#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 3.00 -2.35 4.61 0.00 -1.26 -5.04 120.51 119.47 1uph n ALA 3 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1uph n ALA 3 Cb 0.00 0.20 -0.03 0.00 0.00 0.00 0.00 19.45 19.62 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 -2.00 4.35 0.87 0.00 0.52 -1.26 -5.02 118.95 116.41 1uph s ARG 4 Ca 0.00 1.82 -0.13 0.00 -0.52 0.00 0.00 55.73 56.90 1uph s ARG 4 Cb 0.00 -3.49 0.13 0.00 0.52 0.00 0.00 34.95 32.11 1uph s ARG 4 CO 0.00 -0.44 1.23 0.00 0.02 0.00 0.00 175.30 176.11 1uph s ALA 5 N 1.92 2.51 0.00 2.13 0.00 -1.26 -5.02 121.76 122.04 1uph s ALA 5 Ca 0.60 -0.94 0.11 0.00 0.00 0.00 0.00 51.96 51.73 1uph s ALA 5 Cb -0.29 -2.84 0.19 0.00 0.00 0.00 0.00 23.12 20.18 1uph s ALA 5 CO 0.26 -2.00 1.01 0.43 0.00 0.00 0.00 175.76 175.46 1uph n SER 6 N -3.49 0.20 -0.00 0.00 7.64 -1.26 -4.95 113.62 111.76 1uph n SER 6 Ca 0.11 -1.88 -0.00 0.00 1.01 0.00 0.00 58.87 58.11 1uph n SER 6 Cb 0.60 -0.10 -0.00 0.00 -1.01 0.00 0.00 64.21 63.70 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 0.08 -4.34 0.44 0.31 -1.26 -3.81 118.33 109.96 1uph n VAL 7 Ca -0.04 0.38 -0.17 0.00 -0.01 0.00 0.00 64.34 64.50 1uph n VAL 7 Cb 0.87 -1.43 -0.05 0.00 -0.91 0.00 0.00 33.84 32.33 1uph n VAL 7 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1uph n LEU 8 N -2.59 0.00 0.00 7.52 -0.00 -1.26 -4.60 117.00 116.07 1uph n LEU 8 Ca -0.01 -2.00 -0.19 0.00 -0.00 0.00 0.00 56.01 53.82 1uph n LEU 8 Cb 0.02 0.60 0.11 0.00 -0.00 0.00 0.00 43.42 44.15 1uph n LEU 8 CO 0.01 -0.30 0.49 -1.20 -0.00 0.00 0.00 177.39 176.38 1uph n SER 9 N -1.65 0.94 0.43 1.45 7.64 -1.26 -4.85 113.62 116.31 1uph n SER 9 Ca -0.05 -1.84 -0.19 0.00 1.01 0.00 0.00 58.87 57.80 1uph n SER 9 Cb 0.39 -0.56 -0.10 0.00 -1.01 0.00 0.00 64.21 62.93 1uph n SER 9 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1uph h GLY 10 N -0.61 -1.26 0.25 0.23 0.00 -2.02 0.18 103.07 99.84 1uph h GLY 10 Ca -0.28 0.50 0.09 0.00 0.00 0.00 0.00 47.33 47.65 1uph h GLY 10 CO 0.28 -0.44 0.02 -1.33 0.00 0.00 0.00 176.54 175.07 1uph h GLY 11 N -1.16 0.50 1.91 4.60 0.00 -2.00 0.22 103.07 107.14 1uph h GLY 11 Ca -0.10 0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.26 1uph h GLY 11 CO 0.12 -0.12 0.02 0.83 0.00 0.00 0.00 176.54 177.40 1uph h GLU 12 N 0.13 0.12 -0.24 4.80 5.08 -1.90 -1.23 114.58 121.34 1uph h GLU 12 Ca 0.24 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.52 1uph h GLU 12 Cb 0.35 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1uph h GLU 12 CO -0.38 0.12 -0.11 1.25 -1.00 0.00 0.00 179.01 178.89 1uph h LEU 13 N 0.12 0.50 -0.39 1.33 7.12 0.24 0.41 115.31 124.65 1uph h LEU 13 Ca 0.03 -0.40 0.02 0.00 0.13 0.00 0.00 57.88 57.66 1uph h LEU 13 Cb 0.06 -0.14 -0.03 0.00 -0.53 0.00 0.00 40.66 40.02 1uph h LEU 13 CO -0.00 0.80 0.23 -0.78 -0.13 0.00 0.00 178.44 178.55 1uph h ASP 14 N 0.21 0.36 0.41 1.25 1.82 -0.15 0.29 116.42 120.62 1uph h ASP 14 Ca 0.05 0.01 -0.10 0.00 -0.39 0.00 0.00 57.03 56.60 1uph h ASP 14 Cb 0.60 -0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.53 1uph h ASP 14 CO 0.03 0.26 -0.44 0.11 -1.61 0.00 0.00 179.24 177.59 1uph h LYS 15 N 0.46 0.04 0.00 0.28 1.57 -1.16 -1.81 116.57 115.94 1uph h LYS 15 Ca 0.16 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.84 1uph h LYS 15 Cb 0.01 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1uph h LYS 15 CO -0.08 0.47 -0.39 2.35 -0.57 0.00 0.00 179.45 181.23 1uph h TRP 16 N 0.03 0.00 -0.51 -1.35 2.91 0.12 -2.33 115.95 114.82 1uph h TRP 16 Ca -0.00 0.00 -0.27 0.00 1.13 0.00 0.00 58.89 59.75 1uph h TRP 16 Cb 0.79 0.00 -0.16 0.00 -0.51 0.00 0.00 29.16 29.29 1uph h TRP 16 CO 0.00 0.39 0.34 0.39 -1.03 0.00 0.00 178.44 178.54 1uph n GLU 17 N -3.81 1.65 0.00 2.65 1.02 0.89 -3.40 120.64 119.65 1uph n GLU 17 Ca -0.01 -1.53 0.01 0.00 -0.02 0.00 0.00 57.16 55.60 1uph n GLU 17 Cb 0.46 -1.60 -0.00 0.00 -0.02 0.00 0.00 31.44 30.28 1uph n GLU 17 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1uph n LYS 18 N -0.27 2.83 -3.01 3.49 0.00 -0.88 -4.57 118.16 115.75 1uph n LYS 18 Ca 0.30 -0.29 -0.41 0.00 0.00 0.00 0.00 58.31 57.91 1uph n LYS 18 Cb 1.04 -0.79 -0.05 0.00 0.00 0.00 0.00 35.03 35.23 1uph n LYS 18 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1uph s ILE 19 N -0.59 4.93 0.16 3.15 1.09 -1.22 -4.56 121.20 124.16 1uph s ILE 19 Ca 0.01 1.36 -0.25 0.00 -1.10 0.00 0.00 60.65 60.67 1uph s ILE 19 Cb 0.01 -4.03 -0.08 0.00 -1.06 0.00 0.00 42.46 37.30 1uph s ILE 19 CO 0.03 0.01 0.76 -0.13 -0.10 0.00 0.00 174.94 175.50 1uph s ARG 20 N 2.46 4.52 0.08 2.79 0.52 0.88 -0.75 118.95 129.45 1uph s ARG 20 Ca 0.31 1.11 -0.17 0.00 -0.52 0.00 0.00 55.73 56.46 1uph s ARG 20 Cb -0.16 -3.24 -0.11 0.00 0.52 0.00 0.00 34.95 31.97 1uph s ARG 20 CO 0.09 0.57 1.39 -0.07 0.02 0.00 0.00 175.30 177.30 1uph h LEU 21 N 4.30 0.64-10.04 2.53 3.38 -1.36 -0.86 115.31 113.89 1uph h LEU 21 Ca -0.47 -0.48 -0.54 0.00 0.09 0.00 0.00 57.88 56.47 1uph h LEU 21 Cb 1.21 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 1uph h LEU 21 CO 0.66 0.99 -0.28 -0.13 0.09 0.00 0.00 178.44 179.76 1uph s ARG 22 N -4.32 3.57 0.14 1.13 3.00 -1.26 -4.58 118.95 116.63 1uph s ARG 22 Ca -0.13 -0.20 -0.05 0.00 0.00 0.00 0.00 55.73 55.35 1uph s ARG 22 Cb 0.08 -2.80 -0.06 0.00 0.00 0.00 0.00 34.95 32.16 1uph s ARG 22 CO 0.81 0.38 1.33 -1.00 0.00 0.00 0.00 175.30 176.82 1uph h PRO 23 N 2.14 0.46 0.00 3.54 0.13 -1.99 -3.14 132.00 133.14 1uph h PRO 23 Ca -0.47 -0.45 0.00 0.00 -0.87 0.00 0.00 66.00 64.21 1uph h PRO 23 Cb 1.18 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1uph h PRO 23 CO 0.69 1.09 -0.38 0.78 -0.23 0.00 0.00 178.00 179.95 1uph h GLY 24 N 1.13 0.00 0.00 1.56 0.00 -1.98 -3.50 103.07 100.28 1uph h GLY 24 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.26 1uph h GLY 24 CO 0.15 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.30 1uph n GLY 25 N 1.27 2.69 0.00 4.60 0.00 -1.19 -5.11 105.19 107.46 1uph n GLY 25 Ca 0.04 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 43.95 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 -1.04 0.00 -3.72 1.61 0.00 -1.26 -4.55 118.16 109.20 1uph n LYS 26 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 58.31 58.28 1uph n LYS 26 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.02 1uph n LYS 26 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1uph s LYS 27 N 0.00 1.04 0.33 1.64 2.20 -1.26 -5.06 119.74 118.64 1uph s LYS 27 Ca 0.00 -0.57 0.10 0.00 -0.36 0.00 0.00 55.97 55.14 1uph s LYS 27 Cb 0.00 0.36 -0.06 0.00 -1.51 0.00 0.00 37.83 36.62 1uph s LYS 27 CO 0.00 -0.48 -0.11 1.14 -0.36 0.00 0.00 175.35 175.55 1uph s GLN 28 N -3.13 1.81 1.06 4.03 -2.07 -1.26 -0.90 119.66 119.21 1uph s GLN 28 Ca 0.12 -1.90 -0.15 0.00 -1.82 0.00 0.00 55.36 51.61 1uph s GLN 28 Cb -0.00 -1.73 0.19 0.00 -1.09 0.00 0.00 33.01 30.38 1uph s GLN 28 CO 0.01 0.17 0.36 0.66 -1.32 0.00 0.00 175.29 175.16 1uph n TYR 29 N -0.78 -2.43 -3.76 9.60 4.02 0.07 -4.90 117.16 118.98 1uph n TYR 29 Ca -0.05 -0.08 0.04 0.00 -0.01 0.00 0.00 57.90 57.80 1uph n TYR 29 Cb 0.63 -1.40 0.00 0.00 -0.02 0.00 0.00 39.34 38.56 1uph n TYR 29 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 176.86 176.06 1uph s LYS 30 N -3.63 0.08 0.66 -0.72 2.20 -1.26 -4.63 119.74 112.43 1uph s LYS 30 Ca 0.41 -0.05 0.34 0.00 -0.36 0.00 0.00 55.97 56.31 1uph s LYS 30 Cb -0.07 0.03 1.86 0.00 -1.51 0.00 0.00 37.83 38.13 1uph s LYS 30 CO 0.39 -0.04 2.05 1.25 -0.36 0.00 0.00 175.35 178.63 1uph h LEU 31 N 2.00 0.00 -0.21 5.43 7.12 -1.96 0.24 115.31 127.93 1uph h LEU 31 Ca -0.28 0.00 -0.07 0.00 0.13 0.00 0.00 57.88 57.66 1uph h LEU 31 Cb 1.18 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 41.31 1uph h LEU 31 CO 0.30 0.00 -0.15 0.50 -0.13 0.00 0.00 178.44 178.95 1uph h LYS 32 N 0.00 0.47 -0.17 1.25 3.11 -1.98 0.14 116.57 119.39 1uph h LYS 32 Ca 0.00 -0.23 -0.16 0.00 -2.81 0.00 0.00 60.65 57.45 1uph h LYS 32 Cb 0.45 -0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.67 1uph h LYS 32 CO 0.00 0.79 -0.55 0.45 -2.81 0.00 0.00 179.45 177.33 1uph h HIS 33 N 0.15 0.65 -0.40 1.91 3.86 -0.96 -0.49 115.15 119.88 1uph h HIS 33 Ca 0.04 -0.23 -0.10 0.00 -1.16 0.00 0.00 60.37 58.92 1uph h HIS 33 Cb 0.67 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 29.00 1uph h HIS 33 CO 0.07 0.95 -0.15 0.82 0.86 0.00 0.00 177.93 180.49 1uph h ILE 34 N 0.40 1.26 -0.24 2.45 2.04 -1.12 0.23 117.51 122.54 1uph h ILE 34 Ca 0.01 -1.20 -0.19 0.00 1.00 0.00 0.00 64.86 64.48 1uph h ILE 34 Cb 1.09 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 1uph h ILE 34 CO 0.10 0.40 -0.59 0.58 0.00 0.00 0.00 178.15 178.64 1uph h VAL 35 N 0.65 1.29 -0.32 1.67 2.07 -0.51 -0.92 116.25 120.19 1uph h VAL 35 Ca 0.11 -1.80 -0.04 0.00 0.82 0.00 0.00 66.70 65.79 1uph h VAL 35 Cb 0.62 1.73 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 