#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uph n ALA 3 N 0.00 2.45 -2.32 4.61 0.00 -1.26 -4.97 120.51 119.02 1uph n ALA 3 Ca 0.00 -0.14 -0.43 0.00 0.00 0.00 0.00 53.44 52.87 1uph n ALA 3 Cb 0.00 0.13 -0.02 0.00 0.00 0.00 0.00 19.45 19.56 1uph n ALA 3 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1uph s ARG 4 N -1.79 3.77 0.89 0.00 3.00 -1.26 -5.00 118.95 118.56 1uph s ARG 4 Ca -0.04 1.25 -0.14 0.00 0.00 0.00 0.00 55.73 56.80 1uph s ARG 4 Cb 0.01 -3.96 0.15 0.00 0.00 0.00 0.00 34.95 31.14 1uph s ARG 4 CO 0.06 -1.31 1.25 0.00 0.00 0.00 0.00 175.30 175.31 1uph s ALA 5 N 4.94 2.45 -0.38 2.13 0.00 -1.26 -5.03 121.76 124.61 1uph s ALA 5 Ca 0.62 -0.99 0.12 0.00 0.00 0.00 0.00 51.96 51.70 1uph s ALA 5 Cb -0.18 -2.83 0.43 0.00 0.00 0.00 0.00 23.12 20.55 1uph s ALA 5 CO 0.27 -2.09 1.00 0.43 0.00 0.00 0.00 175.76 175.38 1uph n SER 6 N -3.55 2.88 0.00 0.00 7.64 -1.26 -4.89 113.62 114.44 1uph n SER 6 Ca 0.12 -3.18 0.00 0.00 1.01 0.00 0.00 58.87 56.82 1uph n SER 6 Cb 0.60 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 1uph n SER 6 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1uph n VAL 7 N -0.22 0.00 -4.41 0.44 0.31 -1.26 -4.17 118.33 109.02 1uph n VAL 7 Ca 0.23 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.35 1uph n VAL 7 Cb 0.73 -0.42 -0.09 0.00 -0.91 0.00 0.00 33.84 33.15 1uph n VAL 7 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1uph s LEU 8 N -2.54 1.86 0.00 7.52 1.43 -1.26 -4.84 118.68 120.85 1uph s LEU 8 Ca 0.00 -1.54 -0.17 0.00 -1.03 0.00 0.00 54.13 51.39 1uph s LEU 8 Cb 0.00 -0.03 0.24 0.00 0.03 0.00 0.00 46.19 46.43 1uph s LEU 8 CO 0.00 -0.83 1.23 -0.24 0.23 0.00 0.00 176.35 176.74 1uph n SER 9 N -0.94 -0.40 0.22 2.29 2.88 -1.26 -4.74 113.62 111.67 1uph n SER 9 Ca -0.02 -1.39 -0.15 0.00 -1.33 0.00 0.00 58.87 55.98 1uph n SER 9 Cb 0.65 -0.98 -0.07 0.00 -0.75 0.00 0.00 64.21 63.06 1uph n SER 9 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1uph h GLY 10 N -1.91 -0.74 0.55 0.46 0.00 -2.02 0.13 103.07 99.54 1uph h GLY 10 Ca -0.41 0.36 0.08 0.00 0.00 0.00 0.00 47.33 47.36 1uph h GLY 10 CO 0.29 -0.28 0.39 -1.33 0.00 0.00 0.00 176.54 175.60 1uph h GLY 11 N -0.68 1.08 1.26 4.60 0.00 -1.99 0.17 103.07 107.52 1uph h GLY 11 Ca -0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 1uph h GLY 11 CO -0.05 0.11 0.38 0.83 0.00 0.00 0.00 176.54 177.81 1uph h GLU 12 N 0.67 0.97 -0.25 4.80 4.39 -1.82 -0.60 114.58 122.75 1uph h GLU 12 Ca 0.34 -0.11 -0.07 0.00 0.34 0.00 0.00 59.36 59.87 1uph h GLU 12 Cb 0.31 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1uph h GLU 12 CO -0.24 0.72 -0.11 1.25 -1.16 0.00 0.00 179.01 179.47 1uph h LEU 13 N 0.98 0.52 -0.74 1.33 7.12 0.89 0.36 115.31 125.77 1uph h LEU 13 Ca 0.25 -0.40 0.07 0.00 0.13 0.00 0.00 57.88 57.92 1uph h LEU 13 Cb 0.03 -0.14 -0.06 0.00 -0.53 0.00 0.00 40.66 39.96 1uph h LEU 13 CO -0.04 0.81 0.42 -0.78 -0.13 0.00 0.00 178.44 178.72 1uph h ASP 14 N 0.23 0.62 -0.30 1.25 1.82 -0.19 0.17 116.42 120.02 1uph h ASP 14 Ca 0.06 0.03 -0.17 0.00 -0.39 0.00 0.00 57.03 56.56 1uph h ASP 14 Cb 0.61 -0.09 -0.00 0.00 0.68 0.00 0.00 39.33 40.53 1uph h ASP 14 CO 0.03 0.38 -0.48 0.11 -1.61 0.00 0.00 179.24 177.67 1uph h LYS 15 N 0.75 0.85 -0.35 0.28 1.57 -0.96 -2.62 116.57 116.10 1uph h LYS 15 Ca 0.34 -0.52 0.08 0.00 -1.87 0.00 0.00 60.65 58.68 1uph h LYS 15 Cb 0.24 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 1uph h LYS 15 CO -0.20 1.16 0.25 2.35 -0.57 0.00 0.00 179.45 182.43 1uph h TRP 16 N 0.63 0.10 -0.54 -1.35 2.91 0.92 0.38 115.95 119.00 1uph h TRP 16 Ca 0.02 0.00 -0.29 0.00 1.13 0.00 0.00 58.89 59.76 1uph h TRP 16 Cb 1.09 -0.03 -0.17 0.00 -0.51 0.00 0.00 29.16 29.54 1uph h TRP 16 CO 0.07 0.05 0.36 -1.91 -1.03 0.00 0.00 178.44 175.99 1uph n GLU 17 N -4.46 1.69 0.00 2.65 2.13 0.48 -3.44 120.64 119.69 1uph n GLU 17 Ca 0.05 -1.64 0.00 0.00 0.66 0.00 0.00 57.16 56.24 1uph n GLU 17 Cb 0.36 -1.64 0.00 0.00 0.27 0.00 0.00 31.44 30.43 1uph n GLU 17 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1uph n LYS 18 N -0.36 1.90 -3.13 5.31 4.81 0.13 -4.61 118.16 122.21 1uph n LYS 18 Ca 0.33 -0.33 -0.39 0.00 -0.87 0.00 0.00 58.31 57.04 1uph n LYS 18 Cb 1.11 -0.83 -0.06 0.00 0.02 0.00 0.00 35.03 35.27 1uph n LYS 18 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1uph s ILE 19 N -0.39 4.70 -0.00 3.15 1.09 -1.22 -4.70 121.20 123.82 1uph s ILE 19 Ca 0.00 1.42 -0.01 0.00 -1.10 0.00 0.00 60.65 