#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 -2.12 0.00 4.61 0.00 -1.26 -4.97 120.51 116.76 1uph n ALA 3 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1uph n ALA 3 Cb 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.35 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 0.78 0.00 -0.09 0.00 1.74 -1.26 -4.88 116.66 112.95 1uph n ARG 4 Ca -0.03 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.06 1uph n ARG 4 Cb 0.55 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 31.99 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 -0.93 -0.44 -2.27 7.54 0.00 -1.26 -4.88 120.51 118.27 1uph n ALA 5 Ca 0.00 0.03 -0.03 0.00 0.00 0.00 0.00 53.44 53.44 1uph n ALA 5 Cb 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.32 1uph n ALA 5 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1uph n SER 6 N -3.79 -1.99 0.00 0.00 2.88 -1.26 -4.93 113.62 104.54 1uph n SER 6 Ca 0.00 -0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.51 1uph n SER 6 Cb 0.04 -1.09 0.00 0.00 -0.75 0.00 0.00 64.21 62.41 1uph n SER 6 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1uph n VAL 7 N -3.58 0.00 -3.52 2.46 0.31 -1.26 -3.34 118.33 109.40 1uph n VAL 7 Ca -0.02 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.25 1uph n VAL 7 Cb 0.52 -0.66 0.02 0.00 -0.91 0.00 0.00 33.84 32.80 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 -2.52 0.00 0.00 7.52 -0.00 -1.26 -4.39 117.00 116.35 1uph n LEU 8 Ca 0.00 -1.64 -0.26 0.00 -0.00 0.00 0.00 56.01 54.11 1uph n LEU 8 Cb 0.45 2.37 0.19 0.00 -0.00 0.00 0.00 43.42 46.43 1uph n LEU 8 CO 0.00 -0.54 0.69 -0.24 -0.00 0.00 0.00 177.39 177.31 1uph n SER 9 N -1.36 -0.53 0.13 1.45 2.88 -1.26 -4.80 113.62 110.13 1uph n SER 9 Ca -0.05 -1.32 -0.13 0.00 -1.33 0.00 0.00 58.87 56.04 1uph n SER 9 Cb 0.37 -0.88 -0.08 0.00 -0.75 0.00 0.00 64.21 62.87 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 -1.79 -0.35 0.61 0.46 0.00 -2.02 -0.39 103.07 99.58 1uph h GLY 10 Ca -0.37 0.13 0.05 0.00 0.00 0.00 0.00 47.33 47.14 1uph h GLY 10 CO 0.25 -0.13 0.11 -1.33 0.00 0.00 0.00 176.54 175.45 1uph h GLY 11 N -0.67 0.48 1.01 4.60 0.00 -1.98 0.53 103.07 107.04 1uph h GLY 11 Ca -0.03 -0.06 -0.00 0.00 0.00 0.00 0.00 47.33 47.24 1uph h GLY 11 CO 0.06 0.00 0.54 0.83 0.00 0.00 0.00 176.54 177.97 1uph h GLU 12 N 0.26 1.18 -0.14 4.80 5.08 -1.93 -0.35 114.58 123.47 1uph h GLU 12 Ca 0.18 -0.10 -0.10 0.00 -1.00 0.00 0.00 59.36 58.34 1uph h GLU 12 Cb 0.18 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1uph h GLU 12 CO -0.21 0.81 -0.37 -0.07 -1.00 0.00 0.00 179.01 178.18 1uph h LEU 13 N 1.20 0.32 -0.58 1.33 3.38 -0.14 0.33 115.31 121.15 1uph h LEU 13 Ca 0.32 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 58.09 1uph h LEU 13 Cb -0.07 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1uph h LEU 13 CO -0.06 0.67 0.10 0.44 0.09 0.00 0.00 178.44 179.68 1uph h ASP 14 N 0.26 0.91 0.11 -0.43 3.32 0.11 -0.54 116.42 120.17 1uph h ASP 14 Ca 0.03 -0.26 -0.23 0.00 0.02 0.00 0.00 57.03 56.59 1uph h ASP 14 Cb 0.78 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 40.10 1uph h ASP 14 CO 0.06 0.93 -0.90 0.11 -1.72 