1uph h VAL 35 CO 0.04 0.58 0.05 -0.25 0.02 0.00 0.00 177.57 178.01 1uph h TRP 36 N 0.58 0.56 -0.07 1.57 7.01 -0.76 -0.07 115.95 124.77 1uph h TRP 36 Ca 0.00 -0.08 0.02 0.00 2.11 0.00 0.00 58.89 60.94 1uph h TRP 36 Cb 1.19 -0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 28.08 1uph h TRP 36 CO 0.07 0.60 -0.05 0.00 -2.79 0.00 0.00 178.44 176.27 1uph h ALA 37 N 0.89 0.01 -0.85 2.65 0.00 -0.46 -0.31 119.26 121.19 1uph h ALA 37 Ca 0.10 0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.11 1uph h ALA 37 Cb 0.35 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1uph h ALA 37 CO 0.01 -0.52 0.55 0.66 0.00 0.00 0.00 179.25 179.95 1uph h SER 38 N -0.05 0.79 -0.59 0.00 4.64 -0.98 0.15 113.55 117.51 1uph h SER 38 Ca 0.04 0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.35 1uph h SER 38 Cb 0.12 -0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 62.03 1uph h SER 38 CO -0.10 0.49 0.26 -0.09 -0.87 0.00 0.00 176.83 176.52 1uph h ARG 39 N 0.89 0.86 -0.22 4.77 2.43 0.07 -1.24 114.38 121.94 1uph h ARG 39 Ca 0.38 -0.14 -0.08 0.00 -0.81 0.00 0.00 59.98 59.32 1uph h ARG 39 Cb 0.30 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1uph h ARG 39 CO -0.14 0.71 -0.22 1.49 -1.51 0.00 0.00 179.97 180.30 1uph h GLU 40 N 0.80 0.41 0.09 0.20 4.57 0.29 0.83 114.58 121.77 1uph h GLU 40 Ca 0.20 -0.14 -0.00 0.00 -1.18 0.00 0.00 59.36 58.24 1uph h GLU 40 Cb 0.15 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.71 1uph h GLU 40 CO -0.02 0.61 -0.04 -0.07 -1.18 0.00 0.00 179.01 178.31 1uph h LEU 41 N 0.37 -0.10 -1.17 1.64 -0.00 -0.44 0.44 115.31 116.05 1uph h LEU 41 Ca 0.06 -0.15 -0.07 0.00 -0.00 0.00 0.00 57.88 57.72 1uph h LEU 41 Cb 0.59 0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.27 1uph h LEU 41 CO 0.04 0.09 -0.21 -0.08 -0.00 0.00 0.00 178.44 178.28 1uph h GLU 42 N -0.29 0.32 0.00 1.13 4.57 -1.07 0.59 114.58 119.84 1uph h GLU 42 Ca -0.01 -0.10 -0.05 0.00 -1.18 0.00 0.00 59.36 58.02 1uph h GLU 42 Cb 0.24 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 1uph h GLU 42 CO 0.02 0.52 -0.22 0.00 -1.18 0.00 0.00 179.01 178.15 1uph h ARG 43 N 0.30 0.00 -0.00 1.92 2.47 -0.50 -2.66 114.38 115.90 1uph h ARG 43 Ca 0.05 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.77 1uph h ARG 43 Cb 0.54 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.86 1uph h ARG 43 CO 0.04 0.22 -0.10 1.19 0.56 0.00 0.00 179.97 181.87 1uph n PHE 44 N -3.27 0.00 -0.91 3.04 3.72 0.15 -4.88 117.46 115.31 1uph n PHE 44 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 1uph n PHE 44 Cb 0.50 -0.16 0.00 0.00 -0.94 0.00 0.00 39.48 38.88 1uph n PHE 44 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1uph n ALA 45 N -0.88 0.00 -2.61 4.37 0.00 -1.00 -5.04 120.51 115.34 1uph n ALA 45 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.29 1uph n ALA 45 Cb 0.27 -0.40 -0.09 0.00 0.00 0.00 0.00 19.45 19.23 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 -2.00 3.58 0.21 0.00 0.11 0.12 -5.02 120.40 117.41 1uph s VAL 46 Ca 0.00 -1.19 -0.30 0.00 -2.93 0.00 0.00 61.98 57.57 1uph s VAL 46 Cb 0.00 -2.69 -0.08 0.00 -1.53 0.00 0.00 36.38 32.08 1uph s VAL 46 CO 0.00 0.11 1.06 0.20 -3.33 0.00 0.00 175.10 173.14 1uph s ASN 47 N -2.26 7.35 0.14 3.54 0.01 -1.26 -3.18 114.94 119.28 1uph s ASN 47 Ca 0.23 2.10 -0.04 0.00 -0.71 0.00 0.00 52.86 54.44 1uph s ASN 47 Cb -0.11 -2.61 -0.05 0.00 0.41 0.00 0.00 41.25 38.88 1uph s ASN 47 CO 0.15 -0.12 1.34 1.55 -1.51 0.00 0.00 177.10 178.51 1uph h PRO 48 N 4.61 0.44 -0.72 -0.60 0.13 -1.89 -3.19 132.00 130.78 1uph h PRO 48 Ca -0.45 -0.42 0.03 0.00 -0.87 0.00 0.00 66.00 64.29 1uph h PRO 48 Cb 1.21 0.11 -0.04 0.00 0.13 0.00 0.00 31.00 32.41 1uph h PRO 48 CO 0.70 1.08 0.48 0.78 -0.23 0.00 0.00 178.00 180.80 1uph h GLY 49 N 1.20 1.00 2.00 1.56 0.00 -1.92 0.26 103.07 107.16 1uph h GLY 49 Ca -0.06 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.92 1uph h GLY 49 CO 0.15 0.31 0.00 1.47 0.00 0.00 0.00 176.54 178.47 1uph n LEU 50 N -4.45 0.23 -0.45 3.11 -0.00 -1.20 -0.06 117.00 114.17 1uph n LEU 50 Ca 0.09 0.58 0.14 0.00 -0.00 0.00 0.00 56.01 56.82 1uph n LEU 50 Cb 0.11 -0.57 0.50 0.00 -0.00 0.00 0.00 43.42 43.46 1uph n LEU 50 CO 0.35 -0.51 0.84 -0.11 -0.00 0.00 0.00 177.39 177.96 1uph n LEU 51 N -1.78 1.45 0.00 1.47 0.00 0.90 -3.61 117.00 115.43 1uph n LEU 51 Ca 0.01 -0.47 0.14 0.00 0.00 0.00 0.00 56.01 55.69 1uph n LEU 51 Cb 0.11 -0.02 0.73 0.00 