00 34.13 34.17 1gdh s GLU 143 CO 0.00 -0.43 0.82 0.15 0.95 0.00 0.00 175.26 176.75 1gdh s LYS 144 N -2.52 3.59 0.08 -4.83 1.02 -1.26 -4.40 119.74 111.43 1gdh s LYS 144 Ca -0.04 0.33 0.16 0.00 0.02 0.00 0.00 55.97 56.44 1gdh s LYS 144 Cb -0.01 -2.33 -0.12 0.00 -0.52 0.00 0.00 37.83 34.85 1gdh s LYS 144 CO -0.03 -0.23 0.90 -0.07 -0.92 0.00 0.00 175.35 175.00 1gdh h LEU 145 N 0.33 0.00 -9.87 3.17 3.38 -1.99 -3.45 115.31 106.87 1gdh h LEU 145 Ca -0.47 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 56.98 1gdh h LEU 145 Cb 1.20 0.00 0.07 0.00 0.09 0.00 0.00 40.66 42.01 1gdh h LEU 145 CO 0.62 0.62 0.65 1.51 0.09 0.00 0.00 178.44 181.92 1gdh s ASP 146 N -5.91 6.76 -1.04 -0.43 -4.77 -1.17 -1.88 116.67 108.23 1gdh s ASP 146 Ca -0.02 2.69 -0.08 0.00 -3.30 0.00 0.00 52.55 51.84 1gdh s ASP 146 Cb 0.09 -2.65 0.07 0.00 -1.09 0.00 0.00 42.92 39.34 1gdh s ASP 146 CO 0.80 -0.55 0.33 0.59 0.70 0.00 0.00 175.17 177.04 1gdh n ASN 147 N 0.87 -2.84 -4.87 2.11 3.02 0.20 -4.91 115.26 108.83 1gdh n ASN 147 Ca 0.00 -0.23 -0.26 0.00 -0.03 0.00 0.00 54.58 54.07 1gdh n ASN 147 Cb 0.42 -2.41 -0.04 0.00 -0.61 0.00 0.00 39.78 37.13 1gdh n ASN 147 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1gdh s LYS 148 N -5.82 3.17 -0.16 3.52 -0.14 -0.79 -4.86 119.74 114.67 1gdh s LYS 148 Ca 0.32 -0.75 -0.19 0.00 -1.36 0.00 0.00 55.97 53.99 1gdh s LYS 148 Cb -0.17 -2.80 -0.04 0.00 -1.68 0.00 0.00 37.83 33.14 1gdh s LYS 148 CO 0.39 0.49 0.51 0.99 -0.76 0.00 0.00 175.35 176.97 1gdh s THR 149 N -1.78 5.14 -0.32 2.17 2.01 -1.26 0.09 115.64 121.69 1gdh s THR 149 Ca 0.33 0.98 -0.10 0.00 0.31 0.00 0.00 61.69 63.21 1gdh s THR 149 Cb -0.10 -3.84 -0.01 0.00 0.01 0.00 0.00 72.50 68.56 1gdh s THR 149 CO 0.26 0.25 0.16 -0.22 -0.69 0.00 0.00 174.62 174.38 1gdh s LEU 150 N 1.13 4.16 -0.35 4.42 2.96 0.30 -1.46 118.68 129.84 1gdh s LEU 150 Ca 0.26 -0.55 -0.21 0.00 -0.22 0.00 0.00 54.13 53.41 1gdh s LEU 150 Cb -0.15 -2.01 0.00 0.00 0.50 0.00 0.00 46.19 44.53 1gdh s LEU 150 CO 0.10 -0.21 0.66 -0.83 -1.32 0.00 0.00 176.35 174.76 1gdh s GLY 151 N 1.61 1.73 -0.33 7.98 0.00 0.12 -1.14 107.32 117.29 1gdh s GLY 151 Ca 0.04 -0.79 -0.12 0.00 0.00 0.00 0.00 44.72 43.85 1gdh s GLY 151 CO 0.06 1.54 0.23 -0.42 0.00 0.00 0.00 173.10 174.51 1gdh s ILE 152 N 2.77 5.27 -0.50 0.90 1.01 -0.71 -0.74 121.20 129.19 1gdh s ILE 152 Ca 0.26 -0.16 -0.20 0.00 0.00 0.00 0.00 60.65 60.54 1gdh s ILE 152 Cb -0.14 -3.67 0.05 0.00 0.01 0.00 0.00 42.46 38.70 1gdh s ILE 152 CO 0.15 0.03 0.69 -0.47 0.00 0.00 0.00 174.94 175.34 1gdh s TYR 153 N 1.72 3.00 0.00 3.97 5.04 -0.33 -2.00 117.35 128.75 1gdh s TYR 153 Ca 0.06 -0.35 0.00 0.00 -2.44 0.00 0.00 57.07 54.34 1gdh s TYR 153 Cb -0.17 -3.60 0.00 0.00 0.35 0.00 0.00 41.96 38.53 1gdh s TYR 153 CO 0.10 -1.07 0.00 0.41 -1.34 0.00 0.00 175.55 173.66 1gdh n GLY 154 N 5.14 0.47 2.86 8.97 0.00 0.46 -1.22 105.19 121.86 1gdh n GLY 154 Ca -0.04 -0.80 -0.30 0.00 0.00 0.00 0.00 46.02 44.88 1gdh n GLY 154 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1gdh n PHE 155 N 0.76 3.76 -1.38 1.61 7.35 -1.26 -4.03 117.46 124.27 1gdh n PHE 155 Ca 0.00 -3.64 0.00 0.00 -0.76 0.00 0.00 57.45 53.05 1gdh n PHE 155 Cb 0.00 -0.62 0.00 0.00 0.35 0.00 0.00 39.48 39.21 1gdh n PHE 155 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1gdh n GLY 156 N -0.23 1.81 0.28 7.13 0.00 -1.26 -4.60 105.19 108.31 1gdh n GLY 156 Ca 0.35 -1.94 0.02 0.00 0.00 0.00 0.00 46.02 44.45 1gdh n GLY 156 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1gdh h SER 157 N 0.00 -0.60 0.10 1.61 0.02 -1.98 0.17 113.55 112.87 1gdh h SER 157 Ca 0.00 0.22 -0.23 0.00 -0.84 0.00 0.00 61.79 60.93 1gdh h SER 157 Cb 0.00 0.43 0.01 0.00 0.14 0.00 0.00 62.40 62.98 1gdh h SER 157 CO 0.00 -0.23 -0.90 0.40 -1.14 0.00 0.00 176.83 174.96 1gdh h ILE 158 N 0.02 1.33 -0.30 3.27 2.04 -1.92 -2.60 117.51 119.36 1gdh h ILE 158 Ca 0.37 -2.21 -0.12 0.00 1.00 0.00 0.00 64.86 63.89 1gdh h ILE 158 Cb 0.59 2.24 -0.01 0.00 -0.74 0.00 0.00 36.82 38.90 1gdh h ILE 158 CO -0.74 0.68 -0.32 1.23 0.00 0.00 0.00 178.15 179.00 1gdh h GLY 159 N 0.82 0.70 1.48 5.37 0.00 -1.61 -0.88 103.07 108.95 1gdh h GLY 159 Ca -0.08 -0.64 -0.10 0.00 0.00 0.00 0.00 47.33 46.50 1gdh h GLY 159 CO 0.17 0.58 -0.23 1.46 0.00 0.00 0.00 176.54 178.53 1gdh h GLN 160 N 0.55 0.60 0.00 4.80 4.20 -1.05 -1.84 115.11 122.37 1gdh h GLN 160 Ca 0.06 -0.23 -0.14 0.00 0.06 0.00 0.00 58.65 58.40 1gdh h GLN 160 Cb 0.82 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.54 1gdh h GLN 160 CO 0.07 0.78 -0.66 0.00 -0.67 0.00 0.00 178.83 178.35 1gdh h ALA 161 N 1.22 0.70 -0.32 3.87 0.00 -1.19 -2.86 119.26 120.68 1gdh h ALA 161 Ca 0.08 -0.60 -0.03 0.00 0.00 0.00 0.00 54.91 54.35 1gdh h ALA 161 Cb 0.68 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1gdh h ALA 161 CO 0.05 0.83 0.08 1.25 0.00 0.00 0.00 179.25 181.46 1gdh h LEU 162 N 0.00 0.49 -0.85 0.00 5.85 -0.98 -3.00 115.31 116.82 1gdh h LEU 162 Ca -0.01 -0.23 0.05 0.00 0.84 0.00 0.00 57.88 58.53 1gdh h LEU 162 Cb 1.35 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 42.19 1gdh h LEU 162 CO 0.09 0.59 0.53 0.00 -0.34 0.00 0.00 178.44 179.31 1gdh h ALA 163 N 0.91 1.14 -0.26 1.25 0.00 -1.36 0.17 119.26 121.12 1gdh h ALA 163 Ca 0.10 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.05 1gdh h ALA 163 Cb 0.29 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 1gdh h ALA 163 CO 0.00 0.31 -0.10 -0.22 0.00 0.00 0.00 179.25 179.24 1gdh h LYS 164 N 0.99 -0.05 0.00 0.00 3.64 -1.54 0.15 116.57 119.76 1gdh h LYS 164 Ca 0.36 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.68 1gdh h LYS 164 Cb 0.11 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 1gdh h LYS 164 CO -0.15 -0.03 -0.28 0.00 -2.27 0.00 0.00 179.45 176.71 1gdh h ARG 165 N -0.05 0.00 0.07 1.90 3.08 -1.28 -3.23 114.38 114.87 1gdh h ARG 165 Ca 0.13 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.92 1gdh h ARG 165 Cb 0.25 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 1gdh h ARG 165 CO -0.30 0.28 -1.26 0.00 -1.07 0.00 0.00 179.97 177.63 1gdh h ALA 166 N 1.72 0.27 0.00 0.04 0.00 -0.37 -3.17 119.26 117.74 1gdh h ALA 166 Ca -0.00 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 