60.96 1uph s ILE 19 Cb 0.00 -4.00 -0.04 0.00 -1.06 0.00 0.00 42.46 37.36 1uph s ILE 19 CO 0.01 0.47 0.09 -0.13 -0.10 0.00 0.00 174.94 175.28 1uph s ARG 20 N -0.67 3.10 0.03 2.79 0.52 0.10 -0.69 118.95 124.14 1uph s ARG 20 Ca 0.33 -0.47 -0.14 0.00 -0.52 0.00 0.00 55.73 54.93 1uph s ARG 20 Cb -0.20 -2.88 -0.34 0.00 0.52 0.00 0.00 34.95 32.04 1uph s ARG 20 CO 0.21 0.65 1.01 -0.07 0.02 0.00 0.00 175.30 177.12 1uph h LEU 21 N 4.05 0.77 -9.97 2.53 3.38 -1.53 0.31 115.31 114.85 1uph h LEU 21 Ca -0.49 -0.84 -0.58 0.00 0.09 0.00 0.00 57.88 56.06 1uph h LEU 21 Cb 1.18 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.65 1uph h LEU 21 CO 0.63 1.66 -0.45 -0.13 0.09 0.00 0.00 178.44 180.24 1uph s ARG 22 N -2.61 3.47 0.08 1.13 0.52 -1.26 -4.48 118.95 115.80 1uph s ARG 22 Ca -0.08 -0.43 -0.14 0.00 -0.52 0.00 0.00 55.73 54.55 1uph s ARG 22 Cb 0.05 -2.97 -0.20 0.00 0.52 0.00 0.00 34.95 32.34 1uph s ARG 22 CO 0.93 0.54 1.23 -1.00 0.02 0.00 0.00 175.30 177.03 1uph h PRO 23 N 2.65 0.73 -0.00 3.54 0.13 -1.99 -3.15 132.00 133.91 1uph h PRO 23 Ca -0.46 -0.70 0.00 0.00 -0.87 0.00 0.00 66.00 63.96 1uph h PRO 23 Cb 1.17 0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.48 1uph h PRO 23 CO 0.73 1.29 -0.24 0.41 -0.23 0.00 0.00 178.00 179.96 1uph n GLY 24 N 0.94 -1.37 0.00 1.56 0.00 -1.26 -5.03 105.19 100.03 1uph n GLY 24 Ca -0.10 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1uph n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uph n GLY 25 N 1.49 2.34 0.00 -0.02 0.00 -1.19 -5.10 105.19 102.71 1uph n GLY 25 Ca 0.06 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.99 1uph n GLY 25 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1uph n LYS 26 N -0.29 0.00 -3.53 1.61 3.00 -1.26 -4.57 118.16 113.12 1uph n LYS 26 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.23 1uph n LYS 26 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.01 1uph n LYS 26 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 1uph s LYS 27 N 0.00 0.72 0.41 1.64 -2.85 -1.26 -5.06 119.74 113.34 1uph s LYS 27 Ca 0.00 -0.21 0.07 0.00 -1.00 0.00 0.00 55.97 54.83 1uph s LYS 27 Cb 0.00 0.33 -0.06 0.00 -2.06 0.00 0.00 37.83 36.04 1uph s LYS 27 CO 0.00 -0.30 0.10 -0.65 0.10 0.00 0.00 175.35 174.60 1uph s GLN 28 N -2.74 2.10 1.14 1.78 -0.21 -1.26 -1.33 119.66 119.14 1uph s GLN 28 Ca 0.05 -1.98 -0.13 0.00 0.02 0.00 0.00 55.36 53.32 1uph s GLN 28 Cb -0.01 -1.82 0.27 0.00 1.00 0.00 0.00 33.01 32.45 1uph s GLN 28 CO -0.07 -0.09 1.04 0.71 -2.12 0.00 0.00 175.29 174.76 1uph s TYR 29 N -2.66 1.52 0.01 0.91 1.51 0.13 -4.92 117.35 113.85 1uph s TYR 29 Ca 0.38 1.10 -0.26 0.00 -1.01 0.00 0.00 57.07 57.28 1uph s TYR 29 Cb 0.07 -3.14 0.09 0.00 -0.11 0.00 0.00 41.96 38.87 1uph s TYR 29 CO 0.20 -3.69 1.19 0.36 -1.11 0.00 0.00 175.55 172.50 1uph n LYS 30 N -4.77 0.24 0.29 -0.62 2.85 -1.26 -4.44 118.16 110.44 1uph n LYS 30 Ca 0.03 -0.83 0.18 0.00 -1.05 0.00 0.00 58.31 56.64 1uph n LYS 30 Cb 0.55 1.32 0.94 0.00 -0.65 0.00 0.00 35.03 37.19 1uph n LYS 30 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 1uph h LEU 31 N 0.00 0.00 -0.27 -5.58 7.12 -1.96 0.17 115.31 114.79 1uph h LEU 31 Ca -0.21 0.00 -0.05 0.00 0.13 0.00 0.00 57.88 57.75 1uph h LEU 31 Cb 1.12 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.24 1uph h LEU 31 CO 0.30 0.00 -0.05 0.50 -0.13 0.00 0.00 178.44 179.07 1uph h LYS 32 N 0.00 0.50 -0.18 1.25 3.64 -1.98 0.31 116.57 120.11 1uph h LYS 32 Ca 0.03 -0.18 -0.16 0.00 -1.27 0.00 0.00 60.65 59.07 1uph h LYS 32 Cb 0.44 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 1uph h LYS 32 CO -0.00 0.70 -0.54 0.45 -2.27 0.00 0.00 179.45 177.79 1uph h HIS 33 N 0.26 0.67 -0.47 1.91 3.86 -1.11 -0.31 115.15 119.95 1uph h HIS 33 Ca 0.07 -0.23 -0.07 0.00 -1.16 0.00 0.00 60.37 58.97 1uph h HIS 33 Cb 0.50 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.83 1uph h HIS 33 CO 0.05 0.96 0.01 0.82 0.86 0.00 0.00 177.93 180.62 1uph h ILE 34 N 0.41 1.26 -0.42 2.45 1.08 -1.03 0.19 117.51 121.45 1uph h ILE 34 Ca 0.01 -1.04 -0.11 0.00 -0.39 0.00 0.00 64.86 63.32 1uph h ILE 34 Cb 1.08 1.00 -0.02 0.00 -3.07 0.00 0.00 36.82 35.82 1uph h ILE 34 CO 0.10 0.36 -0.19 0.58 -0.69 0.00 0.00 178.15 178.31 1uph h VAL 35 N 0.68 1.27 -0.07 1.67 2.07 -0.26 0.29 116.25 121.90 1uph h VAL 35 Ca 0.14 -1.31 -0.01 0.00 0.82 0.00 0.00 66.70 66.34 1uph h VAL 35 Cb 0.49 1.