0.00 0.00 0.00 43.42 44.24 1uph n LEU 51 CO 0.10 0.25 0.99 -1.84 0.00 0.00 0.00 177.39 176.88 1uph n GLU 52 N 0.07 0.48 -4.95 1.96 0.28 0.91 -4.54 120.64 114.84 1uph n GLU 52 Ca 0.18 0.02 -0.32 0.00 -0.16 0.00 0.00 57.16 56.87 1uph n GLU 52 Cb 0.36 -1.50 -0.14 0.00 1.43 0.00 0.00 31.44 31.59 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 2.89 0.46 3.84 -4.23 -1.24 -4.81 115.64 110.07 1uph s THR 53 Ca 0.29 -0.78 0.16 0.00 -1.18 0.00 0.00 61.69 60.18 1uph s THR 53 Cb 0.19 -2.12 0.33 0.00 1.34 0.00 0.00 72.50 72.24 1uph s THR 53 CO 0.41 0.59 2.01 0.77 -0.54 0.00 0.00 174.62 177.86 1uph h SER 54 N 5.45 0.25 -0.30 3.99 4.64 -1.88 0.50 113.55 126.20 1uph h SER 54 Ca -0.44 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.76 1uph h SER 54 Cb 1.15 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.19 1uph h SER 54 CO 0.50 0.15 -0.27 -0.08 -0.87 0.00 0.00 176.83 176.26 1uph h GLU 55 N 0.28 0.72 -0.64 4.77 4.81 -1.94 -1.20 114.58 121.37 1uph h GLU 55 Ca 0.22 -0.37 -0.08 0.00 -0.13 0.00 0.00 59.36 59.00 1uph h GLU 55 Cb 0.51 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 1uph h GLU 55 CO -0.05 0.98 0.07 0.78 -0.73 0.00 0.00 179.01 180.06 1uph h GLY 56 N 0.47 1.17 0.93 1.92 0.00 -1.25 -0.01 103.07 106.29 1uph h GLY 56 Ca 0.05 -0.81 -0.03 0.00 0.00 0.00 0.00 47.33 46.55 1uph h GLY 56 CO 0.07 0.75 0.11 0.00 0.00 0.00 0.00 176.54 177.47 1uph h ARG 58 N 0.45 0.94 -0.26 0.00 1.12 -0.96 -1.02 114.38 114.64 1uph h ARG 58 Ca 0.12 -0.10 -0.02 0.00 -1.11 0.00 0.00 59.98 58.87 1uph h ARG 58 Cb 0.25 -0.19 -0.01 0.00 -0.01 0.00 0.00 29.97 30.02 1uph h ARG 58 CO -0.00 0.69 0.10 0.37 -3.11 0.00 0.00 179.97 178.02 1uph h GLN 59 N 0.94 0.39 -0.15 0.20 5.75 -0.50 -0.32 115.11 121.43 1uph h GLN 59 Ca 0.24 -0.07 0.01 0.00 -0.15 0.00 0.00 58.65 58.68 1uph h GLN 59 Cb 0.04 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.51 1uph h GLN 59 CO -0.04 0.43 0.05 0.82 -2.65 0.00 0.00 178.83 177.45 1uph h ILE 60 N 0.27 0.97 -1.00 2.39 2.04 -0.72 0.28 117.51 121.74 1uph h ILE 60 Ca 0.09 -0.04 0.09 0.00 1.00 0.00 0.00 64.86 65.99 1uph h ILE 60 Cb 0.19 0.83 -0.08 0.00 -0.74 0.00 0.00 36.82 37.03 1uph h ILE 60 CO -0.01 0.02 0.63 0.25 0.00 0.00 0.00 178.15 179.05 1uph h LEU 61 N 0.12 0.97 -1.06 1.44 5.85 -1.02 0.19 115.31 121.82 1uph h LEU 61 Ca 0.06 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.73 1uph h LEU 61 Cb 0.04 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 1uph h LEU 61 CO -0.07 0.57 -0.38 1.23 -0.34 0.00 0.00 178.44 179.45 1uph h GLY 62 N 1.08 0.00 1.38 3.75 0.00 -0.05 0.45 103.07 109.67 1uph h GLY 62 Ca 0.46 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.60 1uph h GLY 62 CO -0.22 0.00 -0.70 -1.61 0.00 0.00 0.00 176.54 174.01 1uph h GLN 63 N 0.00 0.62 0.00 4.80 -0.00 0.24 -3.07 115.11 117.71 1uph h GLN 63 Ca -0.00 -0.47 0.00 0.00 -0.00 0.00 0.00 58.65 58.17 1uph h GLN 63 Cb 0.83 0.09 0.00 0.00 0.00 0.00 0.00 27.48 28.40 1uph h GLN 63 CO 0.05 1.09 -0.75 -0.07 0.00 0.00 0.00 178.83 179.16 1uph h LEU 64 N 0.44 0.00 -0.90 -2.39 3.38 -0.84 -3.37 115.31 111.62 1uph h LEU 64 Ca -0.03 -0.13 0.15 0.00 0.09 0.00 0.00 57.88 57.96 1uph h LEU 64 Cb 1.29 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.89 1uph h LEU 64 CO 0.13 0.06 -0.33 1.67 0.09 0.00 0.00 178.44 180.07 1uph n GLN 65 N -2.38 -0.19 0.04 1.13 0.00 0.15 0.50 117.38 116.63 1uph n GLN 65 Ca 0.02 1.39 -0.16 0.00 -0.00 0.00 0.00 57.00 58.25 1uph n GLN 65 Cb 0.49 -2.07 -0.06 0.00 0.00 0.00 0.00 30.24 28.60 1uph n GLN 65 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.06 176.06 1uph h PRO 66 N 0.00 0.59 0.00 3.69 0.13 -1.73 -3.00 132.00 131.68 1uph h PRO 66 Ca 0.33 -0.57 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 1uph h PRO 66 Cb 0.56 0.15 0.00 0.00 0.13 0.00 0.00 31.00 31.84 1uph h PRO 66 CO -0.90 1.19 0.14 0.77 -0.23 0.00 0.00 178.00 178.96 1uph h SER 67 N 0.36 0.00 -0.61 1.44 0.02 -0.12 0.73 113.55 115.37 1uph h SER 67 Ca -0.08 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.83 1uph h SER 67 Cb 1.53 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 64.05 1uph h SER 67 CO 0.17 0.00 0.23 -0.07 -1.14 0.00 0.00 176.83 176.02 1uph h LEU 68 N 0.00 0.86 -0.13 5.07 3.38 -0.22 0.56 115.31 124.82 1uph h LEU 68 Ca 0.00 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 57.80 1uph h LEU 68 Cb 0.27 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1uph h LEU 68 CO 