#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 4.89 0.00 4.61 0.00 -1.26 -4.75 120.51 124.00 1uph n ALA 3 Ca 0.00 -4.60 0.00 0.00 0.00 0.00 0.00 53.44 48.84 1uph n ALA 3 Cb 0.00 -2.61 0.00 0.00 0.00 0.00 0.00 19.45 16.84 1uph n ALA 3 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1uph n ARG 4 N 2.71 0.00 -1.43 0.00 1.74 -1.26 -5.15 116.66 113.27 1uph n ARG 4 Ca 0.30 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 57.03 1uph n ARG 4 Cb 0.36 0.00 0.09 0.00 -1.02 0.00 0.00 32.46 31.89 1uph n ARG 4 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1uph n ALA 5 N 0.00 0.38 -0.01 7.54 0.00 -1.26 -4.94 120.51 122.22 1uph n ALA 5 Ca 0.00 -0.16 0.03 0.00 0.00 0.00 0.00 53.44 53.31 1uph n ALA 5 Cb 0.00 -2.24 -0.07 0.00 0.00 0.00 0.00 19.45 17.14 1uph n ALA 5 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1uph n SER 6 N -2.26 2.97 0.09 0.00 7.64 -1.26 -4.70 113.62 116.10 1uph n SER 6 Ca 0.14 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.98 1uph n SER 6 Cb 0.49 1.28 -0.02 0.00 -1.01 0.00 0.00 64.21 64.95 1uph n SER 6 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1uph h VAL 7 N 0.00 0.00 -3.18 0.44 2.07 -1.87 -3.40 116.25 110.30 1uph h VAL 7 Ca -0.04 -0.51 -0.63 0.00 0.82 0.00 0.00 66.70 66.33 1uph h VAL 7 Cb 0.60 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.24 1uph h VAL 7 CO 0.00 0.00 -0.70 -0.76 0.02 0.00 0.00 177.57 176.13 1uph s LEU 8 N -7.60 3.15 0.00 2.57 1.02 -1.26 -4.29 118.68 112.27 1uph s LEU 8 Ca -0.04 -0.42 -0.05 0.00 0.02 0.00 0.00 54.13 53.64 1uph s LEU 8 Cb 0.00 -1.87 0.13 0.00 0.02 0.00 0.00 46.19 44.47 1uph s LEU 8 CO 0.13 0.13 0.80 -0.24 0.02 0.00 0.00 176.35 177.19 1uph n SER 9 N 0.26 0.56 0.19 2.29 2.88 -1.26 -4.56 113.62 113.97 1uph n SER 9 Ca -0.11 -1.59 -0.15 0.00 -1.33 0.00 0.00 58.87 55.69 1uph n SER 9 Cb 0.54 -0.57 -0.07 0.00 -0.75 0.00 0.00 64.21 63.36 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 -0.77 -0.73 0.98 0.46 0.00 -1.98 0.42 103.07 101.45 1uph h GLY 10 Ca -0.26 0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.43 1uph h GLY 10 CO 0.23 -0.27 0.26 -1.33 0.00 0.00 0.00 176.54 175.43 1uph h GLY 11 N -0.65 0.86 1.81 4.60 0.00 -1.99 -0.08 103.07 107.62 1uph h GLY 11 Ca -0.01 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 46.88 1uph h GLY 11 CO -0.09 0.41 0.09 -2.09 0.00 0.00 0.00 176.54 174.86 1uph h GLU 12 N 0.75 0.25 -0.02 4.80 4.81 -1.85 -0.18 114.58 123.14 1uph h GLU 12 Ca 0.19 -0.02 -0.24 0.00 -0.13 0.00 0.00 59.36 59.15 1uph h GLU 12 Cb 0.13 -0.05 0.01 0.00 0.63 0.00 0.00 28.75 29.47 1uph h GLU 12 CO -0.02 0.20 -0.96 -0.07 -0.73 0.00 0.00 179.01 177.42 1uph h LEU 13 N 0.26 0.76 -1.21 1.64 -0.00 0.54 0.45 115.31 117.75 1uph h LEU 13 Ca 0.07 -0.59 -0.04 0.00 -0.00 0.00 0.00 57.88 57.31 1uph h LEU 13 Cb 0.03 -0.23 -0.02 0.00 -0.00 0.00 0.00 40.66 40.44 1uph h LEU 13 CO -0.01 1.39 0.10 -0.78 -0.00 0.00 0.00 178.44 179.14 1uph h ASP 14 N 0.35 0.59 0.30 -0.43 3.58 0.10 0.40 116.42 121.31 1uph h ASP 14 Ca -0.10 -0.09 -0.33 0.00 0.42 0.00 0.00 57.03 56.93 1uph h ASP 14 Cb 1.60 -0.15 0.02 0.00 1.72 0.00 0.00 39.33 42.52 1uph h ASP 14 CO 0.18 0.60 -1.59 0.50 -2.88 0.00 0.00 179.24 176.05 1uph h LYS 15 N 0.63 0.41 -0.03 0.28 1.63 -1.01 -3.25 116.57 115.22 1uph h LYS 15 Ca 0.14 -0.70 -0.03 0.00 -0.85 0.00 0.00 60.65 59.21 1uph h LYS 15 Cb 0.25 0.26 -0.01 0.00 -0.60 0.00 0.00 32.23 32.13 1uph h LYS 15 CO -0.00 1.32 -0.12 2.35 -3.45 0.00 0.00 179.45 179.55 1uph h TRP 16 N 0.11 0.05 -0.32 1.91 2.91 0.27 0.58 115.95 121.46 1uph h TRP 16 Ca -0.28 -0.00 -0.09 0.00 1.13 0.00 0.00 58.89 59.65 1uph h TRP 16 Cb 2.10 -0.02 -0.05 0.00 -0.51 0.00 0.00 29.16 30.68 1uph h TRP 16 CO 0.10 0.17 0.11 -0.85 -1.03 0.00 0.00 178.44 176.94 1uph n GLU 17 N -4.37 2.24 0.00 2.65 0.28 0.14 -3.17 120.64 118.41 1uph n GLU 17 Ca -0.02 -1.34 0.00 0.00 -0.16 0.00 0.00 57.16 55.64 1uph n GLU 17 Cb 0.21 -1.71 0.00 0.00 1.43 0.00 0.00 31.44 31.37 1uph n GLU 17 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1uph n LYS 18 N 0.08 -0.84 -3.11 3.44 4.81 0.20 -4.70 118.16 118.03 1uph n LYS 18 Ca 0.18 -0.44 -0.39 0.00 -0.87 0.00 0.00 58.31 56.78 1uph n LYS 18 Cb 0.80 -0.93 -0.05 0.00 0.02 0.00 0.00 35.03 34.86 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 -0.01 4.91 0.30 3.15 1.09 -1.19 -4.69 121.20 124.76 1uph s ILE 19 Ca 0.00 1.38 -0.16 