0.00 0.00 179.24 177.72 1uph h LYS 15 N 0.85 0.59 -0.96 3.56 1.79 -0.79 -3.06 116.57 118.54 1uph h LYS 15 Ca 0.18 -0.57 0.07 0.00 -2.18 0.00 0.00 60.65 58.15 1uph h LYS 15 Cb 0.40 0.15 -0.07 0.00 -1.58 0.00 0.00 32.23 31.14 1uph h LYS 15 CO 0.01 1.19 0.62 2.35 -1.08 0.00 0.00 179.45 182.54 1uph h TRP 16 N 0.36 1.12 -0.37 -1.35 2.91 -0.09 0.32 115.95 118.85 1uph h TRP 16 Ca -0.08 0.03 -0.17 0.00 1.13 0.00 0.00 58.89 59.80 1uph h TRP 16 Cb 1.53 -0.37 -0.10 0.00 -0.51 0.00 0.00 29.16 29.72 1uph h TRP 16 CO 0.08 0.56 0.21 -0.85 -1.03 0.00 0.00 178.44 177.41 1uph n GLU 17 N -4.51 1.75 0.00 2.65 0.28 -0.23 -3.21 120.64 117.36 1uph n GLU 17 Ca 0.15 -1.25 0.00 0.00 -0.16 0.00 0.00 57.16 55.91 1uph n GLU 17 Cb 0.22 -1.55 0.00 0.00 1.43 0.00 0.00 31.44 31.53 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 2.26 -3.20 3.44 3.00 0.11 -4.48 118.16 119.21 1uph n LYS 18 Ca 0.22 -0.31 -0.34 0.00 -0.00 0.00 0.00 58.31 57.88 1uph n LYS 18 Cb 0.91 -0.81 -0.06 0.00 0.00 0.00 0.00 35.03 35.08 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 -0.44 4.71 0.12 3.15 1.09 -1.20 -4.92 121.20 123.71 1uph s ILE 19 Ca 0.00 0.98 0.01 0.00 -1.10 0.00 0.00 60.65 60.54 1uph s ILE 19 Cb 0.00 -3.72 -0.04 0.00 -1.06 0.00 0.00 42.46 37.64 1uph s ILE 19 CO 0.01 0.05 0.27 0.00 -0.10 0.00 0.00 174.94 175.17 1uph s ARG 20 N -2.41 3.45 0.00 2.79 1.70 -0.37 -0.83 118.95 123.29 1uph s ARG 20 Ca 0.46 -0.51 -0.11 0.00 -0.47 0.00 0.00 55.73 55.10 1uph s ARG 20 Cb -0.13 -2.98 -0.32 0.00 -0.57 0.00 0.00 34.95 30.95 1uph s ARG 20 CO 0.19 0.54 0.87 -0.07 -1.08 0.00 0.00 175.30 175.75 1uph h LEU 21 N 2.46 0.65 -9.40 -1.89 3.38 -1.49 0.50 115.31 109.52 1uph h LEU 21 Ca -0.47 -0.81 -0.62 0.00 0.09 0.00 0.00 57.88 56.06 1uph h LEU 21 Cb 1.18 -0.21 -0.13 0.00 0.09 0.00 0.00 40.66 41.59 1uph h LEU 21 CO 0.71 1.66 -0.69 -0.60 0.09 0.00 0.00 178.44 179.61 1uph s ARG 22 N -2.60 2.26 0.13 1.13 3.52 -1.26 -4.49 118.95 117.64 1uph s ARG 22 Ca -0.11 -1.12 -0.05 0.00 -0.13 0.00 0.00 55.73 54.31 1uph s ARG 22 Cb 0.05 -2.30 -0.07 0.00 -1.56 0.00 0.00 34.95 31.07 1uph s ARG 22 CO 0.89 0.46 1.33 -1.00 -0.81 0.00 0.00 175.30 176.17 1uph h PRO 23 N 2.98 0.48 -0.00 5.12 0.13 -1.98 -3.06 132.00 135.68 1uph h PRO 23 Ca -0.47 -0.47 0.00 0.00 -0.87 0.00 0.00 66.00 64.19 1uph h PRO 23 Cb 1.19 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1uph h PRO 23 CO 0.56 1.11 -0.12 0.41 -0.23 0.00 0.00 178.00 179.73 1uph n GLY 24 N 0.83 -1.34 0.00 1.56 0.00 -1.26 -5.02 105.19 99.95 1uph n GLY 24 Ca -0.07 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 1.44 2.18 0.00 -0.02 0.00 -1.16 -5.10 105.19 102.53 1uph n GLY 25 Ca 0.09 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.08 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 0.62 0.00 -3.84 1.61 4.76 -1.26 -4.60 118.16 115.45 1uph n LYS 26 Ca 0.00 0.00 -0.05 0.00 -2.87 0.00 0.00 58.31 55.39 1uph n LYS 26 Cb 0.00 0.00 0.02 0.00 -1.84 0.00 0.00 35.03 33.21 1uph n LYS 26 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1uph s LYS 27 N 0.00 1.64 0.29 1.97 1.02 -1.26 -5.06 119.74 118.35 1uph s LYS 27 Ca 0.00 -1.04 0.03 0.00 0.02 0.00 0.00 