0.00 0.81 -0.08 1.67 0.09 0.00 0.00 178.44 180.93 1uph n GLN 69 N -4.43 -0.06 -1.54 1.13 7.27 0.25 -1.50 117.38 118.50 1uph n GLN 69 Ca 0.04 0.89 -0.21 0.00 0.07 0.00 0.00 57.00 57.79 1uph n GLN 69 Cb 0.18 -1.33 0.08 0.00 2.41 0.00 0.00 30.24 31.58 1uph n GLN 69 CO 0.00 0.00 0.00 -2.37 0.07 0.00 0.00 177.06 174.76 1uph n THR 70 N -3.18 2.80 -1.93 1.69 5.66 -1.21 -5.03 114.28 113.07 1uph n THR 70 Ca 0.00 -3.55 -0.29 0.00 -3.05 0.00 0.00 64.05 57.16 1uph n THR 70 Cb 0.03 -0.93 0.12 0.00 -1.55 0.00 0.00 70.33 68.01 1uph n THR 70 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1uph s GLY 71 N -2.92 1.66 0.49 1.09 0.00 0.19 -5.07 107.32 102.76 1uph s GLY 71 Ca 0.53 -0.86 0.02 0.00 0.00 0.00 0.00 44.72 44.40 1uph s GLY 71 CO 0.01 -0.28 0.70 -1.35 0.00 0.00 0.00 173.10 172.19 1uph s SER 72 N -4.69 5.55 0.22 1.64 1.04 -1.26 -4.91 113.70 111.28 1uph s SER 72 Ca 0.66 0.03 -0.09 0.00 0.48 0.00 0.00 55.95 57.03 1uph s SER 72 Cb -0.08 -1.09 0.22 0.00 0.10 0.00 0.00 66.02 65.16 1uph s SER 72 CO 0.50 -0.91 1.86 -0.08 0.98 0.00 0.00 173.24 175.59 1uph h GLU 73 N 0.30 0.90 -0.30 4.02 4.81 -1.99 0.14 114.58 122.46 1uph h GLU 73 Ca -0.43 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 58.68 1uph h GLU 73 Cb 1.28 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 1uph h GLU 73 CO 0.53 0.59 -0.07 0.93 -0.73 0.00 0.00 179.01 180.26 1uph h GLU 74 N 0.93 0.57 -0.82 1.92 5.08 -1.99 -1.44 114.58 118.83 1uph h GLU 74 Ca 0.30 -0.22 0.04 0.00 -1.00 0.00 0.00 59.36 58.48 1uph h GLU 74 Cb 0.02 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.19 1uph h GLU 74 CO -0.11 0.77 0.52 1.25 -1.00 0.00 0.00 179.01 180.43 1uph h LEU 75 N 0.34 0.84 0.04 1.33 6.46 -1.81 0.21 115.31 122.72 1uph h LEU 75 Ca 0.08 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.84 1uph h LEU 75 Cb 0.56 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 40.31 1uph h LEU 75 CO 0.03 0.57 -0.02 0.03 -0.62 0.00 0.00 178.44 178.42 1uph h ARG 76 N 0.99 -0.05 -0.77 1.25 3.08 -0.55 -0.81 114.38 117.51 1uph h ARG 76 Ca 0.34 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.49 1uph h ARG 76 Cb 0.06 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.07 1uph h ARG 76 CO -0.13 0.06 0.50 1.03 -1.07 0.00 0.00 179.97 180.36 1uph h SER 77 N -0.15 0.62 -0.20 7.04 0.87 -0.70 -0.63 113.55 120.40 1uph h SER 77 Ca -0.01 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.55 1uph h SER 77 Cb 0.13 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 1uph h SER 77 CO 0.01 0.37 0.04 0.25 -0.53 0.00 0.00 176.83 176.97 1uph h LEU 78 N 0.69 0.31 -0.75 2.23 7.12 -0.44 -1.28 115.31 123.18 1uph h LEU 78 Ca 0.35 -0.24 0.06 0.00 0.13 0.00 0.00 57.88 58.18 1uph h LEU 78 Cb 0.46 -0.08 -0.06 0.00 -0.53 0.00 0.00 40.66 40.44 1uph h LEU 78 CO -0.13 0.47 0.44 0.22 -0.13 0.00 0.00 178.44 179.31 1uph h TYR 79 N 0.13 0.81 -0.24 1.25 3.20 0.25 0.28 116.97 122.65 1uph h TYR 79 Ca 0.06 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 1uph h TYR 79 Cb 0.29 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 1uph h TYR 79 CO 0.01 0.39 0.13 -0.91 -1.64 0.00 0.00 178.16 176.15 1uph h ASN 80 N 0.80 0.30 -0.81 -2.11 2.35 -0.98 -0.09 115.58 115.03 1uph h ASN 80 Ca 0.34 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 56.00 1uph h ASN 80 Cb 0.20 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 38.45 1uph h ASN 80 CO -0.18 0.30 0.50 0.74 -1.65 0.00 0.00 177.43 177.14 1uph h THR 81 N 0.27 1.22 -0.46 2.81 2.02 -0.44 -1.22 112.91 117.12 1uph h THR 81 Ca 0.08 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.79 1uph h THR 81 Cb 0.07 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.53 1uph h THR 81 CO -0.01 0.23 0.31 0.40 0.37 0.00 0.00 175.52 176.81 1uph h ILE 82 N 1.11 1.12 -0.24 3.11 2.04 -0.04 0.18 117.51 124.79 1uph h ILE 82 Ca 0.29 -0.21 0.03 0.00 1.00 0.00 0.00 64.86 65.97 1uph h ILE 82 Cb -0.06 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.43 1uph h ILE 82 CO -0.06 0.11 0.03 0.00 0.00 0.00 0.00 178.15 178.24 1uph h ALA 83 N 1.17 0.23 -0.69 1.87 0.00 -0.44 -0.27 119.26 121.14 1uph h ALA 83 Ca 0.17 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1uph h ALA 83 Cb -0.07 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1uph h ALA 83 CO -0.04 -0.39 0.45 0.28 0.00 0.00 0.00 179.25 179.55 1uph h VAL 84 N 0.11 1.18 -0.35 0.00 2.07 -0.73 -0.96 116.25 117.58 1uph h VAL 84 Ca 0.11 