0.00 -1.10 0.00 0.00 60.65 60.77 1uph s ILE 19 Cb 0.00 -4.00 -0.09 0.00 -1.06 0.00 0.00 42.46 37.31 1uph s ILE 19 CO 0.00 0.36 0.74 -0.13 -0.10 0.00 0.00 174.94 175.81 1uph s ARG 20 N 0.12 4.07 -0.00 2.79 0.52 0.01 -0.56 118.95 125.91 1uph s ARG 20 Ca 0.34 0.73 -0.20 0.00 -0.52 0.00 0.00 55.73 56.09 1uph s ARG 20 Cb -0.19 -2.54 -0.24 0.00 0.52 0.00 0.00 34.95 32.51 1uph s ARG 20 CO 0.19 0.21 1.09 -0.07 0.02 0.00 0.00 175.30 176.74 1uph h LEU 21 N 2.55 0.52 -8.39 2.53 3.38 -0.52 0.27 115.31 115.65 1uph h LEU 21 Ca -0.48 -0.77 -0.34 0.00 0.09 0.00 0.00 57.88 56.39 1uph h LEU 21 Cb 1.18 -0.16 -0.19 0.00 0.09 0.00 0.00 40.66 41.58 1uph h LEU 21 CO 0.65 1.22 -0.74 0.00 0.09 0.00 0.00 178.44 179.66 1uph s ARG 22 N -3.17 0.78 0.14 1.13 3.03 -1.26 -4.41 118.95 115.19 1uph s ARG 22 Ca -0.13 -1.03 -0.04 0.00 2.03 0.00 0.00 55.73 56.55 1uph s ARG 22 Cb 0.03 -0.57 -0.06 0.00 -1.03 0.00 0.00 34.95 33.33 1uph s ARG 22 CO 0.82 0.10 1.34 -1.00 -1.13 0.00 0.00 175.30 175.43 1uph h PRO 23 N 3.92 0.45 -0.65 3.89 0.13 -1.95 -3.11 132.00 134.68 1uph h PRO 23 Ca -0.38 -0.43 0.00 0.00 -0.87 0.00 0.00 66.00 64.32 1uph h PRO 23 Cb 1.19 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1uph h PRO 23 CO 0.47 1.08 0.00 0.41 -0.23 0.00 0.00 178.00 179.74 1uph n GLY 24 N 0.81 2.22 0.35 1.56 0.00 -1.26 -4.93 105.19 103.93 1uph n GLY 24 Ca -0.06 -0.73 -0.03 0.00 0.00 0.00 0.00 46.02 45.20 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 1.32 3.42 2.67 -0.02 0.00 -1.17 -5.08 105.19 106.33 1uph n GLY 25 Ca 0.22 -2.20 -0.09 0.00 0.00 0.00 0.00 46.02 43.96 1uph n GLY 25 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1uph n LYS 26 N -0.45 1.47 -4.40 1.61 5.02 -1.26 -4.84 118.16 115.32 1uph n LYS 26 Ca -0.01 -3.41 -0.21 0.00 -2.02 0.00 0.00 58.31 52.66 1uph n LYS 26 Cb 0.06 -1.41 -0.10 0.00 -0.02 0.00 0.00 35.03 33.56 1uph n LYS 26 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1uph s LYS 27 N -3.30 1.47 0.30 1.97 2.20 -1.26 -5.03 119.74 116.09 1uph s LYS 27 Ca 0.29 -1.65 -0.01 0.00 -0.36 0.00 0.00 55.97 54.25 1uph s LYS 27 Cb 0.43 -1.41 -0.02 0.00 -1.51 0.00 0.00 37.83 35.32 1uph s LYS 27 CO 0.01 0.25 0.35 -0.65 -0.36 0.00 0.00 175.35 174.95 1uph s GLN 28 N -3.51 1.68 0.55 4.03 -0.21 -1.26 0.22 119.66 121.15 1uph s GLN 28 Ca 0.25 -1.74 -0.06 0.00 0.02 0.00 0.00 55.36 53.83 1uph s GLN 28 Cb -0.03 0.38 -0.01 0.00 1.00 0.00 0.00 33.01 34.35 1uph s GLN 28 CO 0.10 -0.65 0.86 0.71 -2.12 0.00 0.00 175.29 174.19 1uph s TYR 29 N -3.51 3.37 0.22 0.91 1.51 0.27 -4.72 117.35 115.41 1uph s TYR 29 Ca 0.34 0.71 -0.14 0.00 -1.01 0.00 0.00 57.07 56.97 1uph s TYR 29 Cb 0.02 -2.58 0.05 0.00 -0.11 0.00 0.00 41.96 39.34 1uph s TYR 29 CO 0.19 -0.62 0.71 0.36 -1.11 0.00 0.00 175.55 175.08 1uph n LYS 30 N -2.47 0.68 0.20 -0.62 2.85 -1.26 -4.32 118.16 113.23 1uph n LYS 30 Ca 0.03 -1.42 0.17 0.00 -1.05 0.00 0.00 58.31 56.05 1uph n LYS 30 Cb 0.57 1.83 0.83 0.00 -0.65 0.00 0.00 35.03 37.61 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 -0.40 -5.58 7.12 -1.97 0.10 115.31 114.58 1uph h LEU 31 Ca -0.23 0.00 -0.02 0.00 0.13 0.00 0.00 57.88 57.76 1uph h LEU 31 Cb 0.94 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 41.05 1uph h LEU 31 CO 0.30 0.00 0.17 0.50 -0.13 0.00 0.00 178.44 179.29 1uph h LYS 32 N 0.00 0.59 -0.16 1.25 3.64 -1.98 0.30 116.57 120.20 1uph h LYS 32 Ca 0.09 -0.10 -0.16 0.00 -1.27 0.00 0.00 60.65 59.21 1uph h LYS 32 Cb 0.51 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 1uph h LYS 32 CO -0.00 0.54 -0.55 0.45 -2.27 0.00 0.00 179.45 177.62 1uph h HIS 33 N 0.50 0.62 -0.67 1.91 3.86 -1.24 -0.02 115.15 120.10 1uph h HIS 33 Ca 0.13 -0.22 -0.05 0.00 -1.16 0.00 0.00 60.37 59.07 1uph h HIS 33 Cb 0.16 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.49 1uph h HIS 33 CO -0.01 0.93 0.22 0.82 0.86 0.00 0.00 177.93 180.76 1uph h ILE 34 N 0.38 1.25 -0.13 2.45 1.08 -0.80 0.24 117.51 121.99 1uph h ILE 34 Ca 0.01 -0.85 -0.16 0.00 -0.39 0.00 0.00 64.86 63.46 1uph h ILE 34 Cb 1.09 0.53 -0.01 0.00 -3.07 0.00 0.00 36.82 35.36 1uph h ILE 34 CO 0.10 0.33 -0.61 0.58 -0.69 0.00 0.00 178.15 177.86 1uph h VAL 35 N 0.98 1.35 -0.07 1.67 2.07 -0.26 0.36 116.25 122.35 1uph h VAL 35 Ca 0.22 -1.93 -0.01 0.00 0.82 0.00 0.00 66.70 65.81 1uph h VAL 35 Cb 0.29 1.92 -0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1uph h VAL 35 CO -0.01 