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1uph h VAL 35 CO 0.02 0.44 0.02 -0.25 0.02 0.00 0.00 177.57 177.83 1uph h TRP 36 N 0.72 0.11 -0.65 1.57 7.01 -0.73 0.10 115.95 124.08 1uph h TRP 36 Ca 0.10 -0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.12 1uph h TRP 36 Cb 0.71 -0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 27.71 1uph h TRP 36 CO 0.04 0.26 0.43 0.00 -2.79 0.00 0.00 178.44 176.38 1uph h ALA 37 N 0.84 1.61 -0.58 2.65 0.00 -0.44 -0.73 119.26 122.62 1uph h ALA 37 Ca 0.02 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1uph h ALA 37 Cb 0.20 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1uph h ALA 37 CO -0.00 0.33 0.14 1.03 0.00 0.00 0.00 179.25 180.74 1uph h SER 38 N 0.80 0.88 -0.57 0.00 0.87 -0.37 0.23 113.55 115.40 1uph h SER 38 Ca 0.25 -0.24 -0.03 0.00 -1.23 0.00 0.00 61.79 60.55 1uph h SER 38 Cb 0.03 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 61.73 1uph h SER 38 CO -0.07 0.89 0.25 -0.09 -0.53 0.00 0.00 176.83 177.28 1uph h ARG 39 N 0.84 0.84 -0.41 2.24 2.43 0.25 -1.23 114.38 119.33 1uph h ARG 39 Ca 0.18 -0.14 -0.13 0.00 -0.81 0.00 0.00 59.98 59.08 1uph h ARG 39 Cb 0.35 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1uph h ARG 39 CO 0.00 0.70 -0.26 1.49 -1.51 0.00 0.00 179.97 180.40 1uph h GLU 40 N 0.77 0.86 -0.09 0.20 4.57 -0.92 -0.51 114.58 119.46 1uph h GLU 40 Ca 0.19 -0.38 0.02 0.00 -1.18 0.00 0.00 59.36 58.02 1uph h GLU 40 Cb 0.16 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.71 1uph h GLU 40 CO -0.02 1.02 -0.03 -0.07 -1.18 0.00 0.00 179.01 178.73 1uph h LEU 41 N 0.74 -0.11 -0.88 1.64 -0.00 -0.18 0.47 115.31 116.99 1uph h LEU 41 Ca 0.09 0.03 -0.07 0.00 -0.00 0.00 0.00 57.88 57.93 1uph h LEU 41 Cb 0.80 0.07 -0.02 0.00 -0.00 0.00 0.00 40.66 41.51 1uph h LEU 41 CO 0.07 -0.04 0.07 -0.08 -0.00 0.00 0.00 178.44 178.46 1uph h GLU 42 N -0.01 0.90 0.00 1.13 4.57 -1.13 -1.55 114.58 118.49 1uph h GLU 42 Ca 0.05 -0.22 -0.01 0.00 -1.18 0.00 0.00 59.36 57.99 1uph h GLU 42 Cb 0.08 -0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 28.56 1uph h GLU 42 CO -0.10 0.85 -0.07 0.00 -1.18 0.00 0.00 179.01 178.51 1uph h ARG 43 N 0.85 0.00 -0.37 1.92 2.47 -0.36 -2.03 114.38 116.85 1uph h ARG 43 Ca 0.17 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.89 1uph h ARG 43 Cb 0.40 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.72 1uph h ARG 43 CO 0.01 0.07 0.00 1.19 0.56 0.00 0.00 179.97 181.80 1uph n PHE 44 N -3.21 0.31 -2.68 3.04 3.01 0.16 -4.85 117.46 113.24 1uph n PHE 44 Ca 0.00 -0.13 -0.21 0.00 1.01 0.00 0.00 57.45 58.12 1uph n PHE 44 Cb 0.32 -0.05 0.01 0.00 -0.01 0.00 0.00 39.48 39.75 1uph n PHE 44 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1uph n ALA 45 N 0.06 -0.79 -2.53 4.37 0.00 -0.76 -4.97 120.51 115.89 1uph n ALA 45 Ca 0.06 0.20 -0.24 0.00 0.00 0.00 0.00 53.44 53.46 1uph n ALA 45 Cb 0.24 -2.76 -0.12 0.00 0.00 0.00 0.00 19.45 16.80 1uph n ALA 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1uph s VAL 46 N -3.04 1.74 0.23 0.00 0.11 -0.94 -5.06 120.40 113.44 1uph s VAL 46 Ca 0.13 -1.58 -0.30 0.00 -2.93 0.00 0.00 61.98 57.30 1uph s VAL 46 Cb -0.06 -1.59 -0.09 0.00 -1.53 0.00 0.00 36.38 33.11 1uph s VAL 46 CO 0.16 -0.08 1.08 0.20 -3.33 0.00 0.00 175.10 173.14 1uph s ASN 47 N -1.97 7.31 0.14 3.54 0.01 -1.26 -3.70 114.94 119.00 1uph s ASN 47 Ca 0.07 2.15 -0.05 0.00 -0.71 0.00 0.00 52.86 54.32 1uph s ASN 47 Cb -0.10 -2.61 -0.06 0.00 0.41 0.00 0.00 41.25 38.89 1uph s ASN 47 CO 0.04 -0.14 1.34 1.55 -1.51 0.00 0.00 177.10 178.38 1uph h PRO 48 N 4.46 0.46 -0.35 -0.60 0.13 -1.92 -3.18 132.00 131.01 1uph h PRO 48 Ca -0.45 -0.45 -0.05 0.00 -0.87 0.00 0.00 66.00 64.18 1uph h PRO 48 Cb 1.21 0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.44 1uph h PRO 48 CO 0.70 1.09 0.02 0.78 -0.23 0.00 0.00 178.00 180.36 1uph h GLY 49 N 1.14 0.57 2.00 1.56 0.00 -1.92 -0.43 103.07 105.99 1uph h GLY 49 Ca -0.07 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 46.94 1uph h GLY 49 CO 0.15 0.31 0.00 -2.00 0.00 0.00 0.00 176.54 175.00 1uph h LEU 50 N 0.51 0.00 -0.96 3.11 7.12 -1.92 0.24 115.31 123.42 1uph h LEU 50 Ca 0.11 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.12 1uph h LEU 50 Cb 0.30 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.43 1uph h LEU 50 CO 0.01 0.00 -0.03 0.00 -0.13 0.00 0.00 178.44 178.29 1uph n LEU 51 N -2.31 1.51 0.00 2.25 -0.00 -0.17 -3.67 117.00 114.61 1uph n LEU 51 Ca 0.00 -0.50 0.12 0.00 -0.00 0.00 0.00 56.01 55.64 1uph n LEU 51 Cb 