53.92 1gdh h ALA 166 Cb 0.94 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1gdh h ALA 166 CO 0.04 1.14 0.00 1.96 0.00 0.00 0.00 179.25 182.39 1gdh h GLN 167 N 0.04 0.00 0.00 0.00 1.08 -0.99 -2.51 115.11 112.73 1gdh h GLN 167 Ca -0.13 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.04 1gdh h GLN 167 Cb 1.92 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 29.34 1gdh h GLN 167 CO 0.16 0.00 -0.15 0.78 -0.95 0.00 0.00 178.83 178.67 1gdh h GLY 168 N 2.01 0.00 -2.23 3.46 0.00 -1.58 -1.10 103.07 103.63 1gdh h GLY 168 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1gdh h GLY 168 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.23 1gdh n PHE 169 N -3.35 1.00 -3.18 5.60 3.01 -0.98 -4.94 117.46 114.62 1gdh n PHE 169 Ca -0.00 -0.40 -0.22 0.00 1.01 0.00 0.00 57.45 57.84 1gdh n PHE 169 Cb 0.36 -0.18 0.01 0.00 -0.01 0.00 0.00 39.48 39.66 1gdh n PHE 169 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1gdh n ASP 170 N 0.70 -4.58 -4.85 4.37 8.00 -0.42 -3.03 116.55 116.75 1gdh n ASP 170 Ca 0.17 -0.31 -0.32 0.00 0.71 0.00 0.00 54.79 55.05 1gdh n ASP 170 Cb 0.63 -3.75 -0.00 0.00 -0.02 0.00 0.00 41.12 37.98 1gdh n ASP 170 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1gdh s MET 171 N -5.83 3.61 -0.25 -1.24 -1.94 -1.02 0.60 119.30 113.22 1gdh s MET 171 Ca 0.34 0.90 -0.12 0.00 -1.71 0.00 0.00 55.69 55.10 1gdh s MET 171 Cb -0.17 -2.08 -0.05 0.00 2.01 0.00 0.00 34.83 34.54 1gdh s MET 171 CO 0.41 -0.56 0.22 -0.51 -0.01 0.00 0.00 175.02 174.58 1gdh s ASP 172 N -3.58 6.13 -0.32 3.03 1.01 0.11 -4.63 116.67 118.42 1gdh s ASP 172 Ca 0.58 0.13 -0.12 0.00 0.71 0.00 0.00 52.55 53.85 1gdh s ASP 172 Cb -0.12 -2.14 -0.02 0.00 1.01 0.00 0.00 42.92 41.66 1gdh s ASP 172 CO 0.44 -0.02 0.21 -0.63 0.21 0.00 0.00 175.17 175.38 1gdh s ILE 173 N 1.45 5.08 0.12 0.77 1.01 -1.26 -0.54 121.20 127.83 1gdh s ILE 173 Ca 0.09 -0.22 0.09 0.00 0.00 0.00 0.00 60.65 60.61 1gdh s ILE 173 Cb -0.15 -3.57 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 1gdh s ILE 173 CO 0.08 0.05 -0.18 -1.81 0.00 0.00 0.00 174.94 173.08 1gdh s ASP 174 N 1.70 3.89 0.08 3.58 1.11 -0.30 -0.46 116.67 126.27 1gdh s ASP 174 Ca 0.06 -0.56 -0.06 0.00 0.18 0.00 0.00 52.55 52.17 1gdh s ASP 174 Cb -0.17 -0.55 -0.02 0.00 1.07 0.00 0.00 42.92 43.25 1gdh s ASP 174 CO 0.09 0.18 0.10 -0.72 1.18 0.00 0.00 175.17 176.00 1gdh s TYR 175 N -1.16 0.31 -0.05 4.23 1.13 0.58 -1.73 117.35 120.66 1gdh s TYR 175 Ca 0.18 -0.79 0.02 0.00 -1.41 0.00 0.00 57.07 55.07 1gdh s TYR 175 Cb -0.10 -0.19 0.02 0.00 -1.10 0.00 0.00 41.96 40.58 1gdh s TYR 175 CO 0.10 -0.48 -0.08 0.12 -2.51 0.00 0.00 175.55 172.70 1gdh s PHE 176 N -3.89 1.01 0.00 -3.49 5.36 -0.85 -0.01 117.98 116.11 1gdh s PHE 176 Ca 0.06 -0.32 -0.11 0.00 -0.96 0.00 0.00 56.93 55.60 1gdh s PHE 176 Cb 0.06 -0.79 0.01 0.00 -0.34 0.00 0.00 43.02 41.96 1gdh s PHE 176 CO -0.10 -0.20 0.23 0.34 -1.46 0.00 0.00 175.22 174.04 1gdh s ASP 177 N 0.67 -0.08 0.15 6.13 -1.08 -1.26 -0.41 116.67 120.79 1gdh s ASP 177 Ca -0.11 -0.08 0.21 0.00 -0.52 0.00 0.00 52.55 52.05 1gdh s ASP 177 Cb -0.14 0.27 0.86 0.00 -1.46 0.00 0.00 42.92 42.45 1gdh s ASP 177 CO 0.01 -0.44 1.64 0.35 0.52 0.00 0.00 175.17 177.25 1gdh n THR 178 N 1.24 0.84 -3.78 1.71 -2.24 -1.26 -4.25 114.28 106.54 1gdh n THR 178 Ca -0.22 0.19 -0.37 0.00 -2.27 0.00 0.00 64.05 61.39 1gdh n THR 178 Cb 0.56 -1.04 -0.13 0.00 -2.10 0.00 0.00 70.33 67.62 1gdh n THR 178 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1gdh s HIS 179 N -3.18 3.26 -0.05 4.78 3.76 -1.26 -5.08 115.29 117.53 1gdh s HIS 179 Ca 0.06 -1.54 -0.29 0.00 -0.15 0.00 0.00 55.06 53.13 1gdh s HIS 179 Cb 0.10 -2.27 -0.02 0.00 1.11 0.00 0.00 32.58 31.50 1gdh s HIS 179 CO 0.37 -0.75 0.98 0.50 -0.85 0.00 0.00 174.74 174.98 1gdh s ARG 180 N 1.37 4.49 0.88 1.40 6.06 -1.26 -4.88 118.95 127.01 1gdh s ARG 180 Ca -0.02 1.38 -0.12 0.00 -2.50 0.00 0.00 55.73 54.47 1gdh s ARG 180 Cb -0.20 -3.50 0.12 0.00 0.06 0.00 0.00 34.95 31.44 1gdh s ARG 180 CO 0.02 -0.17 1.10 0.00 -2.50 0.00 0.00 175.30 173.75 1gdh s ALA 181 N 1.46 1.68 0.54 6.12 0.00 -1.26 -4.99 121.76 125.31 1gdh s ALA 181 Ca 0.50 -0.16 -0.22 0.00 0.00 0.00 0.00 51.96 52.08 1gdh s ALA 181 Cb -0.20 -3.15 -0.05 0.00 0.00 0.00 0.00 23.12 19.72 1gdh s ALA 181 CO 0.23 -2.24 1.29 0.43 0.00 0.00 0.00 175.76 175.47 1gdh n SER 182 N -3.79 2.39 -0.37 0.00 7.64 -1.26 -4.74 113.62 113.48 1gdh n SER 182 Ca 0.07 0.96 0.02 0.00 1.01 0.00 0.00 58.87 60.93 1gdh n SER 182 Cb 0.56 -1.54 0.16 0.00 -1.01 0.00 0.00 64.21 62.38 1gdh n SER 182 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1gdh h SER 183 N 1.34 1.07 -0.06 6.43 0.02 -1.99 0.22 113.55 120.57 1gdh h SER 183 Ca -0.50 -0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.47 1gdh h SER 183 Cb 1.31 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 63.62 1gdh h SER 183 CO 0.56 0.70 0.27 0.28 -1.14 0.00 0.00 176.83 177.51 1gdh h SER 184 N 1.22 0.00 0.00 3.07 0.02 -2.00 -1.55 113.55 114.31 1gdh h SER 184 Ca 0.42 0.00 -0.43 0.00 -0.84 0.00 0.00 61.79 60.94 1gdh h SER 184 Cb 0.09 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.56 1gdh h SER 184 CO -0.15 0.00 -2.47 -0.67 -1.14 0.00 0.00 176.83 172.40 1gdh n ASP 185 N -3.11 1.92 -0.18 3.07 -0.08 0.59 -2.62 116.55 116.13 1gdh n ASP 185 Ca -0.01 0.22 0.07 0.00 -1.51 0.00 0.00 54.79 53.57 1gdh n ASP 185 Cb 0.34 -0.70 0.37 0.00 2.34 0.00 0.00 41.12 43.47 1gdh n ASP 185 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1gdh h GLU 186 N -0.74 0.70 -0.24 -0.67 5.08 -0.61 -2.56 114.58 115.53 1gdh h GLU 186 Ca -0.65 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 57.65 1gdh h GLU 186 Cb 1.65 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.73 1gdh h GLU 186 CO -0.34 0.46 0.09 0.00 -1.00 0.00 0.00 179.01 178.22 1gdh h ALA 187 N 1.62 0.32 -1.45 3.43 0.00 -1.39 0.30 119.26 122.08 1gdh h ALA 187 Ca 0.32 -0.13 0.47 0.00 0.00 0.00 0.00 54.91 55.57 1gdh h ALA 187 Cb 0.31 -0.10 -0.12 0.00 0.00 0.00 0.00 17.79 17.88 1gdh h ALA 187 CO -0.11 -0.07 0.96 1.03 0.00 0.00 0.00 179.25 181.06 1gdh h SER 188 N 0.24 0.18 -0.00 0.00 0.87 -1.21 -1.00 113.55 112.63 1gdh h SER 188 Ca 0.08 