0.59 0.02 -0.25 0.02 0.00 0.00 177.57 177.94 1uph h TRP 36 N 0.32 0.12 -0.54 1.57 7.01 -0.47 0.17 115.95 124.13 1uph h TRP 36 Ca -0.01 -0.01 -0.11 0.00 2.11 0.00 0.00 58.89 60.87 1uph h TRP 36 Cb 1.15 -0.03 -0.02 0.00 -2.10 0.00 0.00 29.16 28.16 1uph h TRP 36 CO 0.04 0.27 -0.10 0.00 -2.79 0.00 0.00 178.44 175.86 1uph h ALA 37 N 0.84 0.74 -0.31 2.65 0.00 -0.45 -1.01 119.26 121.71 1uph h ALA 37 Ca 0.02 -0.35 0.04 0.00 0.00 0.00 0.00 54.91 54.63 1uph h ALA 37 Cb 0.21 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1uph h ALA 37 CO -0.00 0.65 0.09 0.66 0.00 0.00 0.00 179.25 180.65 1uph h SER 38 N 0.90 0.07 -0.54 0.00 4.64 -0.01 0.40 113.55 119.00 1uph h SER 38 Ca 0.14 0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.47 1uph h SER 38 Cb 0.66 0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.77 1uph h SER 38 CO 0.05 0.08 0.20 -0.09 -0.87 0.00 0.00 176.83 176.20 1uph h ARG 39 N 0.22 0.82 -0.72 4.77 2.43 -0.50 -0.78 114.38 120.63 1uph h ARG 39 Ca 0.14 -0.16 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 1uph h ARG 39 Cb 0.13 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.52 1uph h ARG 39 CO -0.16 0.73 0.37 1.49 -1.51 0.00 0.00 179.97 180.88 1uph h GLU 40 N 0.74 1.01 0.09 0.20 4.22 -0.51 0.46 114.58 120.79 1uph h GLU 40 Ca 0.18 -0.13 -0.00 0.00 0.08 0.00 0.00 59.36 59.49 1uph h GLU 40 Cb 0.23 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1uph h GLU 40 CO -0.01 0.77 -0.04 -0.07 -2.18 0.00 0.00 179.01 177.47 1uph h LEU 41 N 1.01 -0.10 -1.71 1.64 4.07 0.21 0.35 115.31 120.78 1uph h LEU 41 Ca 0.25 -0.22 0.04 0.00 0.08 0.00 0.00 57.88 58.04 1uph h LEU 41 Cb 0.07 0.03 -0.02 0.00 1.08 0.00 0.00 40.66 41.82 1uph h LEU 41 CO -0.04 0.16 0.26 -0.33 -1.08 0.00 0.00 178.44 177.42 1uph h GLU 42 N -0.36 0.36 0.00 1.13 4.39 -0.82 0.29 114.58 119.56 1uph h GLU 42 Ca -0.01 -0.02 -0.13 0.00 0.34 0.00 0.00 59.36 59.54 1uph h GLU 42 Cb 0.31 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.86 1uph h GLU 42 CO 0.02 0.24 -0.60 -0.09 -1.16 0.00 0.00 179.01 177.42 1uph h ARG 43 N 0.37 0.00 -0.01 2.33 2.43 -0.56 -3.03 114.38 115.91 1uph h ARG 43 Ca 0.17 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1uph h ARG 43 Cb 0.20 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1uph h ARG 43 CO -0.04 0.60 -0.01 1.19 -1.51 0.00 0.00 179.97 180.20 1uph n PHE 44 N -3.29 0.00 -2.56 2.20 3.01 0.12 -4.89 117.46 112.04 1uph n PHE 44 Ca 0.01 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.44 1uph n PHE 44 Cb 0.76 -0.02 0.01 0.00 -0.01 0.00 0.00 39.48 40.22 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 -0.47 -0.22 -2.46 4.37 0.00 -0.47 -5.04 120.51 116.21 1uph n ALA 45 Ca 0.21 0.05 -0.26 0.00 0.00 0.00 0.00 53.44 53.43 1uph n ALA 45 Cb 0.24 -1.15 -0.16 0.00 0.00 0.00 0.00 19.45 18.38 1uph n ALA 45 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1uph s VAL 46 N -3.05 1.54 0.09 0.00 1.01 0.79 -5.01 120.40 115.76 1uph s VAL 46 Ca 0.07 -0.83 -0.30 0.00 0.00 0.00 0.00 61.98 60.91 1uph s VAL 46 Cb -0.03 -1.28 -0.06 0.00 0.00 0.00 0.00 36.38 35.01 1uph s VAL 46 CO 0.11 0.44 1.12 0.21 0.00 0.00 0.00 175.10 176.97 1uph s ASN 47 N -0.45 7.21 0.11 3.32 3.84 -1.26 -3.42 114.94 124.29 1uph s ASN 47 Ca 0.07 1.96 -0.09 0.00 0.21 0.00 0.00 52.86 55.01 1uph s ASN 47 Cb -0.08 -2.59 -0.14 0.00 -0.55 0.00 0.00 41.25 37.90 1uph s ASN 47 CO -0.01 -0.34 1.28 1.55 -2.79 0.00 0.00 177.10 176.80 1uph h PRO 48 N 6.23 0.60 -0.84 0.43 0.13 -1.93 -3.11 132.00 133.52 1uph h PRO 48 Ca -0.42 -0.59 -0.01 0.00 -0.87 0.00 0.00 66.00 64.11 1uph h PRO 48 Cb 1.21 0.15 -0.04 0.00 0.13 0.00 0.00 31.00 32.46 1uph h PRO 48 CO 0.77 1.20 0.47 0.78 -0.23 0.00 0.00 178.00 180.99 1uph h GLY 49 N 0.80 1.25 2.00 1.56 0.00 -1.93 0.28 103.07 107.02 1uph h GLY 49 Ca -0.08 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 46.69 1uph h GLY 49 CO 0.17 0.53 0.00 1.47 0.00 0.00 0.00 176.54 178.72 1uph n LEU 50 N -4.40 0.28 0.01 3.11 -0.00 -1.22 -1.36 117.00 113.42 1uph n LEU 50 Ca 0.08 0.57 0.12 0.00 -0.00 0.00 0.00 56.01 56.78 1uph n LEU 50 Cb 0.09 -0.53 0.52 0.00 -0.00 0.00 0.00 43.42 43.50 1uph n LEU 50 CO 0.38 -0.38 0.89 -0.11 -0.00 0.00 0.00 177.39 178.18 1uph n LEU 51 N -1.80 0.06 0.00 1.47 7.94 0.09 -2.52 117.00 122.22 1uph n LEU 51 Ca 0.03 0.51 0.13 0.00 -1.11 0.00 0.00 56.01 55.56 1uph n LEU 51 Cb 0.20 -0.49 0.66 0.00 0.53 0.00 