0.15 -0.01 0.65 0.00 -0.00 0.00 0.00 43.42 44.20 1uph n LEU 51 CO 0.16 0.25 0.92 -1.84 -0.00 0.00 0.00 177.39 176.88 1uph n GLU 52 N 0.14 0.42 -4.55 1.47 0.28 0.84 -4.28 120.64 114.96 1uph n GLU 52 Ca 0.18 0.04 -0.32 0.00 -0.16 0.00 0.00 57.16 56.90 1uph n GLU 52 Cb 0.36 -1.50 -0.11 0.00 1.43 0.00 0.00 31.44 31.62 1uph n GLU 52 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 1uph s THR 53 N -2.48 3.46 0.44 3.84 -4.23 -1.24 -4.85 115.64 110.57 1uph s THR 53 Ca 0.26 -0.80 0.14 0.00 -1.18 0.00 0.00 61.69 60.10 1uph s THR 53 Cb 0.17 -2.47 0.32 0.00 1.34 0.00 0.00 72.50 71.86 1uph s THR 53 CO 0.37 0.43 2.00 -1.28 -0.54 0.00 0.00 174.62 175.59 1uph h SER 54 N 4.68 0.34 -0.29 3.99 0.87 -1.89 0.26 113.55 121.52 1uph h SER 54 Ca -0.48 0.01 -0.14 0.00 -1.23 0.00 0.00 61.79 59.95 1uph h SER 54 Cb 1.16 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1uph h SER 54 CO 0.52 0.21 -0.36 -0.08 -0.53 0.00 0.00 176.83 176.60 1uph h GLU 55 N 0.38 0.75 -0.49 2.24 4.81 -1.94 -1.10 114.58 119.23 1uph h GLU 55 Ca 0.25 -0.42 -0.13 0.00 -0.13 0.00 0.00 59.36 58.93 1uph h GLU 55 Cb 0.47 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 1uph h GLU 55 CO -0.06 1.05 -0.20 0.78 -0.73 0.00 0.00 179.01 179.84 1uph h GLY 56 N 0.50 1.08 0.93 1.92 0.00 -1.26 0.31 103.07 106.55 1uph h GLY 56 Ca 0.04 -0.95 -0.03 0.00 0.00 0.00 0.00 47.33 46.39 1uph h GLY 56 CO 0.09 0.86 0.12 0.00 0.00 0.00 0.00 176.54 177.60 1uph h ARG 58 N 0.46 0.61 0.11 0.00 2.43 -1.05 -1.38 114.38 115.56 1uph h ARG 58 Ca 0.12 -0.24 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 1uph h ARG 58 Cb 0.25 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 1uph h ARG 58 CO -0.00 0.81 -0.05 1.96 -1.51 0.00 0.00 179.97 181.17 1uph h GLN 59 N 0.54 -0.14 -0.04 0.20 1.08 0.04 0.22 115.11 117.01 1uph h GLN 59 Ca 0.07 0.01 0.01 0.00 -1.45 0.00 0.00 58.65 57.29 1uph h GLN 59 Cb 0.72 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.17 1uph h GLN 59 CO 0.05 0.01 -0.02 0.82 -0.95 0.00 0.00 178.83 178.74 1uph h ILE 60 N -0.26 0.94 -0.84 2.54 2.04 -0.89 0.45 117.51 121.48 1uph h ILE 60 Ca -0.01 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.94 1uph h ILE 60 Cb 0.21 0.94 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 1uph h ILE 60 CO 0.02 0.00 0.55 0.25 0.00 0.00 0.00 178.15 178.97 1uph h LEU 61 N -0.02 0.73 -0.61 1.44 5.85 -1.12 0.28 115.31 121.86 1uph h LEU 61 Ca 0.02 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 1uph h LEU 61 Cb 0.05 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 1uph h LEU 61 CO -0.05 0.43 -0.29 1.23 -0.34 0.00 0.00 178.44 179.43 1uph h GLY 62 N 0.81 0.00 1.09 3.75 0.00 0.54 0.70 103.07 109.94 1uph h GLY 62 Ca 0.39 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.52 1uph h GLY 62 CO -0.16 0.00 -0.73 -1.61 0.00 0.00 0.00 176.54 174.04 1uph h GLN 63 N 0.00 0.71 0.00 4.80 4.15 0.34 -3.19 115.11 121.91 1uph h GLN 63 Ca -0.00 -0.60 0.00 0.00 0.77 0.00 0.00 58.65 58.82 1uph h GLN 63 Cb 0.99 0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.81 1uph h GLN 63 CO 0.04 1.21 -0.80 1.47 -1.93 0.00 0.00 178.83 178.82 1uph n LEU 64 N -4.02 0.71 -0.35 -2.39 -0.00 -0.25 -4.36 117.00 106.34 1uph n LEU 64 Ca -0.08 -0.20 0.01 0.00 -0.00 0.00 0.00 56.01 55.75 1uph n LEU 64 Cb 0.72 -0.12 0.07 0.00 -0.00 0.00 0.00 43.42 44.08 1uph n LEU 64 CO 0.51 0.16 0.56 0.00 -0.00 0.00 0.00 177.39 178.62 1uph n GLN 65 N -1.59 -0.17 0.09 1.47 1.13 0.24 0.13 117.38 118.69 1uph n GLN 65 Ca 0.04 1.42 -0.06 0.00 -1.94 0.00 0.00 57.00 56.46 1uph n GLN 65 Cb 0.35 -2.11 0.04 0.00 0.11 0.00 0.00 30.24 28.63 1uph n GLN 65 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1uph h PRO 66 N 0.00 0.14 0.00 -1.09 0.13 -1.76 -2.96 132.00 126.46 1uph h PRO 66 Ca 0.36 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 65.35 1uph h PRO 66 Cb 0.59 0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.76 1uph h PRO 66 CO -0.92 0.86 0.13 1.03 -0.23 0.00 0.00 178.00 178.87 1uph h SER 67 N 0.09 0.00 -0.55 1.44 0.87 0.93 0.94 113.55 117.27 1uph h SER 67 Ca -0.03 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.46 1uph h SER 67 Cb 1.38 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.32 1uph h SER 67 CO 0.12 0.00 0.07 -0.07 -0.53 0.00 0.00 176.83 176.42 1uph h LEU 68 N 0.00 0.90 -0.11 2.23 3.38 -0.93 0.43 115.31 121.21 1uph h LEU 68 Ca 0.00 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.71 1uph h LEU 68 Cb 