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 1gdh h SER 188 Cb 0.20 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 1gdh h SER 188 CO -0.00 -0.17 0.00 -1.22 -0.53 0.00 0.00 176.83 174.90 1gdh n TYR 189 N -4.57 0.00 -3.51 2.24 4.01 -0.73 -4.96 117.16 109.64 1gdh n TYR 189 Ca 0.39 -0.06 -0.26 0.00 -0.16 0.00 0.00 57.90 57.82 1gdh n TYR 189 Cb 1.57 -0.01 0.01 0.00 -0.31 0.00 0.00 39.34 40.60 1gdh n TYR 189 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1gdh n GLN 190 N -0.05 -4.00 -2.51 -0.72 3.00 0.77 -4.72 117.38 109.15 1gdh n GLN 190 Ca 0.00 0.54 -0.42 0.00 -0.01 0.00 0.00 57.00 57.11 1gdh n GLN 190 Cb 0.03 -5.31 -0.03 0.00 0.00 0.00 0.00 30.24 24.93 1gdh n GLN 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1gdh s ALA 191 N -3.07 3.32 -0.28 -1.58 0.00 0.34 -4.60 121.76 115.89 1gdh s ALA 191 Ca 0.47 0.75 -0.23 0.00 0.00 0.00 0.00 51.96 52.96 1gdh s ALA 191 Cb -0.24 -3.41 -0.00 0.00 0.00 0.00 0.00 23.12 19.46 1gdh s ALA 191 CO 0.58 -0.36 0.78 0.99 0.00 0.00 0.00 175.76 177.75 1gdh s THR 192 N 0.99 4.83 0.24 0.00 2.01 0.39 -4.79 115.64 119.31 1gdh s THR 192 Ca 0.56 1.28 -0.30 0.00 0.31 0.00 0.00 61.69 63.55 1gdh s THR 192 Cb -0.27 -4.11 -0.09 0.00 0.01 0.00 0.00 72.50 68.04 1gdh s THR 192 CO 0.29 -0.17 1.09 0.12 -0.69 0.00 0.00 174.62 175.26 1gdh s PHE 193 N 2.87 3.61 -0.09 4.92 5.36 -1.26 -0.31 117.98 133.09 1gdh s PHE 193 Ca 0.32 1.68 0.03 0.00 -0.96 0.00 0.00 56.93 58.00 1gdh s PHE 193 Cb -0.15 -3.26 -0.01 0.00 -0.34 0.00 0.00 43.02 39.26 1gdh s PHE 193 CO 0.11 -0.50 -0.19 -1.01 -1.46 0.00 0.00 175.22 172.16 1gdh s HIS 194 N -0.84 2.62 -0.74 10.12 3.76 0.98 -4.86 115.29 126.33 1gdh s HIS 194 Ca 0.46 -0.66 0.04 0.00 -0.15 0.00 0.00 55.06 54.75 1gdh s HIS 194 Cb -0.31 -1.70 0.25 0.00 1.11 0.00 0.00 32.58 31.94 1gdh s HIS 194 CO 0.38 -0.18 0.90 -0.40 -0.85 0.00 0.00 174.74 174.60 1gdh n ASP 195 N 3.11 2.50 -3.55 1.40 5.68 -1.26 -4.47 116.55 119.96 1gdh n ASP 195 Ca -0.18 -2.30 -0.16 0.00 -0.50 0.00 0.00 54.79 51.65 1gdh n ASP 195 Cb 0.52 -0.56 -0.06 0.00 -1.14 0.00 0.00 41.12 39.88 1gdh n ASP 195 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1gdh s SER 196 N -0.21 -0.63 0.15 -1.12 0.15 -1.26 -5.04 113.70 105.74 1gdh s SER 196 Ca 0.17 0.82 -0.08 0.00 0.70 0.00 0.00 55.95 57.55 1gdh s SER 196 Cb 0.13 0.69 -0.03 0.00 -1.71 0.00 0.00 66.02 65.10 1gdh s SER 196 CO 0.05 -0.49 1.42 0.25 1.20 0.00 0.00 173.24 175.66 1gdh h LEU 197 N 3.35 0.81 -1.14 3.45 5.85 -1.98 -2.89 115.31 122.76 1gdh h LEU 197 Ca -0.26 -0.47 -0.03 0.00 0.84 0.00 0.00 57.88 57.97 1gdh h LEU 197 Cb 1.15 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.91 1gdh h LEU 197 CO 0.31 1.23 0.28 0.44 -0.34 0.00 0.00 178.44 180.36 1gdh h ASP 198 N 0.53 0.80 -0.16 1.25 3.32 -1.99 0.12 116.42 120.29 1gdh h ASP 198 Ca -0.01 -0.09 -0.04 0.00 0.02 0.00 0.00 57.03 56.91 1gdh h ASP 198 Cb 1.21 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.54 1gdh h ASP 198 CO 0.13 0.69 -0.02 -1.28 -1.72 0.00 0.00 179.24 177.04 1gdh h SER 199 N 0.88 0.39 0.23 6.45 0.87 -1.95 -3.16 113.55 117.26 1gdh h SER 199 Ca 0.21 -0.07 -0.31 0.00 -1.23 0.00 0.00 61.79 60.39 1gdh h SER 199 Cb 0.12 -0.10 0.03 0.00 -0.44 0.00 0.00 62.40 62.01 1gdh h SER 199 CO -0.03 0.48 -1.39 0.25 -0.53 0.00 0.00 176.83 175.61 1gdh h LEU 200 N 0.41 0.77 -1.62 2.23 5.85 -0.64 -3.31 115.31 119.00 1gdh h LEU 200 Ca 0.09 -0.93 0.05 0.00 0.84 0.00 0.00 57.88 57.93 1gdh h LEU 200 Cb 0.31 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 1gdh h LEU 200 CO 0.01 1.67 0.33 -0.07 -0.34 0.00 0.00 178.44 180.04 1gdh h LEU 201 N 0.05 0.42 -0.54 2.25 3.38 -1.06 -2.18 115.31 117.64 1gdh h LEU 201 Ca -0.25 -0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.80 1gdh h LEU 201 Cb 2.08 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 42.67 1gdh h LEU 201 CO 0.25 0.28 0.18 -1.28 0.09 0.00 0.00 178.44 177.96 1gdh h SER 202 N 0.48 0.17 -0.20 -0.43 0.87 -1.51 -2.58 113.55 110.35 1gdh h SER 202 Ca 0.21 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.84 1gdh h SER 202 Cb 0.24 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.26 1gdh h SER 202 CO -0.06 0.12 0.00 1.33 -0.53 0.00 0.00 176.83 177.69 1gdh n VAL 203 N -5.02 0.25 -3.10 2.23 0.24 -0.84 -4.09 118.33 108.01 1gdh n VAL 203 Ca 0.06 -0.51 -0.45 0.00 -2.04 0.00 0.00 64.34 61.40 1gdh n VAL 203 Cb 0.23 0.82 -0.03 0.00 -1.47 0.00 0.00 33.84 33.40 1gdh n VAL 203 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1gdh s SER 204 N -1.68 6.63 0.16 -1.34 0.01 -0.97 -4.70 113.70 111.81 1gdh s SER 204 Ca 0.35 -2.21 -0.07 0.00 1.31 0.00 0.00 55.95 55.32 1gdh s SER 204 Cb 0.20 -2.32 0.00 0.00 0.21 0.00 0.00 66.02 64.12 1gdh s SER 204 CO 0.30 -0.89 1.44 1.56 0.41 0.00 0.00 173.24 176.06 1gdh h GLN 205 N 8.48 0.68 -5.33 12.44 4.20 -1.86 -3.38 115.11 130.34 1gdh h GLN 205 Ca 0.09 -0.46 -0.65 0.00 0.06 0.00 0.00 58.65 57.69 1gdh h GLN 205 Cb 1.04 0.07 -0.24 0.00 0.30 0.00 0.00 27.48 28.64 1gdh h GLN 205 CO 0.97 1.08 -0.72 -0.06 -0.67 0.00 0.00 178.83 179.43 1gdh s PHE 206 N -3.96 2.91 -0.13 2.96 0.40 -0.54 -0.80 117.98 118.81 1gdh s PHE 206 Ca -0.09 -0.48 0.01 0.00 -0.60 0.00 0.00 56.93 55.77 1gdh s PHE 206 Cb 0.10 -1.89 0.02 0.00 0.51 0.00 0.00 43.02 41.76 1gdh s PHE 206 CO 0.87 -0.12 -0.13 0.12 0.70 0.00 0.00 175.22 176.65 1gdh s PHE 207 N 0.33 1.99 -0.23 0.36 5.36 0.94 0.14 117.98 126.86 1gdh s PHE 207 Ca -0.08 -1.04 -0.02 0.00 -0.96 0.00 0.00 56.93 54.83 1gdh s PHE 207 Cb -0.15 -1.48 0.02 0.00 -0.34 0.00 0.00 43.02 41.07 1gdh s PHE 207 CO 0.04 -0.58 -0.08 0.45 -1.46 0.00 0.00 175.22 173.60 1gdh s SER 208 N 1.36 4.12 -0.51 6.13 0.15 0.08 -0.25 113.70 124.77 1gdh s SER 208 Ca 0.01 -0.72 -0.26 0.00 0.70 0.00 0.00 55.95 55.68 1gdh s SER 208 Cb -0.13 -1.65 0.03 0.00 -1.71 0.00 0.00 66.02 62.55 1gdh s SER 208 CO -0.07 -0.08 1.01 -0.76 1.20 0.00 0.00 173.24 174.54 1gdh s LEU 209 N 1.36 3.87 -0.16 3.45 1.43 -0.76 -1.19 118.68 126.68 1gdh s LEU 209 Ca 0.02 0.03 0.15 0.00 -1.03 0.00 0.00 54.13 53.30 1gdh s LEU 209 Cb -0.15 -3.13 0.42 0.00 0.03 0.00 0.00 46.19 43.36 1gdh s LEU 209 CO -0.06 -1.22 1.21 0.59 0.23 0.00 0.00 176.35 177.10 1gdh n ASN 210 N 7.60 