0.00 43.42 44.32 1uph n LEU 51 CO 0.16 -0.09 0.93 -1.84 -1.11 0.00 0.00 177.39 175.45 1uph n GLU 52 N -1.55 0.43 -4.37 1.96 0.28 -0.46 -4.60 120.64 112.33 1uph n GLU 52 Ca 0.06 0.04 -0.34 0.00 -0.16 0.00 0.00 57.16 56.76 1uph n GLU 52 Cb 0.30 -1.50 -0.12 0.00 1.43 0.00 0.00 31.44 31.55 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 -2.50 3.98 0.56 3.84 -4.23 -1.05 -4.87 115.64 111.38 1uph s THR 53 Ca 0.26 -0.33 0.26 0.00 -1.18 0.00 0.00 61.69 60.70 1uph s THR 53 Cb 0.17 -2.75 0.36 0.00 1.34 0.00 0.00 72.50 71.62 1uph s THR 53 CO 0.38 0.49 2.08 0.77 -0.54 0.00 0.00 174.62 177.80 1uph h SER 54 N 6.67 0.00 -0.03 3.99 4.64 -1.87 0.20 113.55 127.15 1uph h SER 54 Ca -0.32 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.99 1uph h SER 54 Cb 1.19 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1uph h SER 54 CO 0.64 0.00 -0.05 -0.08 -0.87 0.00 0.00 176.83 176.47 1uph h GLU 55 N 0.00 0.08 -0.79 4.77 4.22 -1.93 -0.08 114.58 120.85 1uph h GLU 55 Ca 0.12 -0.05 -0.03 0.00 0.08 0.00 0.00 59.36 59.47 1uph h GLU 55 Cb 0.55 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.77 1uph h GLU 55 CO -0.00 0.61 0.36 0.78 -2.18 0.00 0.00 179.01 178.58 1uph h GLY 56 N -0.44 1.22 1.19 1.92 0.00 -1.39 0.36 103.07 105.93 1uph h GLY 56 Ca 0.00 -0.61 -0.13 0.00 0.00 0.00 0.00 47.33 46.59 1uph h GLY 56 CO 0.01 0.58 -0.22 0.00 0.00 0.00 0.00 176.54 176.92 1uph h ARG 58 N 0.80 0.61 0.11 0.00 2.43 -0.32 0.26 114.38 118.26 1uph h ARG 58 Ca 0.11 -0.26 -0.01 0.00 -0.81 0.00 0.00 59.98 59.01 1uph h ARG 58 Cb 0.77 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1uph h ARG 58 CO 0.06 0.83 -0.05 0.37 -1.51 0.00 0.00 179.97 179.67 1uph h GLN 59 N 0.52 -0.14 -0.03 0.20 4.15 -0.01 0.81 115.11 120.62 1uph h GLN 59 Ca 0.07 0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.50 1uph h GLN 59 Cb 0.76 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.48 1uph h GLN 59 CO 0.06 0.31 0.02 0.82 -1.93 0.00 0.00 178.83 178.11 1uph h ILE 60 N -0.64 1.06 -0.26 2.39 2.04 -0.76 0.42 117.51 121.75 1uph h ILE 60 Ca -0.01 -0.16 0.05 0.00 1.00 0.00 0.00 64.86 65.73 1uph h ILE 60 Cb 0.51 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.65 1uph h ILE 60 CO 0.02 0.05 -0.01 0.25 0.00 0.00 0.00 178.15 178.46 1uph h LEU 61 N -0.01 -0.13 -1.89 1.44 7.12 -0.53 0.11 115.31 121.42 1uph h LEU 61 Ca 0.01 0.06 -0.02 0.00 0.13 0.00 0.00 57.88 58.06 1uph h LEU 61 Cb 0.06 0.11 -0.00 0.00 -0.53 0.00 0.00 40.66 40.30 1uph h LEU 61 CO -0.00 -0.03 -0.11 1.23 -0.13 0.00 0.00 178.44 179.40 1uph h GLY 62 N 0.07 0.00 1.48 3.75 0.00 -0.52 0.39 103.07 108.24 1uph h GLY 62 Ca 0.13 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.25 1uph h GLY 62 CO -0.22 0.00 -0.83 -1.61 0.00 0.00 0.00 176.54 173.88 1uph h GLN 63 N 0.00 0.49 0.00 4.80 4.15 0.22 -3.10 115.11 121.67 1uph h GLN 63 Ca -0.00 -0.45 0.00 0.00 0.77 0.00 0.00 58.65 58.97 1uph h GLN 63 Cb 0.36 0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.16 1uph h GLN 63 CO 0.01 1.09 -0.71 -0.07 -1.93 0.00 0.00 178.83 177.22 1uph h LEU 64 N 0.31 0.00 -0.89 -2.39 3.38 -0.28 -3.37 115.31 112.07 1uph h LEU 64 Ca -0.06 -0.17 0.14 0.00 0.09 0.00 0.00 57.88 57.88 1uph h LEU 64 Cb 1.44 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 42.04 1uph h LEU 64 CO 0.15 0.08 -0.38 -0.61 0.09 0.00 0.00 178.44 177.78 1uph h GLN 65 N 0.00 -0.04 0.00 1.13 4.15 -0.15 0.87 115.11 121.06 1uph h GLN 65 Ca 0.00 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.35 1uph h GLN 65 Cb 0.81 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.50 1uph h GLN 65 CO 0.00 -0.03 -0.37 -1.00 -1.93 0.00 0.00 178.83 175.50 1uph h PRO 66 N -0.04 0.00 0.00 -2.39 0.13 -1.73 -2.92 132.00 125.04 1uph h PRO 66 Ca 0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.45 1uph h PRO 66 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.71 1uph h PRO 66 CO -0.91 0.37 0.00 0.77 -0.23 0.00 0.00 178.00 178.00 1uph h SER 67 N 0.00 0.00 0.41 1.44 0.02 0.55 0.97 113.55 116.95 1uph h SER 67 Ca -0.00 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 60.79 1uph h SER 67 Cb 1.04 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.56 1uph h SER 67 CO 0.05 0.00 -0.67 -0.07 -1.14 0.00 0.00 176.83 174.99 1uph h LEU 68 N 0.00 0.27 -0.88 5.07 4.07 -1.03 -0.31 115.31 122.50 1uph h LEU 68 Ca 0.00 -0.17 0.36 0.00 0.08 0.00 0.00 57.88 58.14 1uph