0.25 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1uph h LEU 68 CO 0.00 0.94 -0.06 1.67 0.09 0.00 0.00 178.44 181.08 1uph n GLN 69 N -4.33 -0.05 -1.47 1.13 0.00 0.33 -1.50 117.38 111.49 1uph n GLN 69 Ca 0.02 0.90 -0.21 0.00 -0.00 0.00 0.00 57.00 57.71 1uph n GLN 69 Cb 0.28 -1.34 0.09 0.00 0.00 0.00 0.00 30.24 29.28 1uph n GLN 69 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 1uph n THR 70 N -3.13 2.83 -1.87 1.69 5.66 -1.23 -5.02 114.28 113.21 1uph n THR 70 Ca 0.00 -3.43 -0.19 0.00 -3.05 0.00 0.00 64.05 57.37 1uph n THR 70 Cb 0.03 -0.89 0.13 0.00 -1.55 0.00 0.00 70.33 68.05 1uph n THR 70 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1uph n GLY 71 N -0.90 -0.85 3.98 1.09 0.00 0.15 -5.07 105.19 103.59 1uph n GLY 71 Ca 0.46 -1.78 -0.19 0.00 0.00 0.00 0.00 46.02 44.51 1uph n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uph s SER 72 N -4.27 5.78 0.23 1.61 1.04 -1.26 -4.93 113.70 111.90 1uph s SER 72 Ca 0.51 -0.30 -0.07 0.00 0.48 0.00 0.00 55.95 56.57 1uph s SER 72 Cb -0.02 -1.03 0.32 0.00 0.10 0.00 0.00 66.02 65.39 1uph s SER 72 CO 0.35 -0.52 1.82 -0.33 0.98 0.00 0.00 173.24 175.54 1uph h GLU 73 N 0.87 0.77 -0.28 4.02 4.39 -1.98 0.18 114.58 122.54 1uph h GLU 73 Ca -0.44 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.14 1uph h GLU 73 Cb 1.26 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.73 1uph h GLU 73 CO 0.51 0.51 -0.10 0.93 -1.16 0.00 0.00 179.01 179.70 1uph h GLU 74 N 0.79 0.56 -0.67 2.33 3.07 -1.99 -1.55 114.58 117.13 1uph h GLU 74 Ca 0.35 -0.23 0.06 0.00 -0.50 0.00 0.00 59.36 59.04 1uph h GLU 74 Cb 0.24 -0.02 -0.05 0.00 -0.84 0.00 0.00 28.75 28.07 1uph h GLU 74 CO -0.20 0.78 0.37 1.25 -1.40 0.00 0.00 179.01 179.82 1uph h LEU 75 N 0.31 0.56 0.16 1.33 6.46 -1.74 0.55 115.31 122.94 1uph h LEU 75 Ca 0.07 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 57.85 1uph h LEU 75 Cb 0.60 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 40.44 1uph h LEU 75 CO 0.03 0.37 -0.08 0.03 -0.62 0.00 0.00 178.44 178.17 1uph h ARG 76 N 0.70 -0.21 -0.69 1.25 3.08 -0.53 -0.75 114.38 117.22 1uph h ARG 76 Ca 0.30 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.48 1uph h ARG 76 Cb 0.17 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.22 1uph h ARG 76 CO -0.17 -0.10 0.46 1.03 -1.07 0.00 0.00 179.97 180.12 1uph h SER 77 N -0.27 0.40 -0.18 7.04 0.87 -0.73 -0.03 113.55 120.65 1uph h SER 77 Ca -0.02 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.52 1uph h SER 77 Cb 0.21 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 1uph h SER 77 CO 0.04 0.22 -0.02 0.25 -0.53 0.00 0.00 176.83 176.79 1uph h LEU 78 N 0.43 0.33 -0.75 2.23 7.12 -0.24 -1.01 115.31 123.42 1uph h LEU 78 Ca 0.33 -0.33 0.06 0.00 0.13 0.00 0.00 57.88 58.07 1uph h LEU 78 Cb 0.70 -0.09 -0.06 0.00 -0.53 0.00 0.00 40.66 40.68 1uph h LEU 78 CO -0.10 0.58 0.44 0.22 -0.13 0.00 0.00 178.44 179.45 1uph h TYR 79 N 0.07 0.82 -0.47 1.25 3.20 0.41 0.24 116.97 122.49 1uph h TYR 79 Ca 0.05 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.91 1uph h TYR 79 Cb 0.42 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 1uph h TYR 79 CO 0.04 0.40 0.16 -0.91 -1.64 0.00 0.00 178.16 176.21 1uph h ASN 80 N 0.81 0.67 -0.31 -2.11 2.35 -1.06 0.15 115.58 116.08 1uph h ASN 80 Ca 0.33 -0.19 -0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1uph h ASN 80 Cb 0.18 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 1uph h ASN 80 CO -0.18 0.69 0.19 0.74 -1.65 0.00 0.00 177.43 177.22 1uph h THR 81 N 0.62 1.11 -0.86 2.81 2.02 -0.22 -1.03 112.91 117.35 1uph h THR 81 Ca 0.15 -0.24 0.01 0.00 0.77 0.00 0.00 66.41 67.10 1uph h THR 81 Cb 0.24 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 67.32 1uph h THR 81 CO -0.01 0.10 0.57 0.40 0.37 0.00 0.00 175.52 176.95 1uph h ILE 82 N 0.40 1.22 -0.23 3.11 2.04 -0.32 0.17 117.51 123.91 1uph h ILE 82 Ca 0.11 -0.41 0.03 0.00 1.00 0.00 0.00 64.86 65.59 1uph h ILE 82 Cb 0.00 -0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.01 1uph h ILE 82 CO -0.02 0.22 0.02 0.00 0.00 0.00 0.00 178.15 178.36 1uph h ALA 83 N 1.31 0.21 -0.78 1.87 0.00 -0.41 0.32 119.26 121.77 1uph h ALA 83 Ca 0.31 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.25 1uph h ALA 83 Cb -0.13 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1uph h ALA 83 CO -0.07 -0.41 0.38 0.28 0.00 0.00 0.00 179.25 179.43 1uph h VAL 84 N 0.10 1.25 -0.63 0.00 2.07 -0.56 -0.94 116.25 117.53 