55.97 54.98 1uph s LYS 27 Cb 0.00 0.47 -0.04 0.00 -0.52 0.00 0.00 37.83 37.74 1uph s LYS 27 CO 0.00 -0.77 0.14 1.14 -0.92 0.00 0.00 175.35 174.94 1uph s GLN 28 N -2.39 1.55 0.82 1.68 -2.07 -1.26 -1.20 119.66 116.80 1uph s GLN 28 Ca 0.18 -1.87 -0.12 0.00 -1.82 0.00 0.00 55.36 51.73 1uph s GLN 28 Cb -0.03 -0.15 0.08 0.00 -1.09 0.00 0.00 33.01 31.82 1uph s GLN 28 CO 0.07 -0.41 1.12 0.71 -1.32 0.00 0.00 175.29 175.46 1uph s TYR 29 N -3.64 2.82 -0.21 9.60 1.51 -0.01 -4.88 117.35 122.54 1uph s TYR 29 Ca 0.36 0.99 0.00 0.00 -1.01 0.00 0.00 57.07 57.40 1uph s TYR 29 Cb 0.06 -3.25 0.00 0.00 -0.11 0.00 0.00 41.96 38.66 1uph s TYR 29 CO 0.16 -1.87 0.00 0.36 -1.11 0.00 0.00 175.55 173.09 1uph n LYS 30 N -3.46 -2.88 0.28 -0.62 2.85 -1.26 -4.24 118.16 108.83 1uph n LYS 30 Ca 0.07 0.00 0.18 0.00 -1.05 0.00 0.00 58.31 57.51 1uph n LYS 30 Cb 0.58 0.00 0.88 0.00 -0.65 0.00 0.00 35.03 35.84 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 -0.29 -5.58 7.12 -1.97 0.24 115.31 114.83 1uph h LEU 31 Ca 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 57.88 57.97 1uph h LEU 31 Cb 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.12 1uph h LEU 31 CO 0.00 0.00 0.01 0.50 -0.13 0.00 0.00 178.44 178.82 1uph h LYS 32 N 0.00 0.50 -0.17 1.25 3.64 -1.98 0.40 116.57 120.21 1uph h LYS 32 Ca 0.04 -0.15 -0.16 0.00 -1.27 0.00 0.00 60.65 59.11 1uph h LYS 32 Cb 0.58 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 1uph h LYS 32 CO -0.00 0.64 -0.55 0.45 -2.27 0.00 0.00 179.45 177.72 1uph h HIS 33 N 0.29 0.65 -0.22 1.91 3.86 -0.95 -0.87 115.15 119.82 1uph h HIS 33 Ca 0.08 -0.23 -0.10 0.00 -1.16 0.00 0.00 60.37 58.96 1uph h HIS 33 Cb 0.41 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 1uph h HIS 33 CO 0.03 0.95 -0.31 0.82 0.86 0.00 0.00 177.93 180.28 1uph h ILE 34 N 0.39 1.28 -0.21 2.45 2.04 -1.05 0.19 117.51 122.61 1uph h ILE 34 Ca 0.01 -1.37 -0.15 0.00 1.00 0.00 0.00 64.86 64.35 1uph h ILE 34 Cb 1.09 1.46 0.00 0.00 -0.74 0.00 0.00 36.82 38.63 1uph h ILE 34 CO 0.10 0.43 -0.44 0.58 0.00 0.00 0.00 178.15 178.82 1uph h VAL 35 N 0.38 1.32 -0.06 1.67 2.07 0.03 0.31 116.25 121.96 1uph h VAL 35 Ca 0.05 -1.66 -0.00 0.00 0.82 0.00 0.00 66.70 65.90 1uph h VAL 35 Cb 0.74 1.84 -0.00 0.00 -1.52 0.00 0.00 31.29 32.35 1uph h VAL 35 CO 0.06 0.52 0.02 -0.25 0.02 0.00 0.00 177.57 177.94 1uph h TRP 36 N 0.36 0.10 -0.34 1.57 7.01 -0.93 0.17 115.95 123.89 1uph h TRP 36 Ca 0.00 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1uph h TRP 36 Cb 1.04 -0.03 -0.02 0.00 -2.10 0.00 0.00 29.16 28.06 1uph h TRP 36 CO 0.09 0.26 0.22 0.00 -2.79 0.00 0.00 178.44 176.21 1uph h ALA 37 N 0.83 0.44 -0.93 2.65 0.00 -0.60 -0.71 119.26 120.94 1uph h ALA 37 Ca 0.02 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.96 1uph h ALA 37 Cb 0.20 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 17.79 1uph h ALA 37 CO -0.00 -0.08 0.59 1.03 0.00 0.00 0.00 179.25 180.78 1uph h SER 38 N 0.46 0.92 -0.57 0.00 0.87 -0.14 0.63 113.55 115.72 1uph h SER 38 Ca 0.12 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.68 1uph h SER 38 Cb -0.03 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.73 