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 67.32 1uph h VAL 84 Cb 0.12 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.03 1uph h VAL 84 CO -0.16 0.17 0.19 -0.07 0.02 0.00 0.00 177.57 177.73 1uph h LEU 85 N 0.93 0.31 -0.51 2.57 3.38 0.84 -0.32 115.31 122.52 1uph h LEU 85 Ca 0.25 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 1uph h LEU 85 Cb -0.11 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1uph h LEU 85 CO -0.05 0.22 0.27 0.22 0.09 0.00 0.00 178.44 179.19 1uph h TYR 86 N 0.40 0.70 -0.88 1.13 3.20 -0.18 0.40 116.97 121.74 1uph h TYR 86 Ca 0.14 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.06 1uph h TYR 86 Cb 0.02 -0.22 -0.06 0.00 1.54 0.00 0.00 36.73 38.00 1uph h TYR 86 CO -0.08 0.53 0.57 0.00 -1.64 0.00 0.00 178.16 177.54 1uph h VAL 88 N 0.96 1.28 0.00 0.00 2.07 -0.26 1.49 116.25 121.79 1uph h VAL 88 Ca 0.38 -1.92 -0.01 0.00 0.82 0.00 0.00 66.70 65.97 1uph h VAL 88 Cb 0.25 1.92 -0.00 0.00 -1.52 0.00 0.00 31.29 31.94 1uph h VAL 88 CO -0.15 0.61 -0.04 0.45 0.02 0.00 0.00 177.57 178.47 1uph h HIS 89 N 0.56 0.00 -0.01 1.57 -0.00 0.14 -1.03 115.15 116.38 1uph h HIS 89 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.33 1uph h HIS 89 Cb 1.36 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.77 1uph h HIS 89 CO 0.09 0.04 -0.26 1.04 -0.00 0.00 0.00 177.93 178.84 1uph n GLN 90 N -3.25 1.62 -3.14 2.45 1.13 0.13 -4.83 117.38 111.50 1uph n GLN 90 Ca -0.01 -0.93 -0.14 0.00 -1.94 0.00 0.00 57.00 53.97 1uph n GLN 90 Cb 0.22 -1.27 0.07 0.00 0.11 0.00 0.00 30.24 29.36 1uph n GLN 90 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1uph n ARG 91 N 0.08 -3.41 -4.05 -1.09 1.74 0.13 -5.00 116.66 105.06 1uph n ARG 91 Ca 0.07 0.77 -0.35 0.00 -0.77 0.00 0.00 57.85 57.58 1uph n ARG 91 Cb 0.35 -5.42 -0.09 0.00 -1.02 0.00 0.00 32.46 26.27 1uph n ARG 91 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1uph s ILE 92 N -3.34 4.76 -0.34 0.55 1.01 0.47 -4.99 121.20 119.32 1uph s ILE 92 Ca 0.26 -0.05 -0.40 0.00 0.00 0.00 0.00 60.65 60.46 1uph s ILE 92 Cb -0.03 -3.12 -0.16 0.00 0.01 0.00 0.00 42.46 39.16 1uph s ILE 92 CO 0.66 0.49 1.86 0.47 0.00 0.00 0.00 174.94 178.42 1uph n ASP 93 N 3.23 2.07 -4.40 3.58 8.00 -1.26 -4.65 116.55 123.12 1uph n ASP 93 Ca -0.17 0.92 -0.22 0.00 0.71 0.00 0.00 54.79 56.03 1uph n ASP 93 Cb 0.53 -1.11 -0.10 0.00 -0.02 0.00 0.00 41.12 40.41 1uph n ASP 93 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1uph s VAL 94 N 4.50 1.07 0.00 2.53 -7.23 -1.26 -4.90 120.40 115.11 1uph s VAL 94 Ca 1.04 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 59.21 1uph s VAL 94 Cb -1.12 -2.71 0.00 0.00 0.56 0.00 0.00 36.38 33.11 1uph s VAL 94 CO 0.64 0.00 0.00 2.29 -0.31 0.00 0.00 175.10 177.72 1uph n LYS 95 N -0.72 0.00 -4.10 4.82 0.00 -1.26 -4.93 118.16 111.97 1uph n LYS 95 Ca -0.03 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.20 1uph n LYS 95 Cb 0.66 0.00 -0.10 0.00 -0.00 0.00 0.00 35.03 35.59 1uph n LYS 95 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 1uph s ASP 96 N -1.39 0.65 0.38 -5.58 -4.77 -1.26 -0.08 116.67 104.61 1uph s ASP 96 Ca 0.00 -0.94 0.04 0.00 -3.30 0.00 0.00 52.55 48.35 1uph s ASP 96 Cb 0.00 0.16 0.73 0.00 -1.09 0.00 0.00 42.92 42.72 1uph s ASP 96 CO 0.00 -0.53 2.03 0.71 0.70 0.00 0.00 175.17 178.09 1uph h THR 97 N 3.28 1.14 -0.31 2.11 1.35 -1.40 0.35 112.91 119.44 1uph h THR 97 Ca -0.34 -0.25 -0.14 0.00 -0.55 0.00 0.00 66.41 65.13 1uph h THR 97 Cb 1.15 0.34 -0.00 0.00 -1.73 0.00 0.00 68.15 67.91 1uph h THR 97 CO 0.63 0.13 -0.34 0.50 -0.25 0.00 0.00 175.52 176.19 1uph h LYS 98 N 0.73 0.77 -0.12 4.72 3.11 -1.86 -0.06 116.57 123.87 1uph h LYS 98 Ca 0.20 -0.42 -0.10 0.00 -2.81 0.00 0.00 60.65 57.52 1uph h LYS 98 Cb -0.09 0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.15 1uph h LYS 98 CO -0.04 1.05 -0.35 1.49 -2.81 0.00 0.00 179.45 178.79 1uph h GLU 99 N 0.54 0.24 -0.00 1.90 4.57 -1.71 0.39 114.58 120.51 1uph h GLU 99 Ca 0.04 -0.10 -0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1uph h GLU 99 Cb 0.93 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.51 1uph h GLU 99 CO 0.08 0.57 -0.00 0.00 -1.18 0.00 0.00 179.01 178.48 1uph h ALA 100 N 1.43 0.00 -0.28 2.92 0.00 -0.17 0.40 119.26 123.56 1uph h ALA 100 Ca 0.02 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 1uph h ALA 100 Cb 0.73 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1uph h ALA 100 CO 0.05 -0.22 -0.13 1.25 