1uph h VAL 84 Ca 0.11 -0.70 0.02 0.00 0.82 0.00 0.00 66.70 66.95 1uph h VAL 84 Cb 0.12 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.11 1uph h VAL 84 CO -0.16 0.30 0.40 0.25 0.02 0.00 0.00 177.57 178.37 1uph h LEU 85 N 1.11 0.66 -0.44 2.57 7.12 0.33 -0.70 115.31 125.96 1uph h LEU 85 Ca 0.27 -0.00 -0.01 0.00 0.13 0.00 0.00 57.88 58.27 1uph h LEU 85 Cb 0.12 -0.15 -0.02 0.00 -0.53 0.00 0.00 40.66 40.08 1uph h LEU 85 CO -0.03 0.46 0.23 0.22 -0.13 0.00 0.00 178.44 179.19 1uph h TYR 86 N 0.79 0.61 -0.90 1.25 3.20 0.21 0.48 116.97 122.61 1uph h TYR 86 Ca 0.25 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.17 1uph h TYR 86 Cb -0.01 -0.19 -0.06 0.00 1.54 0.00 0.00 36.73 38.00 1uph h TYR 86 CO -0.05 0.47 0.56 0.00 -1.64 0.00 0.00 178.16 177.51 1uph h VAL 88 N 1.02 1.25 -0.83 0.00 2.07 -0.52 0.94 116.25 120.18 1uph h VAL 88 Ca 0.40 -1.12 -0.02 0.00 0.82 0.00 0.00 66.70 66.78 1uph h VAL 88 Cb 0.19 1.01 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 1uph h VAL 88 CO -0.18 0.38 0.42 0.45 0.02 0.00 0.00 177.57 178.66 1uph h HIS 89 N 0.70 1.17 -0.01 1.57 -0.00 0.13 -0.74 115.15 117.98 1uph h HIS 89 Ca 0.12 -0.04 0.00 0.00 -0.00 0.00 0.00 60.37 60.45 1uph h HIS 89 Cb 0.55 -0.37 0.00 0.00 -0.00 0.00 0.00 27.41 27.59 1uph h HIS 89 CO 0.03 0.83 -0.17 1.04 -0.00 0.00 0.00 177.93 179.65 1uph n GLN 90 N -4.32 0.73 -2.55 2.45 6.02 -0.01 -4.85 117.38 114.86 1uph n GLN 90 Ca 0.08 -0.34 -0.08 0.00 -0.01 0.00 0.00 57.00 56.65 1uph n GLN 90 Cb 0.12 -1.49 0.04 0.00 1.02 0.00 0.00 30.24 29.93 1uph n GLN 90 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 1uph n ARG 91 N -0.84 -2.09 -4.34 -1.09 0.63 0.69 -5.03 116.66 104.59 1uph n ARG 91 Ca 0.13 0.45 -0.34 0.00 -0.92 0.00 0.00 57.85 57.18 1uph n ARG 91 Cb 0.31 -3.98 -0.13 0.00 0.45 0.00 0.00 32.46 29.11 1uph n ARG 91 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1uph s ILE 92 N -3.20 3.73 0.25 5.15 1.01 0.29 -4.98 121.20 123.45 1uph s ILE 92 Ca 0.15 -0.41 -0.31 0.00 0.00 0.00 0.00 60.65 60.08 1uph s ILE 92 Cb -0.02 -2.64 -0.11 0.00 0.01 0.00 0.00 42.46 39.69 1uph s ILE 92 CO 0.39 0.48 1.63 1.51 0.00 0.00 0.00 174.94 178.94 1uph s ASP 93 N 0.60 6.41 0.12 3.58 -4.77 -1.26 -4.44 116.67 116.92 1uph s ASP 93 Ca -0.03 2.87 0.04 0.00 -3.30 0.00 0.00 52.55 52.13 1uph s ASP 93 Cb -0.14 -2.62 -0.04 0.00 -1.09 0.00 0.00 42.92 39.03 1uph s ASP 93 CO 0.03 -0.92 -0.10 0.68 0.70 0.00 0.00 175.17 175.56 1uph s VAL 94 N 0.54 1.07 0.00 2.11 -7.23 -1.26 -5.01 120.40 110.62 1uph s VAL 94 Ca 0.68 -1.88 0.00 0.00 -1.81 0.00 0.00 61.98 58.96 1uph s VAL 94 Cb -0.48 -1.65 0.00 0.00 0.56 0.00 0.00 36.38 34.81 1uph s VAL 94 CO 0.40 -0.67 0.00 0.29 -0.31 0.00 0.00 175.10 174.82 1uph n LYS 95 N 0.13 0.00 -4.10 4.82 5.02 -1.26 -4.71 118.16 118.05 1uph n LYS 95 Ca -0.13 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.09 1uph n LYS 95 Cb 0.59 -0.43 -0.10 0.00 -0.02 0.00 0.00 35.03 35.07 1uph n LYS 95 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 1uph s ASP 96 N -4.40 0.46 0.16 4.39 -4.77 -1.26 0.03 116.67 111.29 1uph s ASP 96 Ca 0.00 -1.03 -0.15 0.00 -3.30 0.00 0.00 52.55 48.07 1uph s ASP 96 Cb 0.00 0.21 0.04 0.00 -1.09 0.00 0.00 42.92 42.08 1uph s ASP 96 CO 0.00 -0.62 1.83 0.00 0.70 0.00 0.00 175.17 177.08 1uph h THR 97 N 3.11 1.12 -0.89 2.11 1.03 -0.61 0.59 112.91 119.38 1uph h THR 97 Ca -0.34 -0.22 -0.01 0.00 -0.01 0.00 0.00 66.41 65.83 1uph h THR 97 Cb 1.15 0.43 -0.04 0.00 -1.07 0.00 0.00 68.15 68.62 1uph h THR 97 CO 0.65 0.12 0.51 0.50 -0.01 0.00 0.00 175.52 177.29 1uph h LYS 98 N 0.63 1.22 -0.36 0.00 3.64 -1.83 0.41 116.57 120.29 1uph h LYS 98 Ca 0.17 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.37 1uph h LYS 98 Cb -0.07 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 31.48 1uph h LYS 98 CO -0.04 0.87 -0.02 1.49 -2.27 0.00 0.00 179.45 179.48 1uph h GLU 99 N 1.23 0.57 -0.15 1.90 4.22 -1.75 0.80 114.58 121.39 1uph h GLU 99 Ca 0.32 -0.13 -0.15 0.00 0.08 0.00 0.00 59.36 59.47 1uph h GLU 99 Cb -0.02 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1uph h GLU 99 CO -0.06 0.61 -0.54 0.00 -2.18 0.00 0.00 179.01 176.85 1uph h ALA 100 N 1.44 0.79 -0.05 2.92 0.00 0.12 0.39 119.26 124.87 1uph h ALA 100 Ca 0.11 -0.50 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 1uph h ALA 100 Cb 0.37 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1uph h ALA 100 CO 0.01 0.69 -0.04 -0.07 0.00 0.00 0.00 179.25 179.84 1uph h