1uph h SER 38 CO -0.03 0.58 0.26 -0.09 -0.53 0.00 0.00 176.83 177.03 1uph h ARG 39 N 1.05 0.83 -0.70 2.24 2.43 0.05 -1.28 114.38 119.01 1uph h ARG 39 Ca 0.41 -0.13 -0.05 0.00 -0.81 0.00 0.00 59.98 59.40 1uph h ARG 39 Cb 0.19 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.57 1uph h ARG 39 CO -0.18 0.69 0.24 1.49 -1.51 0.00 0.00 179.97 180.70 1uph h GLU 40 N 0.77 1.06 0.11 0.20 4.81 -0.02 0.11 114.58 121.63 1uph h GLU 40 Ca 0.19 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1uph h GLU 40 Cb 0.15 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.36 1uph h GLU 40 CO -0.02 0.89 -0.05 -0.07 -0.73 0.00 0.00 179.01 179.03 1uph h LEU 41 N 1.03 -0.13 -1.57 1.64 -0.00 -0.47 0.50 115.31 116.32 1uph h LEU 41 Ca 0.23 -0.02 -0.01 0.00 -0.00 0.00 0.00 57.88 58.07 1uph h LEU 41 Cb 0.26 0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 40.93 1uph h LEU 41 CO -0.01 -0.06 0.11 -0.33 -0.00 0.00 0.00 178.44 178.15 1uph h GLU 42 N -0.18 0.39 0.00 1.13 4.39 -0.99 0.12 114.58 119.44 1uph h GLU 42 Ca -0.02 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 1uph h GLU 42 Cb 0.14 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 28.71 1uph h GLU 42 CO 0.03 0.33 -0.11 -0.09 -1.16 0.00 0.00 179.01 178.01 1uph h ARG 43 N 0.40 0.00 -0.00 2.33 2.43 -0.28 -2.91 114.38 116.34 1uph h ARG 43 Ca 0.10 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1uph h ARG 43 Cb 0.09 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1uph h ARG 43 CO -0.01 0.11 -0.21 1.19 -1.51 0.00 0.00 179.97 179.53 1uph n PHE 44 N -3.15 0.00 -1.97 2.20 3.01 0.17 -4.91 117.46 112.81 1uph n PHE 44 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.49 1uph n PHE 44 Cb 0.52 -0.34 0.00 0.00 -0.01 0.00 0.00 39.48 39.65 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 -1.39 0.00 -2.41 4.37 0.00 -0.83 -5.06 120.51 115.19 1uph n ALA 45 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.23 1uph n ALA 45 Cb 0.33 -0.48 -0.13 0.00 0.00 0.00 0.00 19.45 19.17 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 -2.14 2.38 -0.06 0.00 0.11 -0.50 -5.04 120.40 115.15 1uph s VAL 46 Ca 0.00 -1.73 -0.30 0.00 -2.93 0.00 0.00 61.98 57.02 1uph s VAL 46 Cb 0.00 -2.07 -0.03 0.00 -1.53 0.00 0.00 36.38 32.75 1uph s VAL 46 CO 0.00 0.08 1.19 0.21 -3.33 0.00 0.00 175.10 173.25 1uph s ASN 47 N -2.12 7.06 0.14 3.54 2.47 -1.26 -3.85 114.94 120.92 1uph s ASN 47 Ca 0.15 1.80 -0.04 0.00 0.42 0.00 0.00 52.86 55.19 1uph s ASN 47 Cb -0.10 -2.56 -0.05 0.00 -1.45 0.00 0.00 41.25 37.10 1uph s ASN 47 CO 0.07 -0.58 1.35 1.55 -3.72 0.00 0.00 177.10 175.76 1uph h PRO 48 N 7.46 0.43 -0.69 0.43 0.13 -1.91 -3.18 132.00 134.68 1uph h PRO 48 Ca -0.34 -0.41 0.05 0.00 -0.87 0.00 0.00 66.00 64.43 1uph h PRO 48 Cb 1.16 0.11 -0.04 0.00 0.13 0.00 0.00 31.00 32.35 1uph h PRO 48 CO 0.88 1.07 0.45 0.78 -0.23 0.00 0.00 178.00 180.95 1uph h GLY 49 N 1.23 0.91 2.00 1.56 0.00 -1.91 0.38 103.07 107.23 1uph h GLY 49 Ca -0.06 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1uph h GLY 49 CO 0.15 0.24 0.00 1.47 0.00 0.00 0.00 176.54 178.40 1uph n LEU 50 N -4.47 0.25 0.00 3.11 -0.00 -1.20 -1.16 117.00 113.53 