h LEU 68 Cb 0.05 -0.08 -0.16 0.00 1.08 0.00 0.00 40.66 41.55 1uph h LEU 68 CO 0.00 0.87 0.42 1.67 -1.08 0.00 0.00 178.44 180.32 1uph n GLN 69 N -3.82 -0.06 -2.75 1.13 7.27 0.34 -1.43 117.38 118.07 1uph n GLN 69 Ca -0.03 1.23 -0.00 0.00 0.07 0.00 0.00 57.00 58.27 1uph n GLN 69 Cb 0.67 -2.18 0.07 0.00 2.41 0.00 0.00 30.24 31.20 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 -5.04 0.95 -2.53 1.69 5.66 -1.20 -5.12 114.28 108.71 1uph n THR 70 Ca 0.32 -2.43 -0.24 0.00 -3.05 0.00 0.00 64.05 58.66 1uph n THR 70 Cb 1.09 1.23 0.09 0.00 -1.55 0.00 0.00 70.33 71.18 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 -3.16 1.77 0.59 1.09 0.00 -0.13 -5.09 107.32 102.39 1uph s GLY 71 Ca 0.23 -1.53 -0.04 0.00 0.00 0.00 0.00 44.72 43.38 1uph s GLY 71 CO -0.06 -1.03 0.87 -1.35 0.00 0.00 0.00 173.10 171.52 1uph s SER 72 N -4.65 5.40 0.22 1.64 1.04 -1.26 -4.87 113.70 111.21 1uph s SER 72 Ca 0.64 0.47 -0.09 0.00 0.48 0.00 0.00 55.95 57.45 1uph s SER 72 Cb -0.07 -1.41 0.24 0.00 0.10 0.00 0.00 66.02 64.89 1uph s SER 72 CO 0.43 -1.14 1.84 1.05 0.98 0.00 0.00 173.24 176.41 1uph h GLU 73 N -0.14 0.83 -0.30 4.02 4.11 -1.99 0.29 114.58 121.41 1uph h GLU 73 Ca -0.45 -0.05 -0.07 0.00 0.07 0.00 0.00 59.36 58.86 1uph h GLU 73 Cb 1.28 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 1uph h GLU 73 CO 0.59 0.55 -0.10 0.93 0.07 0.00 0.00 179.01 181.05 1uph h GLU 74 N 0.86 0.61 -0.97 1.06 3.07 -1.99 -1.24 114.58 115.97 1uph h GLU 74 Ca 0.31 -0.24 0.01 0.00 -0.50 0.00 0.00 59.36 58.94 1uph h GLU 74 Cb 0.10 -0.03 -0.05 0.00 -0.84 0.00 0.00 28.75 27.93 1uph h GLU 74 CO -0.14 0.81 0.64 1.25 -1.40 0.00 0.00 179.01 180.17 1uph h LEU 75 N 0.37 1.11 -0.10 1.33 6.46 -1.78 0.13 115.31 122.83 1uph h LEU 75 Ca 0.07 -0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 57.80 1uph h LEU 75 Cb 0.60 -0.28 -0.00 0.00 -0.73 0.00 0.00 40.66 40.25 1uph h LEU 75 CO 0.04 0.80 0.04 0.03 -0.62 0.00 0.00 178.44 178.72 1uph h ARG 76 N 1.31 0.15 -1.01 1.25 3.08 -0.25 -0.95 114.38 117.96 1uph h ARG 76 Ca 0.36 -0.03 0.06 0.00 0.07 0.00 0.00 59.98 60.44 1uph h ARG 76 Cb -0.14 -0.02 -0.07 0.00 0.08 0.00 0.00 29.97 29.82 1uph h ARG 76 CO -0.08 0.27 0.65 1.03 -1.07 0.00 0.00 179.97 180.77 1uph h SER 77 N -0.01 1.05 -0.26 7.04 0.87 -0.73 -0.66 113.55 120.86 1uph h SER 77 Ca 0.03 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.59 1uph h SER 77 Cb 0.18 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 1uph h SER 77 CO -0.00 0.68 0.14 0.25 -0.53 0.00 0.00 176.83 177.36 1uph h LEU 78 N 1.20 0.33 -0.75 2.23 7.12 -0.66 -0.95 115.31 123.84 1uph h LEU 78 Ca 0.43 -0.10 0.06 0.00 0.13 0.00 0.00 57.88 58.40 1uph h LEU 78 Cb 0.14 -0.08 -0.06 0.00 -0.53 0.00 0.00 40.66 40.13 1uph h LEU 78 CO -0.17 0.33 0.44 0.22 -0.13 0.00 0.00 178.44 179.14 1uph h TYR 79 N 0.30 0.82 -0.53 1.25 3.20 -0.18 0.10 116.97 121.94 1uph h TYR 79 Ca 0.09 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 1uph h TYR 79 Cb 0.08 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.07 1uph h TYR 79 CO -0.03 0.41 0.30 -0.91 -1.64 0.00 0.00 178.16 176.29 1uph h ASN 80 N 0.81 0.65 -0.53 -2.11 2.35 -0.78 0.04 115.58 116.01 1uph h ASN 80 Ca 0.33 -0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 56.00 1uph h ASN 80 Cb 0.17 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.35 1uph h ASN 80 CO -0.17 0.54 0.31 0.74 -1.65 0.00 0.00 177.43 177.20 1uph h THR 81 N 0.71 1.16 -0.62 2.81 2.02 -0.19 -0.97 112.91 117.83 1uph h THR 81 Ca 0.19 -0.38 0.01 0.00 0.77 0.00 0.00 66.41 67.00 1uph h THR 81 Cb 0.02 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 66.85 1uph h THR 81 CO -0.03 0.17 0.41 0.40 0.37 0.00 0.00 175.52 176.83 1uph h ILE 82 N 0.71 1.15 -0.29 3.11 2.04 -0.39 0.28 117.51 124.12 1uph h ILE 82 Ca 0.19 -0.28 0.04 0.00 1.00 0.00 0.00 64.86 65.80 1uph h ILE 82 Cb -0.00 0.25 -0.04 0.00 -0.74 0.00 0.00 36.82 36.29 1uph h ILE 82 CO -0.03 0.15 0.07 0.00 0.00 0.00 0.00 178.15 178.33 1uph h ALA 83 N 1.23 0.30 -0.50 1.87 0.00 -0.46 0.94 119.26 122.64 1uph h ALA 83 Ca 0.23 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.19 1uph h ALA 83 Cb -0.09 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1uph h ALA 83 CO -0.05 -0.34 0.33 0.28 0.00 0.00 0.00 179.25 179.46 1uph h VAL 84 N 0.18 1.12 -0.44 0.00 2.07 -0.59 -0.72 116.25 117.88 1uph h VAL 84 Ca 0.13 -0.23 -0.04 0.00 0.82 