1.59 -4.89 2.29 4.13 -0.36 -3.59 115.26 122.04 1gdh n ASN 210 Ca 0.06 -3.42 -0.29 0.00 1.68 0.00 0.00 54.58 52.60 1gdh n ASN 210 Cb 0.48 -0.47 -0.01 0.00 -1.54 0.00 0.00 39.78 38.24 1gdh n ASN 210 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1gdh s ALA 211 N -2.45 3.33 0.05 5.41 0.00 -1.10 -4.56 121.76 122.43 1gdh s ALA 211 Ca 0.37 -0.29 -0.30 0.00 0.00 0.00 0.00 51.96 51.74 1gdh s ALA 211 Cb 0.38 -2.72 -0.04 0.00 0.00 0.00 0.00 23.12 20.73 1gdh s ALA 211 CO -0.09 -0.24 0.98 -2.14 0.00 0.00 0.00 175.76 174.27 1gdh s PRO 212 N -4.37 4.62 0.19 0.00 0.02 -1.26 -4.77 135.00 129.42 1gdh s PRO 212 Ca 0.50 1.44 -0.30 0.00 0.02 0.00 0.00 61.00 62.67 1gdh s PRO 212 Cb -0.10 -3.42 -0.08 0.00 0.02 0.00 0.00 34.50 30.91 1gdh s PRO 212 CO 0.39 0.06 1.20 0.45 -0.33 0.00 0.00 177.00 178.77 1gdh s SER 213 N 0.58 7.08 0.00 2.53 0.15 -1.26 -4.92 113.70 117.86 1gdh s SER 213 Ca 0.50 2.24 -0.08 0.00 0.70 0.00 0.00 55.95 59.31 1gdh s SER 213 Cb -0.22 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.49 1gdh s SER 213 CO 0.29 -0.38 0.16 -0.89 1.20 0.00 0.00 173.24 173.63 1gdh s THR 214 N -0.06 0.08 0.37 6.45 2.01 -1.26 -5.01 115.64 118.22 1gdh s THR 214 Ca 0.53 -0.66 0.09 0.00 0.31 0.00 0.00 61.69 61.96 1gdh s THR 214 Cb -0.33 -0.47 0.32 0.00 0.01 0.00 0.00 72.50 72.04 1gdh s THR 214 CO 0.37 -0.36 1.91 -0.65 -0.69 0.00 0.00 174.62 175.19 1gdh h PRO 215 N 4.19 0.63 0.00 4.92 0.11 -1.96 -0.59 132.00 139.30 1gdh h PRO 215 Ca -0.31 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.72 1gdh h PRO 215 Cb 1.19 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1gdh h PRO 215 CO 0.41 0.42 -0.23 0.93 -0.21 0.00 0.00 178.00 179.31 1gdh h GLU 216 N 0.65 0.00 -0.02 1.05 3.07 -1.99 -3.21 114.58 114.13 1gdh h GLU 216 Ca 0.39 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.25 1gdh h GLU 216 Cb 0.61 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.52 1gdh h GLU 216 CO -0.16 0.23 -0.21 0.25 -1.40 0.00 0.00 179.01 177.73 1gdh n THR 217 N -3.35 0.00 -1.92 1.13 -2.24 -0.76 -4.87 114.28 102.27 1gdh n THR 217 Ca 0.00 -0.39 -0.42 0.00 -2.27 0.00 0.00 64.05 60.97 1gdh n THR 217 Cb 0.46 1.31 -0.03 0.00 -2.10 0.00 0.00 70.33 69.97 1gdh n THR 217 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1gdh s ARG 218 N -1.90 4.21 -2.06 -0.78 3.52 -0.30 -2.29 118.95 119.34 1gdh s ARG 218 Ca 0.19 2.39 0.00 0.00 -0.13 0.00 0.00 55.73 58.18 1gdh s ARG 218 Cb 0.16 -3.12 0.00 0.00 -1.56 0.00 0.00 34.95 30.43 1gdh s ARG 218 CO 0.37 -0.56 0.00 0.66 -0.81 0.00 0.00 175.30 174.95 1gdh n TYR 219 N 3.25 -0.36 0.18 5.12 4.01 0.21 -4.86 117.16 124.71 1gdh n TYR 219 Ca 0.11 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.87 1gdh n TYR 219 Cb 0.39 -3.66 0.32 0.00 -0.31 0.00 0.00 39.34 36.08 1gdh n TYR 219 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1gdh h PHE 220 N 0.00 0.00 -1.71 -0.72 -0.00 -1.05 -3.37 116.94 110.09 1gdh h PHE 220 Ca -0.45 0.00 -0.58 0.00 -0.00 0.00 0.00 57.97 56.94 1gdh h PHE 220 Cb 1.36 0.00 -0.09 0.00 -0.00 0.00 0.00 35.95 37.22 1gdh h PHE 220 CO 0.58 0.43 1.27 0.12 -0.00 0.00 0.00 178.31 180.71 1gdh s PHE 221 N -3.95 2.44 0.01 6.09 5.36 -0.50 -4.58 117.98 122.85 1gdh s PHE 221 Ca -0.02 -0.51 0.00 0.00 -0.96 0.00 0.00 56.93 55.44 1gdh s PHE 221 Cb 0.13 -4.65 -0.00 0.00 -0.34 0.00 0.00 43.02 38.16 1gdh s PHE 221 CO 0.72 -1.98 0.01 0.27 -1.46 0.00 0.00 175.22 172.78 1gdh n ASN 222 N 9.01 -0.01 -0.15 6.13 2.04 -1.26 -1.05 115.26 129.97 1gdh n ASN 222 Ca 0.19 -1.03 -0.05 0.00 -0.44 0.00 0.00 54.58 53.25 1gdh n ASN 222 Cb 0.50 0.03 0.02 0.00 -2.53 0.00 0.00 39.78 37.80 1gdh n ASN 222 CO 0.00 0.00 0.00 0.50 -0.44 0.00 0.00 177.26 177.32 1gdh h LYS 223 N 0.00 -0.13 -0.58 -3.83 3.64 -1.90 0.31 116.57 114.08 1gdh h LYS 223 Ca -0.00 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.34 1gdh h LYS 223 Cb 0.02 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 1gdh h LYS 223 CO 0.01 -0.09 0.17 0.00 -2.27 0.00 0.00 179.45 177.26 1gdh h ALA 224 N 1.13 1.20 -0.12 5.00 0.00 -1.96 -0.81 119.26 123.70 1gdh h ALA 224 Ca 0.22 -0.20 -0.17 0.00 0.00 0.00 0.00 54.91 54.76 1gdh h ALA 224 Cb 0.49 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1gdh h ALA 224 CO -0.57 0.56 -0.64 1.15 0.00 0.00 0.00 179.25 179.75 1gdh h THR 225 N 0.85 1.36 -0.39 0.00 2.02 -0.89 -3.27 112.91 112.59 1gdh h THR 225 Ca 0.19 -1.98 -0.01 0.00 0.77 0.00 0.00 66.41 65.37 1gdh h THR 225 Cb 0.27 1.97 -0.02 0.00 -1.74 0.00 0.00 68.15 68.63 1gdh h THR 225 CO -0.01 0.60 0.19 0.40 0.37 0.00 0.00 175.52 177.07 1gdh h ILE 226 N 0.32 1.17 0.00 3.11 2.04 0.80 -2.23 117.51 122.71 1gdh h ILE 226 Ca -0.01 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.35 1gdh h ILE 226 Cb 1.19 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 1gdh h ILE 226 CO 0.11 0.19 0.00 0.29 0.00 0.00 0.00 178.15 178.74 1gdh n LYS 227 N -4.70 0.18 -0.01 2.37 4.76 -0.55 -0.61 118.16 119.61 1gdh n LYS 227 Ca -0.00 0.06 0.10 0.00 -2.87 0.00 0.00 58.31 55.60 1gdh n LYS 227 Cb 0.11 -1.50 -0.14 0.00 -1.84 0.00 0.00 35.03 31.66 1gdh n LYS 227 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1gdh n SER 228 N -1.07 0.56 -4.77 4.39 7.64 -0.84 -4.95 113.62 114.57 1gdh n SER 228 Ca 0.05 -0.42 -0.35 0.00 1.01 0.00 0.00 58.87 59.16 1gdh n SER 228 Cb 0.03 1.54 0.00 0.00 -1.01 0.00 0.00 64.21 64.77 1gdh n SER 228 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1gdh s LEU 229 N -3.80 3.74 0.58 -3.43 1.43 0.21 -3.18 118.68 114.24 1gdh s LEU 229 Ca -0.01 2.17 -0.20 0.00 -1.03 0.00 0.00 54.13 55.06 1gdh s LEU 229 Cb 0.14 -4.58 -0.04 0.00 0.03 0.00 0.00 46.19 41.74 1gdh s LEU 229 CO 0.84 -1.22 1.30 -2.16 0.23 0.00 0.00 176.35 175.34 1gdh s PRO 230 N -3.31 2.97 0.42 1.29 0.04 -1.25 -4.91 135.00 130.24 1gdh s PRO 230 Ca 0.73 2.08 -0.25 0.00 0.04 0.00 0.00 61.00 63.59 1gdh s PRO 230 Cb -0.24 -2.08 -0.10 0.00 0.04 0.00 0.00 34.50 32.12 1gdh s PRO 230 CO 0.27 -1.28 1.11 1.04 0.04 0.00 0.00 177.00 178.18 1gdh n GLN 231 N -1.37 1.56 -1.95 4.56 1.13 -1.26 -1.94 117.38 118.11 1gdh n GLN 231 Ca 0.12 0.56 -0.19 0.00 -1.94 0.00 0.00 57.00 55.55 1gdh n GLN 231 Cb 0.47 -2.16 -0.04 0.00 0.11 0.00 0.00 30.24 28.61 1gdh n GLN 231 