1uph n LEU 50 Ca 0.09 0.58 0.11 0.00 -0.00 0.00 0.00 56.01 56.79 1uph n LEU 50 Cb 0.19 -0.56 0.56 0.00 -0.00 0.00 0.00 43.42 43.61 1uph n LEU 50 CO 0.34 -0.46 0.84 -0.11 -0.00 0.00 0.00 177.39 178.00 1uph n LEU 51 N -1.79 0.00 0.00 1.47 7.94 0.13 -2.30 117.00 122.45 1uph n LEU 51 Ca 0.02 0.23 0.13 0.00 -1.11 0.00 0.00 56.01 55.28 1uph n LEU 51 Cb 0.14 -0.23 0.67 0.00 0.53 0.00 0.00 43.42 44.53 1uph n LEU 51 CO 0.12 -0.07 0.94 1.21 -1.11 0.00 0.00 177.39 178.48 1uph n GLU 52 N -1.23 0.43 -4.99 1.96 2.13 -0.31 -4.61 120.64 114.03 1uph n GLU 52 Ca 0.11 0.04 -0.32 0.00 0.66 0.00 0.00 57.16 57.65 1uph n GLU 52 Cb 0.15 -1.50 -0.14 0.00 0.27 0.00 0.00 31.44 30.22 1uph n GLU 52 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 1uph s THR 53 N -2.49 2.76 0.50 6.31 -4.23 -0.97 -4.78 115.64 112.74 1uph s THR 53 Ca 0.27 -0.82 0.20 0.00 -1.18 0.00 0.00 61.69 60.15 1uph s THR 53 Cb 0.17 -2.07 0.34 0.00 1.34 0.00 0.00 72.50 72.28 1uph s THR 53 CO 0.38 0.57 2.04 0.77 -0.54 0.00 0.00 174.62 177.85 1uph h SER 54 N 5.74 0.09 -0.15 3.99 4.64 -1.86 -0.80 113.55 125.21 1uph h SER 54 Ca -0.39 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.88 1uph h SER 54 Cb 1.16 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1uph h SER 54 CO 0.50 0.05 -0.08 -0.33 -0.87 0.00 0.00 176.83 176.11 1uph h GLU 55 N 0.10 0.32 -0.60 4.77 5.08 -1.94 -0.54 114.58 121.76 1uph h GLU 55 Ca 0.18 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1uph h GLU 55 Cb 0.57 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 1uph h GLU 55 CO -0.02 0.65 0.40 0.78 -1.00 0.00 0.00 179.01 179.82 1uph h GLY 56 N -0.01 0.85 1.03 -3.84 0.00 -1.35 0.41 103.07 100.16 1uph h GLY 56 Ca 0.03 -0.32 -0.05 0.00 0.00 0.00 0.00 47.33 47.00 1uph h GLY 56 CO 0.02 0.31 0.22 0.00 0.00 0.00 0.00 176.54 177.09 1uph h ARG 58 N 0.99 0.86 -0.07 0.00 2.43 -0.31 -0.15 114.38 118.13 1uph h ARG 58 Ca 0.22 -0.22 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1uph h ARG 58 Cb 0.28 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.73 1uph h ARG 58 CO -0.01 0.84 0.03 1.96 -1.51 0.00 0.00 179.97 181.28 1uph h GLN 59 N 0.81 0.10 -0.43 0.20 1.08 0.37 0.35 115.11 117.60 1uph h GLN 59 Ca 0.16 -0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.34 1uph h GLN 59 Cb 0.43 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.82 1uph h GLN 59 CO 0.02 0.20 0.24 0.82 -0.95 0.00 0.00 178.83 179.16 1uph h ILE 60 N -0.03 1.15 -0.70 2.54 2.04 -1.04 0.41 117.51 121.89 1uph h ILE 60 Ca 0.02 -0.38 0.08 0.00 1.00 0.00 0.00 64.86 65.58 1uph h ILE 60 Cb 0.14 0.62 -0.06 0.00 -0.74 0.00 0.00 36.82 36.77 1uph h ILE 60 CO -0.00 0.16 0.38 0.25 0.00 0.00 0.00 178.15 178.93 1uph h LEU 61 N 0.57 0.53 -0.81 1.44 6.46 -0.81 0.12 115.31 122.81 1uph h LEU 61 Ca 0.15 0.04 -0.05 0.00 -0.12 0.00 0.00 57.88 57.90 1uph h LEU 61 Cb 0.04 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 39.90 1uph h LEU 61 CO -0.03 0.32 -0.26 1.23 -0.62 0.00 0.00 178.44 179.09 1uph h GLY 62 N 0.67 0.00 1.26 3.75 0.00 -0.31 0.64 103.07 109.07 1uph h GLY 62 Ca 0.33 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.49 1uph h GLY 62 CO -0.22 