0.00 0.00 66.70 67.38 1uph h VAL 84 Cb 0.13 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 1uph h VAL 84 CO -0.16 0.12 0.12 0.25 0.02 0.00 0.00 177.57 177.92 1uph h LEU 85 N 0.67 0.66 -0.69 2.57 7.12 0.79 -0.22 115.31 126.20 1uph h LEU 85 Ca 0.18 -0.22 -0.02 0.00 0.13 0.00 0.00 57.88 57.96 1uph h LEU 85 Cb -0.07 -0.17 -0.03 0.00 -0.53 0.00 0.00 40.66 39.86 1uph h LEU 85 CO -0.04 0.70 0.36 0.22 -0.13 0.00 0.00 178.44 179.55 1uph h TYR 86 N 0.58 0.96 -0.76 1.25 3.20 0.28 -0.01 116.97 122.47 1uph h TYR 86 Ca 0.14 -0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.93 1uph h TYR 86 Cb 0.29 -0.30 -0.03 0.00 1.54 0.00 0.00 36.73 38.22 1uph h TYR 86 CO 0.02 0.70 0.29 0.00 -1.64 0.00 0.00 178.16 177.52 1uph h VAL 88 N 1.11 1.24 0.00 0.00 2.07 -0.34 0.39 116.25 120.72 1uph h VAL 88 Ca 0.25 -0.76 -0.07 0.00 0.82 0.00 0.00 66.70 66.94 1uph h VAL 88 Cb 0.24 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1uph h VAL 88 CO -0.02 0.30 -0.35 0.45 0.02 0.00 0.00 177.57 177.98 1uph h HIS 89 N 1.01 0.00 -0.00 1.57 -0.00 -0.17 -2.65 115.15 114.91 1uph h HIS 89 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.61 1uph h HIS 89 Cb 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.61 1uph h HIS 89 CO 0.02 0.35 -0.35 1.04 -0.00 0.00 0.00 177.93 178.98 1uph n GLN 90 N -3.36 0.29 -1.77 2.45 6.02 0.97 -4.82 117.38 117.17 1uph n GLN 90 Ca 0.01 -0.15 -0.01 0.00 -0.01 0.00 0.00 57.00 56.83 1uph n GLN 90 Cb 0.56 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.32 1uph n GLN 90 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1uph n ARG 91 N -1.22 -0.28 -4.51 -1.09 1.74 0.11 -5.04 116.66 106.38 1uph n ARG 91 Ca 0.08 0.44 -0.34 0.00 -0.77 0.00 0.00 57.85 57.27 1uph n ARG 91 Cb 0.33 -2.20 -0.12 0.00 -1.02 0.00 0.00 32.46 29.45 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 -3.03 3.73 -1.06 0.55 -1.09 0.34 -4.99 121.20 115.66 1uph s ILE 92 Ca 0.03 -0.43 -0.15 0.00 -2.23 0.00 0.00 60.65 57.88 1uph s ILE 92 Cb -0.00 -2.60 0.18 0.00 -1.58 0.00 0.00 42.46 38.45 1uph s ILE 92 CO 0.12 0.52 1.20 -1.81 -1.23 0.00 0.00 174.94 173.75 1uph s ASP 93 N 0.09 6.92 0.21 3.58 1.11 -1.26 -4.72 116.67 122.62 1uph s ASP 93 Ca -0.02 -2.73 0.08 0.00 0.18 0.00 0.00 52.55 50.07 1uph s ASP 93 Cb -0.14 -2.35 -0.04 0.00 1.07 0.00 0.00 42.92 41.46 1uph s ASP 93 CO 0.03 -0.76 -0.01 0.68 1.18 0.00 0.00 175.17 176.28 1uph s VAL 94 N 1.37 3.53 0.00 -1.27 -7.23 -1.26 -5.02 120.40 110.52 1uph s VAL 94 Ca 0.35 -1.66 0.00 0.00 -1.81 0.00 0.00 61.98 58.85 1uph s VAL 94 Cb -0.05 -2.82 0.00 0.00 0.56 0.00 0.00 36.38 34.07 1uph s VAL 94 CO -0.05 -0.22 0.38 1.17 -0.31 0.00 0.00 175.10 176.06 1uph n LYS 95 N -0.43 -0.25 -3.64 4.82 4.81 -1.26 -4.62 118.16 117.59 1uph n LYS 95 Ca -0.09 -0.38 -0.14 0.00 -0.87 0.00 0.00 58.31 56.83 1uph n LYS 95 Cb 0.57 -0.87 -0.07 0.00 0.02 0.00 0.00 35.03 34.67 1uph n LYS 95 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 1uph s ASP 96 N -0.07 -0.72 0.55 3.14 -4.77 -1.26 -0.81 116.67 112.73 1uph s ASP 96 Ca 0.00 1.38 0.21 0.00 -3.30 0.00 0.00 52.55 50.84 1uph s ASP 96 Cb 0.00 1.39 1.47 0.00 -1.09 0.00 0.00 42.92 44.69 1uph s ASP 96 CO 0.00 -0.25 2.19 0.00 0.70 0.00 0.00 175.17 177.81 1uph h THR 97 N 4.02 0.83 -0.45 2.11 1.03 -0.66 -0.92 112.91 118.88 1uph h THR 97 Ca -0.29 0.00 -0.04 0.00 -0.01 0.00 0.00 66.41 66.08 1uph h THR 97 Cb 1.16 1.00 -0.02 0.00 -1.07 0.00 0.00 68.15 69.22 1uph h THR 97 CO 0.08 0.00 0.14 0.50 -0.01 0.00 0.00 175.52 176.22 1uph h LYS 98 N 0.00 0.69 -0.31 0.00 3.11 -1.80 0.18 116.57 118.44 1uph h LYS 98 Ca 0.00 -0.15 -0.08 0.00 -2.81 0.00 0.00 60.65 57.61 1uph h LYS 98 Cb 0.01 -0.10 -0.01 0.00 -1.00 0.00 0.00 32.23 31.13 1uph h LYS 98 CO -0.00 0.67 -0.13 0.93 -2.81 0.00 0.00 179.45 178.11 1uph h GLU 99 N 0.58 0.64 -0.24 1.90 5.08 -1.61 0.41 114.58 121.33 1uph h GLU 99 Ca 0.14 -0.27 0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1uph h GLU 99 Cb 0.27 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1uph h GLU 99 CO -0.00 0.85 0.13 0.00 -1.00 0.00 0.00 179.01 178.99 1uph h ALA 100 N 0.77 0.30 -0.04 3.43 0.00 -1.06 0.42 119.26 123.08 1uph h ALA 100 Ca 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1uph h ALA 100 Cb 0.65 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1uph h ALA 100 CO 0.04 -0.27 -0.44 1.25 0.00 0.00 0.00 179.25 179.84 1uph h LEU 101 N 0.27 