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1gdh n GLY 232 N 1.05 0.70 3.74 1.08 0.00 -0.86 -4.95 105.19 105.95 1gdh n GLY 232 Ca 0.08 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 1gdh n GLY 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gdh s ALA 233 N -2.82 2.24 -0.11 4.61 0.00 -0.82 -3.82 121.76 121.05 1gdh s ALA 233 Ca 0.00 0.73 0.03 0.00 0.00 0.00 0.00 51.96 52.73 1gdh s ALA 233 Cb 0.00 -3.41 0.01 0.00 0.00 0.00 0.00 23.12 19.72 1gdh s ALA 233 CO 0.00 -1.66 -0.21 0.42 0.00 0.00 0.00 175.76 174.31 1gdh s ILE 234 N -2.15 1.88 -0.08 0.00 1.01 0.02 -0.88 121.20 121.00 1gdh s ILE 234 Ca 0.71 -0.90 0.04 0.00 0.00 0.00 0.00 60.65 60.50 1gdh s ILE 234 Cb -0.25 -1.65 -0.01 0.00 0.01 0.00 0.00 42.46 40.56 1gdh s ILE 234 CO 0.44 0.52 -0.22 0.54 0.00 0.00 0.00 174.94 176.22 1gdh s VAL 235 N 0.56 2.34 0.14 2.92 0.11 -1.12 -0.04 120.40 125.32 1gdh s VAL 235 Ca -0.14 -0.95 0.09 0.00 -2.93 0.00 0.00 61.98 58.05 1gdh s VAL 235 Cb -0.17 -1.89 -0.04 0.00 -1.53 0.00 0.00 36.38 32.75 1gdh s VAL 235 CO 0.05 0.56 -0.17 0.68 -3.33 0.00 0.00 175.10 172.89 1gdh s VAL 236 N -0.04 2.87 -0.06 2.04 -7.23 0.65 -1.55 120.40 117.09 1gdh s VAL 236 Ca -0.06 -1.60 -0.02 0.00 -1.81 0.00 0.00 61.98 58.49 1gdh s VAL 236 Cb -0.15 -2.35 0.03 0.00 0.56 0.00 0.00 36.38 34.48 1gdh s VAL 236 CO 0.05 0.02 0.05 0.21 -0.31 0.00 0.00 175.10 175.12 1gdh s ASN 237 N -2.37 1.33 0.00 4.85 2.47 -0.37 -1.82 114.94 119.02 1gdh s ASN 237 Ca 0.20 -0.00 0.00 0.00 0.42 0.00 0.00 52.86 53.48 1gdh s ASN 237 Cb -0.10 -0.22 0.00 0.00 -1.45 0.00 0.00 41.25 39.48 1gdh s ASN 237 CO 0.11 -0.24 0.84 0.35 -3.72 0.00 0.00 177.10 174.44 1gdh n THR 238 N 5.26 0.71 0.00 -5.21 -2.24 -1.24 -0.54 114.28 111.02 1gdh n THR 238 Ca -0.04 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 60.97 1gdh n THR 238 Cb 0.50 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 1gdh n THR 238 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gdh n ALA 239 N -0.35 0.00 -3.67 6.98 0.00 -1.25 -4.87 120.51 117.34 1gdh n ALA 239 Ca 0.00 -0.07 -0.10 0.00 0.00 0.00 0.00 53.44 53.27 1gdh n ALA 239 Cb 0.26 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.60 1gdh n ALA 239 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1gdh s ARG 240 N -0.41 0.29 0.50 0.00 1.81 -1.26 -4.96 118.95 114.92 1gdh s ARG 240 Ca 0.00 0.87 0.34 0.00 -1.72 0.00 0.00 55.73 55.22 1gdh s ARG 240 Cb 0.00 0.13 1.69 0.00 -0.45 0.00 0.00 34.95 36.32 1gdh s ARG 240 CO 0.00 -0.23 2.02 0.78 -0.68 0.00 0.00 175.30 177.19 1gdh h GLY 241 N 7.85 0.00 -1.90 -3.53 0.00 -1.79 -1.84 103.07 101.86 1gdh h GLY 241 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1gdh h GLY 241 CO 0.19 0.00 0.00 2.09 0.00 0.00 0.00 176.54 178.82 1gdh n ASP 242 N -2.75 2.84 0.00 0.19 5.75 -1.26 -3.25 116.55 118.07 1gdh n ASP 242 Ca -0.01 -1.96 0.14 0.00 -0.01 0.00 0.00 54.79 52.95 1gdh n ASP 242 Cb 0.13 -0.31 0.63 0.00 -1.03 0.00 0.00 41.12 40.54 1gdh n ASP 242 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1gdh n LEU 243 N 1.06 0.00 -4.19 -2.12 4.77 -0.69 0.67 117.00 116.50 1gdh n LEU 243 Ca 0.18 0.47 -0.28 0.00 -0.03 0.00 0.00 56.01 56.34 1gdh n LEU 243 Cb 0.47 -0.47 -0.16 0.00 -2.33 0.00 0.00 43.42 40.93 1gdh n LEU 243 CO 0.13 -0.01 -0.53 -0.69 -1.33 0.00 0.00 177.39 174.96 1gdh s VAL 244 N -2.93 1.69 -0.59 4.08 1.01 -1.22 -1.40 120.40 121.03 1gdh s VAL 244 Ca 0.16 -0.86 -0.20 0.00 0.00 0.00 0.00 61.98 61.08 1gdh s VAL 244 Cb 0.19 -1.45 0.09 0.00 0.00 0.00 0.00 36.38 35.21 1gdh s VAL 244 CO 0.51 0.48 0.76 -0.62 0.00 0.00 0.00 175.10 176.23 1gdh s ASP 245 N -0.02 6.19 0.22 3.32 -1.08 -0.21 -4.77 116.67 120.32 1gdh s ASP 245 Ca -0.04 -1.20 -0.09 0.00 -0.52 0.00 0.00 52.55 50.69 1gdh s ASP 245 Cb -0.13 -2.33 0.34 0.00 -1.46 0.00 0.00 42.92 39.34 1gdh s ASP 245 CO 0.03 -1.16 1.67 0.78 0.52 0.00 0.00 175.17 177.01 1gdh h ASN 246 N 9.25 -0.21 -0.89 -0.34 -0.26 -1.91 -1.50 115.58 119.72 1gdh h ASN 246 Ca -0.29 0.15 0.14 0.00 -0.56 0.00 0.00 56.30 55.74 1gdh h ASN 246 Cb 1.08 0.25 -0.07 0.00 -1.06 0.00 0.00 38.32 38.53 1gdh h ASN 246 CO 1.10 -0.10 0.57 -0.33 -1.06 0.00 0.00 177.43 177.61 1gdh h GLU 247 N 0.15 0.70 0.03 0.81 4.39 -1.97 0.15 114.58 118.84 1gdh h GLU 247 Ca 0.35 -0.04 -0.26 0.00 0.34 0.00 0.00 59.36 59.74 1gdh h GLU 247 Cb 0.57 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 29.03 1gdh h GLU 247 CO -0.53 0.46 -1.37 -0.07 -1.16 0.00 0.00 179.01 176.34 1gdh h LEU 248 N 0.72 0.09 -0.05 1.33 3.38 -1.65 -2.35 115.31 116.79 1gdh h LEU 248 Ca 0.44 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.27 1gdh h LEU 248 Cb 0.67 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 1gdh h LEU 248 CO -0.20 1.11 -0.01 0.58 0.09 0.00 0.00 178.44 180.01 1gdh h VAL 249 N 0.02 1.28 -0.47 1.22 2.07 -1.27 -2.72 116.25 116.37 1gdh h VAL 249 Ca -0.16 -0.87 0.01 0.00 0.82 0.00 0.00 66.70 66.50 1gdh h VAL 249 Cb 1.91 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 33.42 1gdh h VAL 249 CO 0.12 0.24 0.31 0.58 0.02 0.00 0.00 177.57 178.84 1gdh h VAL 250 N -0.24 1.12 -0.01 2.57 2.07 -1.00 -1.84 116.25 118.92 1gdh h VAL 250 Ca 0.01 -0.22 -0.13 0.00 0.82 0.00 0.00 66.70 67.19 1gdh h VAL 250 Cb 0.38 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 1gdh h VAL 250 CO 0.00 0.12 -0.59 0.00 0.02 0.00 0.00 177.57 177.12 1gdh h ALA 251 N 1.70 1.00 0.02 1.67 0.00 -1.37 -2.42 119.26 119.86 1gdh h ALA 251 Ca 0.17 -0.54 -0.29 0.00 0.00 0.00 0.00 54.91 54.26 1gdh h ALA 251 Cb -0.07 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1gdh h ALA 251 CO -0.04 0.74 -1.62 0.00 0.00 0.00 0.00 179.25 178.33 1gdh h ALA 252 N 1.38 0.64 -0.78 0.00 0.00 -1.07 -2.34 119.26 117.09 1gdh h ALA 252 Ca -0.01 -1.36 -0.02 0.00 0.00 0.00 0.00 54.91 53.53 1gdh h ALA 252 Cb 1.06 0.41 -0.04 0.00 0.00 0.00 0.00 17.79 19.21 1gdh h ALA 252 CO 0.08 1.48 0.42 -0.07 0.00 0.00 0.00 179.25 181.16 1gdh h LEU 253 N 0.01 0.98 -0.16 0.00 3.38 -1.30 0.50 115.31 118.73 1gdh h LEU 253 Ca -0.26 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.55 1gdh h LEU 253 Cb 1.98 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 42.48 1gdh h LEU 253 CO 0.09 0.79 -0.19 -0.33 0.09 0.00 0.00 