0.00 -0.49 -1.61 0.00 0.00 0.00 176.54 174.22 1uph h GLN 63 N 0.00 0.79 0.00 4.80 4.15 0.23 -3.08 115.11 121.99 1uph h GLN 63 Ca -0.00 -0.46 0.00 0.00 0.77 0.00 0.00 58.65 58.95 1uph h GLN 63 Cb 0.89 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.62 1uph h GLN 63 CO 0.03 1.09 -0.94 1.47 -1.93 0.00 0.00 178.83 178.56 1uph n LEU 64 N -4.01 0.89 -0.33 -2.39 -0.00 -0.12 -4.45 117.00 106.58 1uph n LEU 64 Ca -0.03 -0.40 0.01 0.00 -0.00 0.00 0.00 56.01 55.59 1uph n LEU 64 Cb 0.59 -0.04 0.06 0.00 -0.00 0.00 0.00 43.42 44.03 1uph n LEU 64 CO 0.49 0.22 0.54 0.00 -0.00 0.00 0.00 177.39 178.63 1uph n GLN 65 N -1.53 -0.17 0.12 1.47 6.02 0.22 0.18 117.38 123.69 1uph n GLN 65 Ca 0.04 1.37 -0.02 0.00 -0.01 0.00 0.00 57.00 58.38 1uph n GLN 65 Cb 0.34 -2.04 0.09 0.00 1.02 0.00 0.00 30.24 29.65 1uph n GLN 65 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1uph h PRO 66 N 0.00 0.00 0.00 -1.09 0.13 -1.78 -2.95 132.00 126.31 1uph h PRO 66 Ca 0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.47 1uph h PRO 66 Cb 0.56 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.69 1uph h PRO 66 CO -0.89 0.72 0.09 1.03 -0.23 0.00 0.00 178.00 178.72 1uph h SER 67 N 0.00 0.00 -0.22 1.44 0.87 0.18 0.16 113.55 115.98 1uph h SER 67 Ca -0.01 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.36 1uph h SER 67 Cb 1.30 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.27 1uph h SER 67 CO 0.09 0.00 -0.62 -0.07 -0.53 0.00 0.00 176.83 175.70 1uph h LEU 68 N 0.00 0.95 -0.17 2.23 3.38 -1.03 0.43 115.31 121.10 1uph h LEU 68 Ca 0.00 -0.54 0.02 0.00 0.09 0.00 0.00 57.88 57.44 1uph h LEU 68 Cb 0.18 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1uph h LEU 68 CO 0.00 1.34 -0.10 1.67 0.09 0.00 0.00 178.44 181.44 1uph n GLN 69 N -3.98 -0.07 -1.60 1.13 7.27 0.57 -1.51 117.38 119.19 1uph n GLN 69 Ca -0.05 0.87 -0.21 0.00 0.07 0.00 0.00 57.00 57.68 1uph n GLN 69 Cb 0.67 -1.30 0.07 0.00 2.41 0.00 0.00 30.24 32.09 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 -3.26 2.71 -1.44 1.69 5.66 -1.25 -5.03 114.28 113.36 1uph n THR 70 Ca 0.00 -3.69 -0.12 0.00 -3.05 0.00 0.00 64.05 57.19 1uph n THR 70 Cb 0.04 -0.95 0.08 0.00 -1.55 0.00 0.00 70.33 67.96 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 -0.84 -1.18 3.91 1.09 0.00 0.14 -5.08 105.19 103.22 1uph n GLY 71 Ca 0.44 -1.70 -0.20 0.00 0.00 0.00 0.00 46.02 44.56 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 -3.01 5.35 0.23 1.61 1.04 -1.26 -4.94 113.70 112.71 1uph s SER 72 Ca 0.31 -0.54 -0.07 0.00 0.48 0.00 0.00 55.95 56.14 1uph s SER 72 Cb -0.01 -0.80 0.33 0.00 0.10 0.00 0.00 66.02 65.64 1uph s SER 72 CO 0.22 -0.55 1.81 -0.33 0.98 0.00 0.00 173.24 175.37 1uph h GLU 73 N 1.02 0.72 -0.30 4.02 5.08 -1.99 0.20 114.58 123.33 1uph h GLU 73 Ca -0.43 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 57.82 1uph h GLU 73 Cb 1.26 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1uph h GLU 73 CO 0.55 0.48 -0.09 0.93 -1.00 0.00 0.00 179.01 179.88 1uph h GLU 74 N 0.74 0.59 -0.74 2.33 3.07 -1.99 -1.70 114.58 116.89 1uph h GLU 74 Ca 0.35 -0.23 0.05 0.00 -0.50 0.00 0.00 59.36 59.03 1uph h GLU 74 Cb 0.28 -0.03 -0.05 0.00 -0.84 0.00 0.00 28.75 28.11 1uph h GLU 74 CO -0.22 0.79 0.44 1.25 -1.40 0.00 0.00 179.01 179.87 1uph h LEU 75 N 0.35 0.69 0.19 1.33 6.46 -1.73 -0.07 115.31 122.52 1uph h LEU 75 Ca 0.07 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.84 1uph h LEU 75 Cb 0.59 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 40.39 1uph h LEU 75 CO 0.03 0.45 -0.09 -0.09 -0.62 0.00 0.00 178.44 178.12 1uph h ARG 76 N 0.82 -0.25 -0.65 1.25 2.43 -0.48 -0.79 114.38 116.71 1uph h ARG 76 Ca 0.32 0.02 0.13 0.00 -0.81 0.00 0.00 59.98 59.64 1uph h ARG 76 Cb 0.14 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.71 1uph h ARG 76 CO -0.16 -0.12 0.44 0.77 -1.51 0.00 0.00 179.97 179.39 1uph h SER 77 N -0.30 0.29 -0.16 -3.80 0.02 -0.77 0.16 113.55 109.00 1uph h SER 77 Ca -0.03 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.90 1uph h SER 77 Cb 0.23 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 62.72 1uph h SER 77 CO 0.04 0.16 -0.05 0.25 -1.14 0.00 0.00 176.83 176.09 1uph h LEU 78 N 0.32 0.31 -0.86 5.07 6.46 -0.32 -1.27 115.31 125.03 1uph h LEU 78 Ca 0.31 -0.38 0.07 0.00 -0.12 0.00 0.00 57.88 57.76 1uph h LEU 78 Cb 0.79 -0.09 -0.06 0.00 -0.73 0.00 0.00 40.66 40.57 1uph h LEU 78 CO -0.08 0.62 0.53 0.22 -0.62 0.00 0.00 178.44 179.11 1uph h TYR 79 N 0.00 0.97 -0.31 1.25 3.20 0.41 0.31 116.97 122.80 1uph h TYR 79 Ca 0.04 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.91 1uph h TYR 79 Cb 0.49 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 1uph h TYR 79 CO 0.06 0.48 0.08 -0.91 -1.64 0.00 0.00 178.16 176.22 1uph h ASN 80 N 0.94 0.46 -0.63 -2.11 4.21 -1.09 -0.18 115.58 117.19 1uph h ASN 80 Ca 0.38 -0.23 -0.00 0.00 1.21 0.00 0.00 56.30 57.66 1uph h ASN 80 Cb 0.21 -0.12 -0.03 0.00 -1.12 0.00 0.00 38.32 37.26 1uph h ASN 80 CO -0.19 0.57 0.39 0.74 -1.29 0.00 0.00 177.43 177.65 1uph h THR 81 N 0.34 1.18 -0.73 2.81 2.02 -0.33 -1.04 112.91 117.15 1uph h THR 81 Ca 0.10 -0.38 -0.03 0.00 0.77 0.00 0.00 66.41 66.87 1uph h THR 81 Cb 0.28 0.30 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 1uph h THR 81 CO 0.00 0.18 0.35 0.40 0.37 0.00 0.00 175.52 176.82 1uph h ILE 82 N 0.85 1.23 -0.23 3.11 2.04 -0.20 -0.56 117.51 123.75 1uph h ILE 82 Ca 0.23 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1uph h ILE 82 Cb -0.04 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.32 1uph h ILE 82 CO -0.04 0.28 0.15 0.00 0.00 0.00 0.00 178.15 178.53 1uph h ALA 83 N 1.34 0.29 -0.99 1.87 0.00 -0.20 -0.49 119.26 121.08 1uph h ALA 83 Ca 0.25 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1uph h ALA 83 Cb 0.11 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1uph h ALA 83 CO -0.03 -0.22 0.66 0.28 0.00 0.00 0.00 179.25 179.94 1uph h VAL 84 N 0.30 1.25 -0.55 0.00 2.07 -0.67 -0.48 116.25 118.17 1uph h VAL 84 Ca 0.08 -0.46 0.02 0.00 0.82 0.00 0.00 66.70 67.17 1uph h VAL 84 Cb -0.01 -0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 29.52 1uph h VAL 84 CO -0.02 0.24 0.33 0.25 0.02 0.00 0.00 177.57 178.40 1uph h LEU 85 N 1.34 0.54 -0.81 2.57 5.85 -0.39 -0.88 115.31 123.54 1uph h LEU 85 Ca 0.37 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 