LEU 101 N 0.34 0.13 -1.03 0.00 3.38 -0.25 0.00 115.31 117.89 1uph h LEU 101 Ca 0.01 -0.45 -0.09 0.00 0.09 0.00 0.00 57.88 57.44 1uph h LEU 101 Cb 1.05 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1uph h LEU 101 CO 0.09 0.55 -0.31 -0.78 0.09 0.00 0.00 178.44 178.09 1uph h ASP 102 N -0.29 0.32 -0.07 -0.43 3.58 -0.82 0.39 116.42 119.10 1uph h ASP 102 Ca 0.01 -0.11 -0.01 0.00 0.42 0.00 0.00 57.03 57.34 1uph h ASP 102 Cb 0.50 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.46 1uph h ASP 102 CO 0.01 0.62 0.02 0.50 -2.88 0.00 0.00 179.24 177.51 1uph h LYS 103 N 0.28 0.11 -0.19 0.28 1.63 -0.10 0.28 116.57 118.86 1uph h LYS 103 Ca 0.04 -0.03 -0.13 0.00 -0.85 0.00 0.00 60.65 59.68 1uph h LYS 103 Cb 0.68 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.29 1uph h LYS 103 CO 0.05 0.29 -0.44 0.97 -3.45 0.00 0.00 179.45 176.87 1uph h ILE 104 N -0.08 1.31 -0.74 2.00 6.09 -0.78 -1.32 117.51 123.99 1uph h ILE 104 Ca 0.02 -1.62 -0.06 0.00 -1.37 0.00 0.00 64.86 61.82 1uph h ILE 104 Cb 0.22 1.65 -0.03 0.00 0.47 0.00 0.00 36.82 39.13 1uph h ILE 104 CO -0.00 0.50 0.21 -0.33 -3.07 0.00 0.00 178.15 175.46 1uph h GLU 105 N 0.38 1.16 -0.02 2.19 3.07 0.04 0.40 114.58 121.80 1uph h GLU 105 Ca 0.03 -0.26 -0.01 0.00 -0.50 0.00 0.00 59.36 58.62 1uph h GLU 105 Cb 0.93 -0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 28.68 1uph h GLU 105 CO 0.08 1.00 -0.01 0.93 -1.40 0.00 0.00 179.01 179.60 1uph h GLU 106 N 1.11 0.04 -0.14 2.33 4.39 -0.23 -1.21 114.58 120.86 1uph h GLU 106 Ca 0.24 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.95 1uph h GLU 106 Cb 0.34 -0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.95 1uph h GLU 106 CO -0.00 0.48 -0.08 0.93 -1.16 0.00 0.00 179.01 179.18 1uph h GLU 107 N -0.39 -0.07 -0.08 2.33 5.08 -1.13 0.12 114.58 120.42 1uph h GLU 107 Ca 0.00 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.40 1uph h GLU 107 Cb 0.47 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 1uph h GLU 107 CO 0.00 -0.05 -0.08 0.37 -1.00 0.00 0.00 179.01 178.25 1uph h GLN 108 N -0.08 -0.10 -0.47 2.33 -0.00 -0.94 0.24 115.11 116.09 1uph h GLN 108 Ca 0.08 0.01 0.08 0.00 -0.00 0.00 0.00 58.65 58.83 1uph h GLN 108 Cb 0.20 0.02 -0.07 0.00 0.00 0.00 0.00 27.48 27.63 1uph h GLN 108 CO -0.19 -0.07 0.04 -0.97 0.00 0.00 0.00 178.83 177.64 1uph h ASN 109 N -0.11 -0.11 -0.72 -0.69 -0.73 -0.77 0.21 115.58 112.66 1uph h ASN 109 Ca 0.06 0.10 0.02 0.00 1.87 0.00 0.00 56.30 58.36 1uph h ASN 109 Cb 0.20 0.16 -0.04 0.00 0.27 0.00 0.00 38.32 38.90 1uph h ASN 109 CO -0.15 -0.02 0.46 0.11 -0.37 0.00 0.00 177.43 177.46 1uph h LYS 110 N 0.16 0.89 0.41 6.67 1.57 -0.10 -0.19 116.57 125.97 1uph h LYS 110 Ca 0.23 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1uph h LYS 110 Cb 0.33 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1uph h LYS 110 CO -0.35 0.59 -0.33 1.03 -0.57 0.00 0.00 179.45 179.82 1uph h SER 111 N 0.92 -0.86 -0.30 0.86 0.87 0.15 0.17 113.55 115.35 1uph h SER 111 Ca 0.28 0.07 0.07 0.00 -1.23 0.00 0.00 61.79 60.98 1uph h SER 111 Cb -0.02 0.28 -0.07 0.00 -0.44 0.00 0.00 62.40 62.14 1uph h SER 111 CO -0.09 -0.48 -0.21 0.50 -0.53 0.00 0.00 176.83 176.01 1uph h LYS 112 N -0.74 -0.18 -0.33 2.24 3.64 -0.36 0.14 116.57 120.99 1uph h LYS 112 Ca -0.04 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.43 1uph h LYS 112 Cb 0.64 0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 32.42 1uph h LYS 112 CO -0.01 -0.12 -0.20 -0.22 -2.27 0.00 0.00 179.45 176.63 1uph h LYS 113 N -0.18 -0.15 -0.27 1.90 3.64 -0.71 0.17 116.57 120.97 1uph h LYS 113 Ca 0.16 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.61 1uph h LYS 113 Cb 0.43 0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.21 1uph h LYS 113 CO -0.41 -0.10 -0.21 -0.22 -2.27 0.00 0.00 179.45 176.24 1uph h LYS 114 N -0.15 -0.19 -0.30 1.90 1.63 0.72 0.20 116.57 120.37 1uph h LYS 114 Ca 0.17 0.01 0.07 0.00 -0.85 0.00 0.00 60.65 60.05 1uph h LYS 114 Cb 0.41 0.04 -0.07 0.00 -0.60 0.00 0.00 32.23 32.01 1uph h LYS 114 CO -0.43 -0.13 -0.21 0.00 -3.45 0.00 0.00 179.45 175.23 1uph h ALA 115 N 0.91 -0.02 -0.26 5.00 0.00 0.62 -0.33 119.26 125.18 1uph h ALA 115 Ca 0.15 0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.22 1uph h ALA 115 Cb 0.43 0.47 -0.06 0.00 0.00 0.00 0.00 17.79 18.62 1uph h ALA 115 CO -0.39 -0.61 -0.17 0.37 0.00 0.00 0.00 179.25 178.45 1uph h GLN 116 N -0.18 -0.14 -0.90 0.00 -0.00 0.54 0.28 115.11 