178.44 178.89 1gdh h GLU 254 N 1.10 0.41 0.00 1.13 5.08 -1.51 -2.98 114.58 117.81 1gdh h GLU 254 Ca 0.28 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1gdh h GLU 254 Cb 0.04 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1gdh h GLU 254 CO -0.04 0.80 0.00 0.00 -1.00 0.00 0.00 179.01 178.77 1gdh n ALA 255 N -2.44 1.64 -0.97 3.43 0.00 -0.88 -4.88 120.51 116.40 1gdh n ALA 255 Ca -0.06 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1gdh n ALA 255 Cb 0.40 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1gdh n ALA 255 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gdh n GLY 256 N -0.05 0.57 0.32 0.00 0.00 0.15 -4.85 105.19 101.33 1gdh n GLY 256 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.16 1gdh n GLY 256 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1gdh h ARG 257 N 1.43 0.16 -6.42 1.61 9.65 -1.18 -3.36 114.38 116.27 1gdh h ARG 257 Ca 0.00 -0.01 -0.69 0.00 -1.10 0.00 0.00 59.98 58.18 1gdh h ARG 257 Cb 0.10 -0.04 -0.27 0.00 -1.39 0.00 0.00 29.97 28.37 1gdh h ARG 257 CO 0.00 0.10 -0.83 -0.51 2.80 0.00 0.00 179.97 181.53 1gdh s LEU 258 N -9.10 2.38 -0.11 3.80 1.43 -1.00 -2.03 118.68 114.04 1gdh s LEU 258 Ca -0.06 -0.34 -0.25 0.00 -1.03 0.00 0.00 54.13 52.44 1gdh s LEU 258 Cb 0.18 -1.45 -0.22 0.00 0.03 0.00 0.00 46.19 44.74 1gdh s LEU 258 CO 0.71 0.32 0.78 0.00 0.23 0.00 0.00 176.35 178.39 1gdh h ALA 259 N 5.49 -0.02 -2.56 4.21 0.00 -1.11 -3.39 119.26 121.88 1gdh h ALA 259 Ca -0.44 -0.40 -0.11 0.00 0.00 0.00 0.00 54.91 53.97 1gdh h ALA 259 Cb 1.14 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.80 1gdh h ALA 259 CO 0.49 -0.06 -0.39 -0.47 0.00 0.00 0.00 179.25 178.82 1gdh s TYR 260 N -2.52 0.39 -0.02 0.00 5.04 -1.25 -4.84 117.35 114.14 1gdh s TYR 260 Ca -0.16 -0.78 0.00 0.00 -2.44 0.00 0.00 57.07 53.69 1gdh s TYR 260 Cb -0.02 -0.12 0.02 0.00 0.35 0.00 0.00 41.96 42.19 1gdh s TYR 260 CO 0.61 -0.63 0.00 0.00 -1.34 0.00 0.00 175.55 174.19 1gdh s ALA 261 N -3.94 0.26 -0.28 3.97 0.00 -0.98 -2.78 121.76 118.00 1gdh s ALA 261 Ca 0.14 0.15 0.02 0.00 0.00 0.00 0.00 51.96 52.26 1gdh s ALA 261 Cb 0.04 -0.26 0.06 0.00 0.00 0.00 0.00 23.12 22.97 1gdh s ALA 261 CO -0.03 -0.05 -0.06 0.20 0.00 0.00 0.00 175.76 175.81 1gdh s GLY 262 N 0.84 1.72 -0.09 0.00 0.00 -0.59 -0.52 107.32 108.67 1gdh s GLY 262 Ca -0.08 -1.86 0.03 0.00 0.00 0.00 0.00 44.72 42.81 1gdh s GLY 262 CO -0.02 0.67 -0.19 -1.36 0.00 0.00 0.00 173.10 172.21 1gdh s PHE 263 N 1.12 2.64 -0.19 1.90 0.08 -0.81 -1.24 117.98 121.48 1gdh s PHE 263 Ca -0.06 -0.71 0.19 0.00 0.12 0.00 0.00 56.93 56.47 1gdh s PHE 263 Cb -0.20 -1.72 -0.28 0.00 -0.57 0.00 0.00 43.02 40.25 1gdh s PHE 263 CO -0.04 -0.22 0.49 -3.47 -0.10 0.00 0.00 175.22 171.88 1gdh n ASP 264 N 3.23 0.70 -3.91 1.36 2.03 0.30 -1.91 116.55 118.35 1gdh n ASP 264 Ca -0.18 -0.18 -0.11 0.00 0.52 0.00 0.00 54.79 54.83 1gdh n ASP 264 Cb 0.53 1.70 -0.13 0.00 -0.72 0.00 0.00 41.12 42.49 1gdh n ASP 264 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1gdh s VAL 265 N -3.21 0.07 0.07 5.18 -7.23 -1.24 -1.55 120.40 112.49 1gdh s VAL 265 Ca -0.04 -0.30 0.03 0.00 -1.81 0.00 0.00 61.98 59.86 1gdh s VAL 265 Cb 0.12 -0.11 -0.03 0.00 0.56 0.00 0.00 36.38 36.92 1gdh s VAL 265 CO 0.78 -0.15 -0.10 -0.36 -0.31 0.00 0.00 175.10 174.96 1gdh s PHE 266 N -0.47 0.95 -0.21 2.82 0.40 -1.26 -4.52 117.98 115.69 1gdh s PHE 266 Ca -0.05 -0.55 -0.29 0.00 -0.60 0.00 0.00 56.93 55.44 1gdh s PHE 266 Cb -0.03 -0.54 -0.03 0.00 0.51 0.00 0.00 43.02 42.93 1gdh s PHE 266 CO -0.00 -0.02 1.67 0.00 0.70 0.00 0.00 175.22 177.57 1gdh s ALA 267 N -1.74 3.24 0.00 5.36 0.00 -1.20 -2.73 121.76 124.69 1gdh s ALA 267 Ca -0.02 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.46 1gdh s ALA 267 Cb -0.07 -3.87 0.00 0.00 0.00 0.00 0.00 23.12 19.18 1gdh s ALA 267 CO 0.01 -2.00 0.00 0.41 0.00 0.00 0.00 175.76 174.17 1gdh n GLY 268 N 4.75 0.93 3.77 0.00 0.00 -1.26 -4.44 105.19 108.93 1gdh n GLY 268 Ca 0.20 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1gdh n GLY 268 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1gdh s GLU 269 N -0.39 4.14 0.00 1.61 -1.05 -1.10 0.09 118.70 122.00 1gdh s GLU 269 Ca 0.00 2.53 0.17 0.00 -0.15 0.00 0.00 54.97 57.51 1gdh s GLU 269 Cb 0.00 -3.00 0.48 0.00 -0.44 0.00 0.00 34.13 31.17 1gdh s GLU 269 CO 0.00 -0.53 1.39 -0.35 0.95 0.00 0.00 175.26 176.73 1gdh n PRO 270 N 1.11 2.09 -2.59 -4.83 -0.04 -1.26 -4.98 135.00 124.49 1gdh n PRO 270 Ca 0.03 -1.68 -0.43 0.00 -0.04 0.00 0.00 63.50 61.39 1gdh n PRO 270 Cb 0.39 -1.39 0.01 0.00 -0.04 0.00 0.00 33.50 32.46 1gdh n PRO 270 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1gdh n ASN 271 N 0.87 5.72 -4.77 3.54 4.13 0.11 -4.98 115.26 119.87 1gdh n ASN 271 Ca 0.16 -3.24 -0.36 0.00 1.68 0.00 0.00 54.58 52.82 1gdh n ASN 271 Cb 0.41 -1.39 -0.00 0.00 -1.54 0.00 0.00 39.78 37.26 1gdh n ASN 271 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 1gdh s ILE 272 N -0.99 3.14 -0.05 2.41 -4.36 -1.26 -4.68 121.20 115.41 1gdh s ILE 272 Ca 0.36 0.77 -0.39 0.00 -0.26 0.00 0.00 60.65 61.13 1gdh s ILE 272 Cb 0.08 -3.34 -0.18 0.00 1.25 0.00 0.00 42.46 40.27 1gdh s ILE 272 CO 0.04 -0.10 1.33 -3.20 0.24 0.00 0.00 174.94 173.25 1gdh n ASN 273 N -1.00 1.13 0.32 4.36 2.85 -1.26 -4.84 115.26 116.82 1gdh n ASN 273 Ca 0.10 1.13 0.20 0.00 -0.11 0.00 0.00 54.58 55.91 1gdh n ASN 273 Cb 0.50 -1.06 1.09 0.00 1.24 0.00 0.00 39.78 41.55 1gdh n ASN 273 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 1gdh h GLU 274 N 4.42 0.00 -0.40 1.20 4.39 -2.01 -2.66 114.58 119.52 1gdh h GLU 274 Ca -0.48 0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.28 1gdh h GLU 274 Cb 1.37 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.00 1gdh h GLU 274 CO 0.78 0.01 0.27 0.78 -1.16 0.00 0.00 179.01 179.69 1gdh h GLY 275 N 0.19 0.34 1.26 -3.84 0.00 -2.00 -3.09 103.07 95.92 1gdh h GLY 275 Ca -0.00 -0.11 -0.06 0.00 0.00 0.00 0.00 47.33 47.16 1gdh h GLY 275 CO 0.00 0.08 0.14 -0.97 0.00 0.00 0.00 176.54 175.80 1gdh h TYR 276 N 0.27 0.96 -0.98 5.60 0.05 -1.84 -3.29 116.97 117.74 1gdh h TYR 276 Ca 0.18 -0.10 0.14 0.00 0.05 0.00 0.00 58.73 59.00 1gdh h TYR 276 Cb 0.36 -0.28 -0.09 0.00 1.01 0.00 0.00 36.73 