0.00 0.00 0.00 179.25 180.20 1uph h LEU 101 N -0.55 0.46 -0.24 0.00 5.85 -0.90 0.10 115.31 120.03 1uph h LEU 101 Ca 0.00 -0.12 -0.15 0.00 0.84 0.00 0.00 57.88 58.45 1uph h LEU 101 Cb 0.55 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 1uph h LEU 101 CO 0.00 0.63 -0.42 -0.78 -0.34 0.00 0.00 178.44 177.53 1uph h ASP 102 N 0.44 0.79 -0.08 1.25 3.58 -0.16 0.39 116.42 122.64 1uph h ASP 102 Ca 0.08 -0.53 -0.00 0.00 0.42 0.00 0.00 57.03 57.00 1uph h ASP 102 Cb 0.50 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 41.32 1uph h ASP 102 CO 0.03 1.17 0.03 0.50 -2.88 0.00 0.00 179.24 178.09 1uph h LYS 103 N 0.44 0.11 -0.30 0.28 1.63 0.21 0.30 116.57 119.23 1uph h LYS 103 Ca 0.02 -0.02 -0.09 0.00 -0.85 0.00 0.00 60.65 59.71 1uph h LYS 103 Cb 1.02 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.61 1uph h LYS 103 CO 0.09 0.22 -0.17 0.97 -3.45 0.00 0.00 179.45 177.11 1uph h ILE 104 N -0.02 1.25 -0.65 2.00 6.09 -0.80 -1.14 117.51 124.24 1uph h ILE 104 Ca 0.03 -1.15 -0.09 0.00 -1.37 0.00 0.00 64.86 62.28 1uph h ILE 104 Cb 0.15 1.21 -0.03 0.00 0.47 0.00 0.00 36.82 38.62 1uph h ILE 104 CO -0.00 0.37 0.07 -0.08 -3.07 0.00 0.00 178.15 175.44 1uph h GLU 105 N 0.49 1.10 -0.13 2.19 4.22 0.23 0.14 114.58 122.81 1uph h GLU 105 Ca 0.08 -0.31 -0.03 0.00 0.08 0.00 0.00 59.36 59.18 1uph h GLU 105 Cb 0.58 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 1uph h GLU 105 CO 0.04 1.03 -0.02 0.93 -2.18 0.00 0.00 179.01 178.80 1uph h GLU 106 N 1.02 0.25 -0.23 1.92 5.08 -0.03 -1.09 114.58 121.50 1uph h GLU 106 Ca 0.19 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.42 1uph h GLU 106 Cb 0.48 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 1uph h GLU 106 CO 0.02 0.53 -0.05 0.93 -1.00 0.00 0.00 179.01 179.44 1uph h GLU 107 N -0.05 0.34 -0.07 2.33 4.39 -1.10 0.14 114.58 120.57 1uph h GLU 107 Ca 0.03 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 1uph h GLU 107 Cb 0.43 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.03 1uph h GLU 107 CO 0.01 0.42 -0.01 1.96 -1.16 0.00 0.00 179.01 180.23 1uph h GLN 108 N 0.33 0.13 0.24 2.33 7.50 -0.52 0.38 115.11 125.51 1uph h GLN 108 Ca 0.07 -0.05 -0.01 0.00 0.50 0.00 0.00 58.65 59.16 1uph h GLN 108 Cb 0.31 -0.01 0.00 0.00 0.05 0.00 0.00 27.48 27.83 1uph h GLN 108 CO 0.01 0.44 -0.12 -0.97 -1.50 0.00 0.00 178.83 176.70 1uph h ASN 109 N -0.19 -0.27 -0.05 1.46 -1.24 -0.89 -0.20 115.58 114.20 1uph h ASN 109 Ca 0.02 -0.13 0.02 0.00 0.71 0.00 0.00 56.30 56.91 1uph h ASN 109 Cb 0.39 0.07 -0.00 0.00 0.73 0.00 0.00 38.32 39.50 1uph h ASN 109 CO 0.01 -0.02 0.04 0.07 -1.29 0.00 0.00 177.43 176.24 1uph h LYS 110 N -0.53 0.00 0.46 6.67 5.09 -0.76 -0.27 116.57 127.23 1uph h LYS 110 Ca -0.03 0.00 -0.02 0.00 0.09 0.00 0.00 60.65 60.68 1uph h LYS 110 Cb 0.39 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.73 1uph h LYS 110 CO 0.05 0.00 -0.22 1.03 -2.09 0.00 0.00 179.45 178.23 1uph h SER 111 N 0.00 -0.52 -0.14 7.07 0.87 0.32 -0.96 113.55 120.20 1uph h SER 111 Ca 0.03 -0.09 0.04 0.00 -1.23 0.00 0.00 61.79 60.54 1uph h SER 111 Cb 0.11 0.13 -0.05 0.00 -0.44 0.00 0.00 62.40 62.16 1uph h SER 111 CO -0.00 -0.13 -0.16 0.11 -0.53 0.00 0.00 176.83 176.12 1uph h LYS 112 N -0.99 -0.19 -0.51 2.24 1.57 -0.53 -0.44 116.57 117.71 1uph h LYS 112 Ca -0.06 0.01 0.10 0.00 -1.87 0.00 0.00 60.65 58.83 1uph h LYS 112 Cb 0.58 0.04 -0.10 0.00 0.08 0.00 0.00 32.23 32.83 1uph h LYS 112 CO 0.10 -0.13 -0.12 -0.22 -0.57 0.00 0.00 179.45 178.52 1uph h LYS 113 N -0.20 0.01 -0.21 3.15 3.64 -1.10 0.15 116.57 122.01 1uph h LYS 113 Ca 0.10 -0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.54 1uph h LYS 113 Cb 0.34 -0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.10 1uph h LYS 113 CO -0.26 0.01 -0.23 0.87 -2.27 0.00 0.00 179.45 177.56 1uph h LYS 114 N 0.01 -0.24 -0.23 1.90 1.57 -0.09 0.20 116.57 119.69 1uph h LYS 114 Ca 0.25 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 59.10 1uph h LYS 114 Cb 0.38 0.06 -0.07 0.00 0.08 0.00 0.00 32.23 32.68 1uph h LYS 114 CO -0.52 -0.16 -0.23 0.00 -0.57 0.00 0.00 179.45 177.97 1uph h ALA 115 N 0.77 -0.12 -0.47 3.86 0.00 0.53 -0.14 119.26 123.69 1uph h ALA 115 Ca 0.13 0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.20 1uph h ALA 115 Cb 0.45 0.48 -0.08 0.00 0.00 0.00 0.00 17.79 18.63 1uph h ALA 115 CO -0.36 -0.66 -0.07 1.96 0.00 0.00 0.00 179.25 180.13 1uph h GLN 116 N -0.24 0.04 -0.23 0.00 4.20 