0.09 -0.55 0.00 5.85 -0.56 -0.23 115.31 120.19 1uph h LEU 101 Ca 0.10 -0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.67 1uph h LEU 101 Cb 0.01 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1uph h LEU 101 CO -0.06 0.52 -0.08 -0.78 -0.34 0.00 0.00 178.44 177.70 1uph h ASP 102 N 0.07 1.02 -0.04 1.25 1.82 0.89 0.40 116.42 121.84 1uph h ASP 102 Ca 0.00 -0.34 -0.02 0.00 -0.39 0.00 0.00 57.03 56.29 1uph h ASP 102 Cb 0.81 -0.28 -0.00 0.00 0.68 0.00 0.00 39.33 40.54 1uph h ASP 102 CO 0.06 1.12 -0.04 0.11 -1.61 0.00 0.00 179.24 178.88 1uph h LYS 103 N 0.90 0.09 -0.48 0.28 1.79 0.14 0.69 116.57 119.99 1uph h LYS 103 Ca 0.15 -0.05 -0.00 0.00 -2.18 0.00 0.00 60.65 58.56 1uph h LYS 103 Cb 0.65 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.28 1uph h LYS 103 CO 0.04 0.57 0.29 0.97 -1.08 0.00 0.00 179.45 180.24 1uph h ILE 104 N -0.38 1.14 -0.32 1.86 2.10 -0.97 -1.07 117.51 119.86 1uph h ILE 104 Ca 0.01 -0.30 -0.18 0.00 1.08 0.00 0.00 64.86 65.47 1uph h ILE 104 Cb 0.55 0.46 -0.00 0.00 -1.09 0.00 0.00 36.82 36.73 1uph h ILE 104 CO 0.01 0.14 -0.49 -0.08 -1.08 0.00 0.00 178.15 176.65 1uph h GLU 105 N 0.66 0.90 0.48 2.19 4.81 -0.07 -0.94 114.58 122.61 1uph h GLU 105 Ca 0.18 -0.54 -0.02 0.00 -0.13 0.00 0.00 59.36 58.85 1uph h GLU 105 Cb -0.03 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1uph h GLU 105 CO -0.03 1.18 -0.24 0.93 -0.73 0.00 0.00 179.01 180.11 1uph h GLU 106 N 0.71 -0.64 -0.41 1.92 3.07 0.12 0.17 114.58 119.52 1uph h GLU 106 Ca 0.03 0.04 0.01 0.00 -0.50 0.00 0.00 59.36 58.94 1uph h GLU 106 Cb 1.10 0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 29.13 1uph h GLU 106 CO 0.11 -0.42 0.26 1.49 -1.40 0.00 0.00 179.01 179.05 1uph h GLU 107 N -0.66 0.52 -0.29 2.33 4.22 -1.27 -1.07 114.58 118.36 1uph h GLU 107 Ca -0.06 -0.03 0.05 0.00 0.08 0.00 0.00 59.36 59.40 1uph h GLU 107 Cb 0.51 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.60 1uph h GLU 107 CO 0.10 0.35 -0.03 0.37 -2.18 0.00 0.00 179.01 177.61 1uph h GLN 108 N 0.54 0.05 -0.42 1.92 -0.00 -0.98 0.33 115.11 116.55 1uph h GLN 108 Ca 0.15 -0.00 0.05 0.00 -0.00 0.00 0.00 58.65 58.85 1uph h GLN 108 Cb -0.04 -0.01 -0.05 0.00 0.00 0.00 0.00 27.48 27.38 1uph h GLN 108 CO -0.04 0.03 0.15 -0.91 0.00 0.00 0.00 178.83 178.06 1uph h ASN 109 N 0.05 0.16 -0.83 -0.69 4.21 -0.28 0.26 115.58 118.46 1uph h ASN 109 Ca 0.14 0.05 0.03 0.00 1.21 0.00 0.00 56.30 57.72 1uph h ASN 109 Cb 0.20 0.03 -0.05 0.00 -1.12 0.00 0.00 38.32 37.38 1uph h ASN 109 CO -0.26 0.13 0.53 0.11 -1.29 0.00 0.00 177.43 176.65 1uph h LYS 110 N 0.32 1.02 0.41 0.81 1.57 -0.24 -0.61 116.57 119.85 1uph h LYS 110 Ca 0.20 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 1uph h LYS 110 Cb 0.18 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1uph h LYS 110 CO -0.20 0.67 -0.33 0.77 -0.57 0.00 0.00 179.45 179.79 1uph h SER 111 N 1.05 -0.86 -0.32 0.86 0.02 0.10 0.17 113.55 114.57 1uph h SER 111 Ca 0.32 0.07 0.07 0.00 -0.84 0.00 0.00 61.79 61.41 1uph h SER 111 Cb -0.02 0.28 -0.08 0.00 0.14 0.00 0.00 62.40 62.73 1uph h SER 111 CO -0.11 -0.49 -0.20 0.50 -1.14 0.00 0.00 176.83 175.40 1uph h LYS 112 N -0.74 -0.16 -0.32 3.45 3.64 -0.64 0.18 116.57 121.98 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 -0.11 -0.20 0.87 -2.27 0.00 0.00 179.45 177.73 1uph h LYS 113 N -0.17 -0.16 -0.20 1.90 1.57 -0.79 0.21 116.57 118.94 1uph h LYS 113 Ca 0.16 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 59.01 1uph h LYS 113 Cb 0.42 0.04 -0.06 0.00 0.08 0.00 0.00 32.23 32.70 1uph h LYS 113 CO -0.42 -0.11 -0.24 -0.22 -0.57 0.00 0.00 179.45 177.90 1uph h LYS 114 N -0.17 -0.26 -0.56 3.15 3.64 0.74 0.22 116.57 123.34 1uph h LYS 114 Ca 0.16 0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.67 1uph h LYS 114 Cb 0.42 0.06 -0.09 0.00 -0.41 0.00 0.00 32.23 32.21 1uph h LYS 114 CO -0.42 -0.17 0.04 0.00 -2.27 0.00 0.00 179.45 176.63 1uph h ALA 115 N 0.74 0.59 -0.19 5.00 0.00 0.56 0.30 119.26 126.26 1uph h ALA 115 Ca 0.12 0.15 0.05 0.00 0.00 0.00 0.00 54.91 55.24 1uph h ALA 115 Cb 0.45 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.43 1uph h ALA 115 CO -0.35 -0.36 -0.19 0.37 0.00 0.00 0.00 179.25 178.71 1uph h GLN 116 N 0.16 -0.21 -0.92 0.00 4.15 0.97 -0.42 115.11 118.85 1uph h GLN 116 Ca 0.29 0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.75 1uph h GLN 116 Cb 0.45 