114.69 1uph h GLN 116 Ca 0.16 0.01 0.18 0.00 -0.00 0.00 0.00 58.65 59.00 1uph h GLN 116 Cb 0.43 0.03 -0.11 0.00 0.00 0.00 0.00 27.48 27.83 1uph h GLN 116 CO -0.41 -0.09 0.48 0.37 0.00 0.00 0.00 178.83 179.17 1uph h GLN 117 N -0.15 0.59 0.36 1.69 5.75 0.48 0.28 115.11 124.12 1uph h GLN 117 Ca 0.14 -0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 58.59 1uph h GLN 117 Cb 0.36 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 28.78 1uph h GLN 117 CO -0.35 0.39 -0.17 0.00 -2.65 0.00 0.00 178.83 176.04 1uph h ALA 118 N 1.62 -0.97 -0.73 3.38 0.00 0.59 -1.30 119.26 121.84 1uph h ALA 118 Ca 0.52 -0.11 0.21 0.00 0.00 0.00 0.00 54.91 55.54 1uph h ALA 118 Cb 0.83 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 1uph h ALA 118 CO -0.41 -0.94 0.83 0.00 0.00 0.00 0.00 179.25 178.73 1uph h ALA 119 N -1.71 2.54 0.14 0.00 0.00 -0.53 1.40 119.26 121.12 1uph h ALA 119 Ca -0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1uph h ALA 119 Cb 0.37 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1uph h ALA 119 CO 0.08 -1.20 -0.07 0.00 0.00 0.00 0.00 179.25 178.06 1uph h ALA 120 N 1.04 -0.62 -1.96 0.00 0.00 0.06 -3.42 119.26 114.35 1uph h ALA 120 Ca 0.35 -0.04 -0.52 0.00 0.00 0.00 0.00 54.91 54.70 1uph h ALA 120 Cb 2.00 0.07 -0.39 0.00 0.00 0.00 0.00 17.79 19.47 1uph h ALA 120 CO -0.00 -0.61 -1.14 -3.47 0.00 0.00 0.00 179.25 174.03 1uph n ASP 121 N -2.81 0.42 0.00 0.00 2.03 -0.10 -5.09 116.55 110.99 1uph n ASP 121 Ca -0.02 -2.85 0.00 0.00 0.52 0.00 0.00 54.79 52.44 1uph n ASP 121 Cb 0.08 -0.58 0.00 0.00 -0.72 0.00 0.00 41.12 39.89 1uph n ASP 121 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1uph n THR 122 N 0.89 0.00 -2.11 5.18 -1.04 0.46 -4.84 114.28 112.82 1uph n THR 122 Ca 0.23 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.24 1uph n THR 122 Cb 0.59 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.10 1uph n THR 122 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1uph n GLY 123 N -0.53 3.16 2.02 3.41 0.00 -1.26 -3.32 105.19 108.67 1uph n GLY 123 Ca 0.00 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.00 1uph n GLY 123 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1uph n ASN 124 N 0.00 -0.32 0.00 1.61 6.94 -1.26 -4.69 115.26 117.55 1uph n ASN 124 Ca 0.00 0.12 0.00 0.00 -0.02 0.00 0.00 54.58 54.68 1uph n ASN 124 Cb 0.00 0.48 0.00 0.00 -2.36 0.00 0.00 39.78 37.90 1uph n ASN 124 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1uph n ASN 125 N -2.67 0.00 -3.17 0.53 4.13 -1.26 -5.13 115.26 107.70 1uph n ASN 125 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1uph n ASN 125 Cb 0.00 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.23 1uph n ASN 125 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1uph s SER 126 N 0.00 -1.48 0.64 6.41 0.15 -1.26 -5.15 113.70 113.01 1uph s SER 126 Ca 0.00 -0.90 -0.15 0.00 0.70 0.00 0.00 55.95 55.60 1uph s SER 126 Cb 0.00 1.93 -0.01 0.00 -1.71 0.00 0.00 66.02 66.23 1uph s SER 126 CO 0.00 -0.16 1.10 -1.10 1.20 0.00 0.00 173.24 174.28 1uph s GLN 127 N 1.74 2.96 -0.15 5.44 -0.21 -1.26 -5.06 119.66 123.12 1uph s GLN 127 Ca 0.17 1.34 -0.29 0.00 0.02 0.00 0.00 55.36 56.60 1uph s GLN 127 Cb -0.04 -1.97 0.10 0.00 1.00 0.00 0.00 33.01 32.10 1uph s GLN 127 CO -0.07 -1.12 0.88 0.54 -2.12 0.00 0.00 175.29 173.40 1uph s VAL 128 N -2.37 0.00 -0.21 1.09 0.11 -1.26 -5.15 120.40 112.61 1uph s VAL 128 Ca 0.66 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.72 1uph s VAL 128 Cb -0.19 -1.00 0.05 0.00 -1.53 0.00 0.00 36.38 33.70 1uph s VAL 128 CO 0.40 0.00 -0.10 -0.55 -3.33 0.00 0.00 175.10 171.52 1uph s SER 129 N -0.79 3.63 0.43 3.54 0.15 -1.26 -5.12 113.70 114.29 1uph s SER 129 Ca -0.04 -1.01 0.08 0.00 0.70 0.00 0.00 55.95 55.68 1uph s SER 129 Cb -0.01 -1.29 0.01 0.00 -1.71 0.00 0.00 66.02 63.02 1uph s SER 129 CO 0.03 -0.16 0.59 -1.10 1.20 0.00 0.00 173.24 173.80 1uph s GLN 130 N 1.34 2.79 -0.02 5.44 -1.52 -1.26 -5.13 119.66 121.30 1uph s GLN 130 Ca -0.03 -1.23 -0.29 0.00 -1.95 0.00 0.00 55.36 51.86 1uph s GLN 130 Cb -0.17 -2.74 0.10 0.00 -0.22 0.00 0.00 33.01 29.98 1uph s GLN 130 CO -0.08 -0.32 0.88 1.21 -0.25 0.00 0.00 175.29 176.73 1uph s ASN 131 N -4.37 -0.38 0.00 5.90 2.47 -1.26 -5.37 114.94 111.93 1uph s ASN 131 Ca 0.55 0.07 0.00 0.00 0.42 0.00 0.00 52.86 53.90 1uph s ASN 131 Cb -0.10 0.39 0.00 0.00 -1.45 0.00 0.00 41.25 40.09 1uph s ASN 131 CO 0.34 -0.61 0.00 -1.22 -3.72 0.00 0.00 177.10 171.89