0.29 0.18 115.11 119.34 1uph h GLN 116 Ca 0.13 -0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.90 1uph h GLN 116 Cb 0.44 -0.01 -0.06 0.00 0.30 0.00 0.00 27.48 28.15 1uph h GLN 116 CO -0.37 0.03 -0.17 0.37 -0.67 0.00 0.00 178.83 178.01 1uph h GLN 117 N 0.04 -0.16 0.38 1.46 4.15 0.62 -0.96 115.11 120.64 1uph h GLN 117 Ca 0.23 0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.66 1uph h GLN 117 Cb 0.35 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.06 1uph h GLN 117 CO -0.45 -0.11 -0.37 0.00 -1.93 0.00 0.00 178.83 175.97 1uph h ALA 118 N 0.96 -0.82 -0.98 3.38 0.00 0.08 0.16 119.26 122.04 1uph h ALA 118 Ca 0.13 -0.13 0.22 0.00 0.00 0.00 0.00 54.91 55.13 1uph h ALA 118 Cb 0.37 0.54 -0.18 0.00 0.00 0.00 0.00 17.79 18.51 1uph h ALA 118 CO -0.34 -0.99 -0.15 0.00 0.00 0.00 0.00 179.25 177.77 1uph h ALA 119 N -0.36 0.83 0.54 0.00 0.00 -0.18 0.45 119.26 120.54 1uph h ALA 119 Ca -0.03 0.37 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 1uph h ALA 119 Cb 0.69 0.69 0.01 0.00 0.00 0.00 0.00 17.79 19.18 1uph h ALA 119 CO -0.06 -0.45 -0.26 0.00 0.00 0.00 0.00 179.25 178.48 1uph h ALA 120 N 1.98 -0.72 -0.70 0.00 0.00 -0.41 1.53 119.26 120.93 1uph h ALA 120 Ca 0.51 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 55.30 1uph h ALA 120 Cb 0.89 0.28 -0.09 0.00 0.00 0.00 0.00 17.79 18.88 1uph h ALA 120 CO -0.97 -0.84 -0.43 0.22 0.00 0.00 0.00 179.25 177.23 1uph h ASP 121 N -0.86 -1.59 -0.12 0.00 1.82 0.26 -0.28 116.42 115.65 1uph h ASP 121 Ca -0.07 0.24 -0.01 0.00 -0.39 0.00 0.00 57.03 56.79 1uph h ASP 121 Cb 0.61 0.70 -0.01 0.00 0.68 0.00 0.00 39.33 41.31 1uph h ASP 121 CO 0.12 -0.18 0.03 0.00 -1.61 0.00 0.00 179.24 177.60 1uph h THR 122 N -0.02 1.19 0.00 2.25 1.03 -0.74 -3.48 112.91 113.14 1uph h THR 122 Ca 0.11 -0.59 0.00 0.00 -0.01 0.00 0.00 66.41 65.92 1uph h THR 122 Cb 0.31 1.35 0.00 0.00 -1.07 0.00 0.00 68.15 68.75 1uph h THR 122 CO -0.67 0.18 0.00 0.61 -0.01 0.00 0.00 175.52 175.62 1uph n GLY 123 N -0.53 0.37 0.00 2.99 0.00 0.49 -5.09 105.19 103.42 1uph n GLY 123 Ca -0.05 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1uph n GLY 123 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1uph n ASN 124 N 0.00 0.00 -3.72 1.61 2.85 0.76 -3.92 115.26 112.85 1uph n ASN 124 Ca 0.00 0.00 -0.07 0.00 -0.11 0.00 0.00 54.58 54.40 1uph n ASN 124 Cb 0.00 0.00 -0.02 0.00 1.24 0.00 0.00 39.78 41.00 1uph n ASN 124 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 1uph s ASN 125 N 0.00 -0.30 0.25 1.20 0.01 -1.26 -4.82 114.94 110.01 1uph s ASN 125 Ca 0.00 -0.39 -0.22 0.00 -0.71 0.00 0.00 52.86 51.54 1uph s ASN 125 Cb 0.00 0.61 0.03 0.00 0.41 0.00 0.00 41.25 42.30 1uph s ASN 125 CO 0.00 -1.09 0.79 -0.44 -1.51 0.00 0.00 177.10 174.84 1uph s SER 126 N -2.86 -0.23 -0.03 -1.22 0.01 -1.26 -5.03 113.70 103.08 1uph s SER 126 Ca 0.09 -0.57 -0.23 0.00 1.31 0.00 0.00 55.95 56.56 1uph s SER 126 Cb -0.03 0.67 0.05 0.00 0.21 0.00 0.00 66.02 66.91 1uph s SER 126 CO 0.01 -1.24 0.49 -1.58 0.41 0.00 0.00 173.24 171.33 1uph s GLN 127 N -3.72 0.86 0.05 12.44 -0.44 -1.26 -5.17 119.66 122.42 1uph s GLN 127 Ca 0.11 0.03 0.03 0.00 -2.50 0.00 0.00 55.36 53.04 1uph s GLN 127 Cb -0.05 0.39 -0.03 0.00 -1.64 0.00 0.00 33.01 31.69 1uph s GLN 127 CO 0.06 -0.25 -0.10 0.54 0.50 0.00 0.00 175.29 176.04 1uph s VAL 128 N -1.25 0.73 0.37 1.34 0.11 -1.26 -5.16 120.40 115.27 1uph s VAL 128 Ca -0.12 -1.20 0.05 0.00 -2.93 0.00 0.00 61.98 57.78 1uph s VAL 128 Cb -0.03 -0.81 -0.07 0.00 -1.53 0.00 0.00 36.38 33.95 1uph s VAL 128 CO 0.07 -0.36 0.04 -0.44 -3.33 0.00 0.00 175.10 171.08 1uph s SER 129 N -1.71 3.07 -0.30 3.54 0.01 -1.26 -5.15 113.70 111.90 1uph s SER 129 Ca -0.06 -1.38 -0.13 0.00 1.31 0.00 0.00 55.95 55.69 1uph s SER 129 Cb -0.09 -0.22 0.17 0.00 0.21 0.00 0.00 66.02 66.09 1uph s SER 129 CO 0.01 -0.54 0.95 -1.10 0.41 0.00 0.00 173.24 172.97 1uph s GLN 130 N -3.81 0.31 0.37 12.44 -1.52 -1.26 -5.17 119.66 121.01 1uph s GLN 130 Ca 0.36 0.71 0.08 0.00 -1.95 0.00 0.00 55.36 54.55 1uph s GLN 130 Cb 0.09 0.42 -0.04 0.00 -0.22 0.00 0.00 33.01 33.26 1uph s GLN 130 CO 0.17 -0.17 0.16 1.21 -0.25 0.00 0.00 175.29 176.40 1uph s ASN 131 N 2.61 4.60 0.00 5.90 2.47 -1.26 -5.39 114.94 123.87 1uph s ASN 131 Ca -0.00 -0.88 0.00 0.00 0.42 0.00 0.00 52.86 52.40 1uph s ASN 131 Cb -0.08 -0.63 0.00 0.00 -1.45 0.00 0.00 41.25 39.09 1uph s ASN 131 CO -0.17 -0.39 0.37 0.00 -3.72 0.00 0.00 177.10 173.20