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 28.14 1uph h GLN 116 CO -0.44 -0.14 0.61 0.37 -1.93 0.00 0.00 178.83 177.29 1uph h GLN 117 N -0.22 1.16 0.03 1.69 4.15 0.41 0.27 115.11 122.61 1uph h GLN 117 Ca 0.12 -0.07 0.03 0.00 0.77 0.00 0.00 58.65 59.49 1uph h GLN 117 Cb 0.40 -0.26 -0.04 0.00 0.21 0.00 0.00 27.48 27.79 1uph h GLN 117 CO -0.32 0.77 -0.22 0.00 -1.93 0.00 0.00 178.83 177.13 1uph h ALA 118 N 1.45 -0.32 -0.63 3.38 0.00 0.10 0.03 119.26 123.27 1uph h ALA 118 Ca 0.35 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.18 1uph h ALA 118 Cb -0.07 0.39 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1uph h ALA 118 CO -0.09 -0.73 0.12 0.00 0.00 0.00 0.00 179.25 178.54 1uph h ALA 119 N 0.47 1.01 -0.12 0.00 0.00 -0.63 0.39 119.26 120.38 1uph h ALA 119 Ca 0.05 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.74 1uph h ALA 119 Cb 0.44 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 1uph h ALA 119 CO -0.18 0.63 -0.48 0.00 0.00 0.00 0.00 179.25 179.22 1uph h ALA 120 N 1.16 -0.75 0.00 0.00 0.00 0.49 0.18 119.26 120.34 1uph h ALA 120 Ca 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1uph h ALA 120 Cb 0.40 0.90 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1uph h ALA 120 CO 0.01 -1.01 0.00 0.22 0.00 0.00 0.00 179.25 178.46 1uph h ASP 121 N -0.55 0.00 -0.01 0.00 3.58 -0.88 -3.48 116.42 115.07 1uph h ASP 121 Ca 0.05 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.50 1uph h ASP 121 Cb 0.66 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.71 1uph h ASP 121 CO -0.41 0.00 0.00 1.07 -2.88 0.00 0.00 179.24 177.02 1uph n THR 122 N -3.05 0.00 0.00 2.25 5.66 0.14 -4.96 114.28 114.31 1uph n THR 122 Ca 0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.02 1uph n THR 122 Cb 0.39 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.17 1uph n THR 122 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1uph n GLY 123 N 0.00 0.01 0.00 1.09 0.00 -1.26 -4.93 105.19 100.10 1uph n GLY 123 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.61 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 0.00 -3.61 1.61 6.94 -1.26 -5.19 115.26 113.75 1uph n ASN 124 Ca 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 54.58 54.54 1uph n ASN 124 Cb 0.00 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 37.40 1uph n ASN 124 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1uph s ASN 125 N 0.00 -0.08 0.39 0.53 2.47 -1.26 -5.10 114.94 111.90 1uph s ASN 125 Ca 0.00 -0.02 0.00 0.00 0.42 0.00 0.00 52.86 53.26 1uph s ASN 125 Cb 0.00 0.10 0.00 0.00 -1.45 0.00 0.00 41.25 39.90 1uph s ASN 125 CO 0.00 -0.16 0.00 -0.24 -3.72 0.00 0.00 177.10 172.98 1uph n SER 126 N -0.15 -3.04 -2.88 -4.21 2.88 -1.26 -5.12 113.62 99.84 1uph n SER 126 Ca -0.00 0.73 -0.02 0.00 -1.33 0.00 0.00 58.87 58.26 1uph n SER 126 Cb 0.59 2.91 -0.01 0.00 -0.75 0.00 0.00 64.21 66.94 1uph n SER 126 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1uph n GLN 127 N -3.35 -2.57 -4.24 -1.46 7.27 -1.26 -5.04 117.38 106.73 1uph n GLN 127 Ca 0.00 2.17 -0.15 0.00 0.07 0.00 0.00 57.00 59.09 1uph n GLN 127 Cb 0.00 -3.21 -0.09 0.00 2.41 0.00 0.00 30.24 29.35 1uph n GLN 127 CO 0.00 0.00 0.00 0.14 0.07 0.00 0.00 177.06 177.27 1uph s VAL 128 N -0.82 0.03 0.38 1.69 -7.23 -1.26 -5.11 120.40 108.09 1uph s VAL 128 Ca -0.08 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.09 1uph s VAL 128 Cb 0.01 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.44 1uph s VAL 128 CO 0.42 0.00 0.00 -0.24 -0.31 0.00 0.00 175.10 174.97 1uph n SER 129 N -0.74 -6.16 -2.66 4.85 2.88 -1.26 -5.04 113.62 105.48 1uph n SER 129 Ca 0.04 1.03 -0.04 0.00 -1.33 0.00 0.00 58.87 58.57 1uph n SER 129 Cb 0.65 -3.12 0.06 0.00 -0.75 0.00 0.00 64.21 61.04 1uph n SER 129 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1uph n GLN 130 N -1.42 0.09 -1.27 -1.46 0.00 -1.26 -5.15 117.38 106.91 1uph n GLN 130 Ca 0.00 -0.68 0.15 0.00 -0.00 0.00 0.00 57.00 56.47 1uph n GLN 130 Cb 0.12 -0.02 -0.06 0.00 0.00 0.00 0.00 30.24 30.28 1uph n GLN 130 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1uph n ASN 131 N 1.94 -6.88 0.00 1.69 4.13 -1.26 -5.37 115.26 109.51 1uph n ASN 131 Ca 0.05 0.91 0.00 0.00 1.68 0.00 0.00 54.58 57.22 1uph n ASN 131 Cb 0.69 -4.15 0.00 0.00 -1.54 0.00 0.00 39.78 34.77 1uph n ASN 131 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54