37.74 1gdh h TYR 276 CO -0.00 0.80 0.62 1.88 -1.05 0.00 0.00 178.16 180.41 1gdh h TYR 277 N 0.89 1.05 -0.01 4.88 0.05 -1.75 -2.67 116.97 119.41 1gdh h TYR 277 Ca 0.19 0.03 0.00 0.00 0.05 0.00 0.00 58.73 59.00 1gdh h TYR 277 Cb 0.32 -0.33 0.00 0.00 1.01 0.00 0.00 36.73 37.73 1gdh h TYR 277 CO 0.02 0.36 -0.26 -0.25 -1.05 0.00 0.00 178.16 176.98 1gdh n ASP 278 N -4.64 1.70 -4.64 3.88 8.00 -1.24 -4.93 116.55 114.67 1gdh n ASP 278 Ca 0.20 -1.35 -0.42 0.00 0.71 0.00 0.00 54.79 53.92 1gdh n ASP 278 Cb 0.44 0.39 -0.03 0.00 -0.02 0.00 0.00 41.12 41.90 1gdh n ASP 278 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1gdh s LEU 279 N -1.86 4.09 0.27 0.64 1.43 -1.01 -4.90 118.68 117.34 1gdh s LEU 279 Ca 0.14 2.07 0.12 0.00 -1.03 0.00 0.00 54.13 55.43 1gdh s LEU 279 Cb 0.12 -3.53 0.33 0.00 0.03 0.00 0.00 46.19 43.14 1gdh s LEU 279 CO 0.35 -1.19 1.58 1.55 0.23 0.00 0.00 176.35 178.87 1gdh h PRO 280 N 10.84 0.00 -2.28 1.29 0.13 -1.91 -3.28 132.00 136.80 1gdh h PRO 280 Ca -0.40 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.21 1gdh h PRO 280 Cb 1.19 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.20 1gdh h PRO 280 CO 0.97 0.62 1.17 0.27 -0.23 0.00 0.00 178.00 180.79 1gdh n ASN 281 N -3.66 6.90 -3.95 1.44 6.94 -1.26 -4.71 115.26 116.96 1gdh n ASN 281 Ca -0.01 -2.97 -0.10 0.00 -0.02 0.00 0.00 54.58 51.49 1gdh n ASN 281 Cb 0.64 -1.34 -0.11 0.00 -2.36 0.00 0.00 39.78 36.61 1gdh n ASN 281 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1gdh s THR 282 N -0.79 0.09 -0.16 5.53 -4.23 -1.24 -2.32 115.64 112.52 1gdh s THR 282 Ca 0.61 -0.71 -0.00 0.00 -1.18 0.00 0.00 61.69 60.40 1gdh s THR 282 Cb 0.29 -0.23 0.04 0.00 1.34 0.00 0.00 72.50 73.94 1gdh s THR 282 CO -0.13 -0.39 -0.08 0.12 -0.54 0.00 0.00 174.62 173.60 1gdh s PHE 283 N -1.16 1.92 -0.05 3.99 5.36 0.32 -4.76 117.98 123.60 1gdh s PHE 283 Ca -0.13 -1.18 0.02 0.00 -0.96 0.00 0.00 56.93 54.68 1gdh s PHE 283 Cb -0.08 -1.43 0.02 0.00 -0.34 0.00 0.00 43.02 41.19 1gdh s PHE 283 CO -0.01 -0.64 -0.08 -0.51 -1.46 0.00 0.00 175.22 172.52 1gdh s LEU 284 N 1.56 1.52 0.11 6.12 1.43 -1.26 -1.92 118.68 126.23 1gdh s LEU 284 Ca 0.02 -0.19 0.10 0.00 -1.03 0.00 0.00 54.13 53.02 1gdh s LEU 284 Cb -0.15 -0.59 -0.04 0.00 0.03 0.00 0.00 46.19 45.44 1gdh s LEU 284 CO -0.08 -0.00 -0.25 -0.36 0.23 0.00 0.00 176.35 175.88 1gdh s PHE 285 N 0.71 2.37 -1.45 0.29 0.08 -0.80 -5.01 117.98 114.16 1gdh s PHE 285 Ca -0.12 -0.36 -0.13 0.00 0.12 0.00 0.00 56.93 56.45 1gdh s PHE 285 Cb -0.14 -1.30 0.04 0.00 -0.57 0.00 0.00 43.02 41.06 1gdh s PHE 285 CO 0.02 0.31 2.28 -0.35 -0.10 0.00 0.00 175.22 177.38 1gdh n PRO 286 N 1.04 3.12 -3.99 0.24 -0.04 -1.26 -4.51 135.00 129.61 1gdh n PRO 286 Ca -0.17 -2.71 -0.31 0.00 -0.04 0.00 0.00 63.50 60.27 1gdh n PRO 286 Cb 0.53 -3.15 -0.02 0.00 -0.04 0.00 0.00 33.50 30.82 1gdh n PRO 286 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1gdh n HIS 287 N 5.32 -1.59 -1.26 0.54 -0.00 -0.59 -4.86 115.22 112.78 1gdh n HIS 287 Ca 0.54 0.56 -0.22 0.00 0.46 0.00 0.00 57.72 59.06 1gdh n HIS 287 Cb 0.36 -3.36 0.18 0.00 -0.12 0.00 0.00 29.99 27.05 1gdh n HIS 287 CO 0.00 0.00 0.00 0.44 0.46 0.00 0.00 176.34 177.24 1gdh n ILE 288 N -4.49 3.13 -0.21 3.57 -5.35 -1.26 -4.58 119.36 110.17 1gdh n ILE 288 Ca -0.24 -2.03 -0.02 0.00 -0.27 0.00 0.00 62.75 60.19 1gdh n ILE 288 Cb 0.65 -0.45 0.05 0.00 -1.74 0.00 0.00 39.64 38.15 1gdh n ILE 288 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1gdh h GLY 289 N 1.00 0.32 -1.43 3.28 0.00 -1.89 -1.56 103.07 102.80 1gdh h GLY 289 Ca 0.59 0.26 0.00 0.00 0.00 0.00 0.00 47.33 48.18 1gdh h GLY 289 CO 1.02 -0.24 0.00 -1.14 0.00 0.00 0.00 176.54 176.19 1gdh n SER 290 N -5.44 3.05 -2.58 0.19 3.41 -1.26 -3.10 113.62 107.89 1gdh n SER 290 Ca 0.07 -2.02 -0.04 0.00 -0.26 0.00 0.00 58.87 56.62 1gdh n SER 290 Cb 0.34 -0.26 -0.02 0.00 -0.26 0.00 0.00 64.21 64.00 1gdh n SER 290 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gdh n ALA 291 N 0.61 2.08 -2.36 7.33 0.00 -0.59 -4.18 120.51 123.41 1gdh n ALA 291 Ca 0.13 -0.44 -0.30 0.00 0.00 0.00 0.00 53.44 52.83 1gdh n ALA 291 Cb 0.46 -2.37 -0.16 0.00 0.00 0.00 0.00 19.45 17.37 1gdh n ALA 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gdh s ALA 292 N 3.12 2.09 0.47 0.00 0.00 -1.26 -5.04 121.76 121.13 1gdh s ALA 292 Ca 0.13 -1.08 0.15 0.00 0.00 0.00 0.00 51.96 51.16 1gdh s ALA 292 Cb 0.05 -0.54 1.12 0.00 0.00 0.00 0.00 23.12 23.75 1gdh s ALA 292 CO -0.00 0.50 2.03 0.00 0.00 0.00 0.00 175.76 178.29 1gdh h THR 293 N 4.56 0.93 -0.18 0.00 1.03 -1.98 0.28 112.91 117.54 1gdh h THR 293 Ca -0.42 -0.09 -0.14 0.00 -0.01 0.00 0.00 66.41 65.75 1gdh h THR 293 Cb 1.13 0.63 -0.01 0.00 -1.07 0.00 0.00 68.15 68.82 1gdh h THR 293 CO 0.47 0.05 -0.47 1.56 -0.01 0.00 0.00 175.52 177.12 1gdh h GLN 294 N 0.28 0.45 -0.02 0.00 7.50 -1.96 -2.41 115.11 118.96 1gdh h GLN 294 Ca 0.19 -0.25 -0.02 0.00 0.50 0.00 0.00 58.65 59.07 1gdh h GLN 294 Cb 0.41 0.02 0.00 0.00 0.05 0.00 0.00 27.48 27.95 1gdh h GLN 294 CO -0.04 0.83 -0.07 0.00 -1.50 0.00 0.00 178.83 178.06 1gdh h ALA 295 N 1.13 0.03 0.00 3.87 0.00 -0.72 -2.70 119.26 120.87 1gdh h ALA 295 Ca 0.02 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1gdh h ALA 295 Cb 0.97 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1gdh h ALA 295 CO 0.08 -0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.24 1gdh h ARG 296 N -0.54 0.00 0.04 0.00 2.47 -0.98 -1.96 114.38 113.41 1gdh h ARG 296 Ca -0.00 0.00 -0.35 0.00 -1.26 0.00 0.00 59.98 58.37 1gdh h ARG 296 Cb 0.72 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.99 1gdh h ARG 296 CO 0.01 0.00 -2.10 0.39 0.56 0.00 0.00 179.97 178.84 1gdh n GLU 297 N -2.75 0.69 -0.18 0.04 1.02 -0.91 -2.96 120.64 115.58 1gdh n GLU 297 Ca -0.01 0.19 -0.02 0.00 -0.02 0.00 0.00 57.16 57.30 1gdh n GLU 297 Cb 0.15 -1.66 0.08 0.00 -0.02 0.00 0.00 31.44 30.00 1gdh n GLU 297 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 1gdh h ASP 298 N 0.02 0.26 -0.91 1.62 3.58 -1.04 0.15 116.42 120.10 1gdh h ASP 298 Ca -0.44 0.06 0.02 0.00 0.42 0.00 0.00 57.03 57.08 1gdh h ASP 298 Cb 2.04 0.02 -0.05 0.00 1.72 0.00 0.00 39.33 43.07 1gdh h ASP 298 CO 0.04 0.17 0.60 0.24 -2.88 0.00 0.00 179.24 177.41 1gdh h MET 299 N 0.42 1.17 -0.02 0.28 2.86 -1.49 -0.16 114.93 117.99 1gdh h MET 299 Ca 0.26 -0.07 -0.21 0.00 -2.06 0.00 0.00 59.70 57.63 1gdh h MET 299 Cb 0.26 -0.26 0.02 0.00 0.06 0.00 0.00 31.60 31.68 1gdh h MET 299 CO -0.24 0.77 -0.79 0.00 1.06 0.00 0.00 176.91 177.71 1gdh h ALA 300 N 1.44 0.12 -0.43 6.32 0.00 -1.23 0.41 119.26 125.89 1gdh h ALA 300 Ca 0.34 -0.62 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 1gdh h ALA 300 Cb -0.09 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1gdh h ALA 300 CO -0.09 0.51 0.15 0.45 0.00 0.00 0.00 179.25 180.28 1gdh h HIS 301 N 0.15 0.61 -0.16 0.00 -0.00 -0.52 -0.78 115.15 114.46 1gdh h HIS 301 Ca -0.09 -0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.22 1gdh h HIS 301 Cb 1.47 -0.19 -0.01 0.00 -0.00 0.00 0.00 27.41 28.68 1gdh h HIS 301 CO 0.12 0.50 0.01 1.96 -0.00 0.00 0.00 177.93 180.52 1gdh h GLN 302 N 0.61 0.27 0.00 2.45 4.20 -0.73 0.26 115.11 122.18 1gdh h GLN 302 Ca 0.15 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1gdh h GLN 302 Cb 0.16 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1gdh h GLN 302 CO -0.01 0.48 0.00 0.00 -0.67 0.00 0.00 178.83 178.63 1gdh h ALA 303 N 0.78 1.00 0.14 3.87 0.00 -0.68 -2.51 119.26 121.86 1gdh h ALA 303 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.62 1gdh h ALA 303 Cb 0.36 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1gdh h ALA 303 CO 0.01 0.00 -1.69 -0.91 0.00 0.00 0.00 179.25 176.66 1gdh h ASN 304 N 0.00 0.47 -0.91 0.00 2.35 -0.09 -3.30 115.58 114.10 1gdh h ASN 304 Ca 0.00 -0.72 0.15 0.00 -0.55 0.00 0.00 56.30 55.18 1gdh h ASN 304 Cb 0.21 -0.15 -0.07 0.00 0.05 0.00 0.00 38.32 38.36 1gdh h ASN 304 CO 0.00 1.61 0.58 0.44 -1.65 0.00 0.00 177.43 178.42 1gdh h ASP 305 N 0.08 0.66 0.73 5.81 3.32 -0.11 -0.63 116.42 126.28 1gdh h ASP 305 Ca -0.31 0.05 -0.04 0.00 0.02 0.00 0.00 57.03 56.75 1gdh h ASP 305 Cb 2.06 -0.08 0.01 0.00 0.22 0.00 0.00 39.33 41.53 1gdh h ASP 305 CO 0.16 0.32 -0.35 -0.07 -1.72 0.00 0.00 179.24 177.57 1gdh h LEU 306 N 0.69 -0.83 -0.48 1.55 3.38 -1.54 -2.04 115.31 116.04 1gdh h LEU 306 Ca 0.47 0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.53 1gdh h LEU 306 Cb 0.77 0.21 -0.10 0.00 0.09 0.00 0.00 40.66 41.64 1gdh h LEU 306 CO -0.22 -0.48 -0.37 0.40 0.09 0.00 0.00 178.44 177.86 1gdh h ILE 307 N -1.18 0.16 -0.91 1.22 2.04 -1.61 -1.14 117.51 116.09 1gdh h ILE 307 Ca -0.10 0.00 0.22 0.00 1.00 0.00 0.00 64.86 65.98 1gdh h ILE 307 Cb 0.77 0.16 -0.17 0.00 -0.74 0.00 0.00 36.82 36.85 1gdh h ILE 307 CO 0.16 0.00 -0.07 0.44 0.00 0.00 0.00 178.15 178.69 1gdh h ASP 308 N -0.24 -0.58 1.57 1.72 5.19 -1.09 -0.98 116.42 122.00 1gdh h ASP 308 Ca 0.18 0.26 -0.06 0.00 -0.62 0.00 0.00 57.03 56.79 1gdh h ASP 308 Cb 0.56 0.48 -0.01 0.00 0.18 0.00 0.00 39.33 40.54 1gdh h ASP 308 CO -0.61 -0.30 -0.27 0.00 -3.12 0.00 0.00 179.24 174.94 1gdh h ALA 309 N 1.90 0.85 0.57 3.45 0.00 -0.47 -0.20 119.26 125.36 1gdh h ALA 309 Ca 0.50 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 1gdh h ALA 309 Cb 0.92 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.67 1gdh h ALA 309 CO -0.87 0.34 -0.27 1.25 0.00 0.00 0.00 179.25 179.69 1gdh h LEU 310 N 0.00 -0.65 -2.23 0.00 7.12 -0.42 0.35 115.31 119.48 1gdh h LEU 310 Ca -0.00 -0.02 0.00 0.00 0.13 0.00 0.00 57.88 57.98 1gdh h LEU 310 Cb 1.13 0.17 0.00 0.00 -0.53 0.00 0.00 40.66 41.43 1gdh h LEU 310 CO 0.04 -0.27 0.00 -0.26 -0.13 0.00 0.00 178.44 177.82 1gdh h PHE 311 N -1.12 0.00 -0.00 1.25 0.04 -1.37 0.34 116.94 116.07 1gdh h PHE 311 Ca -0.08 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.69 1gdh h PHE 311 Cb 0.64 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.79 1gdh h PHE 311 CO 0.01 0.00 -0.30 0.41 -0.60 0.00 0.00 178.31 177.82 1gdh n GLY 312 N -0.74 -0.96 2.33 -1.45 0.00 -0.09 -4.96 105.19 99.33 1gdh n GLY 312 Ca -0.01 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.56 1gdh n GLY 312 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gdh n GLY 313 N 1.40 0.18 3.61 -0.02 0.00 0.12 -5.02 105.19 105.45 1gdh n GLY 313 Ca 0.10 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 1gdh n GLY 313 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gdh n ALA 314 N -2.77 0.50 -1.93 4.61 0.00 0.08 -5.05 120.51 115.96 1gdh n ALA 314 Ca -0.04 -2.25 -0.41 0.00 0.00 0.00 0.00 53.44 50.74 1gdh n ALA 314 Cb 0.55 1.35 -0.04 0.00 0.00 0.00 0.00 19.45 21.30 1gdh n ALA 314 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1gdh s ASP 315 N -3.74 7.25 0.26 0.00 1.11 -1.26 -4.35 116.67 115.94 1gdh s ASP 315 Ca 0.09 2.17 -0.31 0.00 0.18 0.00 0.00 52.55 54.68 1gdh s ASP 315 Cb 0.00 -2.61 -0.12 0.00 1.07 0.00 0.00 42.92 41.26 1gdh s ASP 315 CO 0.06 -0.20 1.57 0.23 1.18 0.00 0.00 175.17 178.02 1gdh n MET 316 N 1.90 2.52 0.01 8.23 2.81 -1.26 -4.89 117.12 126.44 1gdh n MET 316 Ca 0.01 0.90 0.01 0.00 -1.81 0.00 0.00 57.70 56.81 1gdh n MET 316 Cb 0.45 -2.66 0.32 0.00 -0.71 0.00 0.00 33.22 30.62 1gdh n MET 316 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 1gdh h SER 317 N 5.04 0.46 -2.23 7.83 0.02 -1.88 -2.88 113.55 119.92 1gdh h SER 317 Ca -0.46 -0.08 -0.58 0.00 -0.84 0.00 0.00 61.79 59.83 1gdh h SER 317 Cb 1.23 -0.12 -0.42 0.00 0.14 0.00 0.00 62.40 63.24 1gdh h SER 317 CO 0.82 0.52 -0.68 -1.22 -1.14 0.00 0.00 176.83 175.12 1gdh n TYR 318 N -4.30 3.48 -1.94 3.45 4.01 -1.26 -5.06 117.16 115.54 1gdh n TYR 318 Ca 0.01 -4.02 -0.43 0.00 -0.16 0.00 0.00 57.90 53.31 1gdh n TYR 318 Cb 0.23 -0.50 -0.03 0.00 -0.31 0.00 0.00 39.34 38.73 1gdh n TYR 318 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1gdh s ALA 319 N -3.00 2.97 -0.10 -0.72 0.00 -1.09 -1.57 121.76 118.26 1gdh s ALA 319 Ca 0.45 0.45 -0.08 0.00 0.00 0.00 0.00 51.96 52.78 1gdh s ALA 319 Cb 0.24 -3.98 -0.27 0.00 0.00 0.00 0.00 23.12 19.11 1gdh s ALA 319 CO -0.09 -2.45 0.43 -0.07 0.00 0.00 0.00 175.76 173.58 1gdh h LEU 320 N 13.30 0.46 -0.59 0.00 3.38 -1.24 -3.48 115.31 127.13 1gdh h LEU 320 Ca -0.36 -0.95 0.00 0.00 0.09 0.00 0.00 57.88 56.66 1gdh h LEU 320 Cb 1.18 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1gdh h LEU 320 CO 1.01 1.85 0.00 0.00 0.09 0.00 0.00 178.44 181.38