59.04 1uph h LEU 85 Cb -0.14 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 40.74 1uph h LEU 85 CO -0.08 0.38 0.33 0.22 -0.34 0.00 0.00 178.44 178.95 1uph h TYR 86 N 0.66 1.22 -0.61 1.25 5.03 -0.17 0.17 116.97 124.53 1uph h TYR 86 Ca 0.22 -0.09 0.03 0.00 2.58 0.00 0.00 58.73 61.47 1uph h TYR 86 Cb 0.01 -0.37 -0.04 0.00 1.55 0.00 0.00 36.73 37.89 1uph h TYR 86 CO -0.06 0.92 0.37 0.00 -1.32 0.00 0.00 178.16 178.07 1uph h VAL 88 N 0.73 1.24 0.00 0.00 2.07 -0.66 0.42 116.25 120.04 1uph h VAL 88 Ca 0.25 -1.06 -0.04 0.00 0.82 0.00 0.00 66.70 66.67 1uph h VAL 88 Cb 0.03 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1uph h VAL 88 CO -0.10 0.36 -0.19 0.45 0.02 0.00 0.00 177.57 178.11 1uph h HIS 89 N 0.66 0.00 0.00 1.57 3.86 0.50 -2.31 115.15 119.43 1uph h HIS 89 Ca 0.12 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 1uph h HIS 89 Cb 0.50 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.97 1uph h HIS 89 CO 0.02 0.19 -1.09 1.04 0.86 0.00 0.00 177.93 178.96 1uph n GLN 90 N -3.41 0.38 -2.51 2.45 1.13 0.14 -4.77 117.38 110.79 1uph n GLN 90 Ca -0.00 0.01 -0.07 0.00 -1.94 0.00 0.00 57.00 55.00 1uph n GLN 90 Cb 0.39 -1.63 0.03 0.00 0.11 0.00 0.00 30.24 29.14 1uph n GLN 90 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 1uph n ARG 91 N -2.12 -2.34 -4.51 -1.09 0.63 0.13 -5.04 116.66 102.33 1uph n ARG 91 Ca 0.01 0.34 -0.34 0.00 -0.92 0.00 0.00 57.85 56.95 1uph n ARG 91 Cb 0.47 -3.74 -0.12 0.00 0.45 0.00 0.00 32.46 29.52 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 -3.15 3.73 0.24 5.15 1.01 -0.37 -5.03 121.20 122.78 1uph s ILE 92 Ca 0.03 -0.43 -0.31 0.00 0.00 0.00 0.00 60.65 59.94 1uph s ILE 92 Cb -0.00 -2.60 -0.12 0.00 0.01 0.00 0.00 42.46 39.74 1uph s ILE 92 CO 0.29 0.52 1.65 0.47 0.00 0.00 0.00 174.94 177.87 1uph n ASP 93 N 3.25 3.80 -3.91 3.58 9.92 -1.26 -4.67 116.55 127.25 1uph n ASP 93 Ca -0.18 1.10 -0.10 0.00 -0.53 0.00 0.00 54.79 55.08 1uph n ASP 93 Cb 0.53 -1.56 -0.06 0.00 -0.64 0.00 0.00 41.12 39.39 1uph n ASP 93 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1uph s VAL 94 N 0.63 0.00 0.00 2.53 -7.23 -1.26 -4.93 120.40 110.14 1uph s VAL 94 Ca 0.71 -1.52 0.00 0.00 -1.81 0.00 0.00 61.98 59.36 1uph s VAL 94 Cb -0.53 -2.33 0.00 0.00 0.56 0.00 0.00 36.38 34.09 1uph s VAL 94 CO 0.40 0.00 0.00 2.29 -0.31 0.00 0.00 175.10 177.48 1uph n LYS 95 N -0.39 0.00 -4.40 4.82 2.85 -1.26 -4.98 118.16 114.79 1uph n LYS 95 Ca -0.01 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 57.01 1uph n LYS 95 Cb 0.62 -0.12 -0.09 0.00 -0.65 0.00 0.00 35.03 34.80 1uph n LYS 95 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 1uph s ASP 96 N -4.14 4.00 0.20 -5.58 -4.77 -1.26 -1.24 116.67 103.88 1uph s ASP 96 Ca 0.00 -0.96 -0.08 0.00 -3.30 0.00 0.00 52.55 48.20 1uph s ASP 96 Cb 0.00 -0.49 0.13 0.00 -1.09 0.00 0.00 42.92 41.46 1uph s ASP 96 CO 0.00 -0.10 1.74 0.00 0.70 0.00 0.00 175.17 177.51 1uph h THR 97 N 2.00 1.26 -0.52 2.11 1.03 -1.11 0.12 112.91 117.80 1uph h THR 97 Ca -0.42 -0.91 -0.12 0.00 -0.01 0.00 0.00 66.41 64.95 1uph h THR 97 Cb 1.25 0.45 -0.02 0.00 -1.07 0.00 0.00 68.15 68.77 1uph h THR 97 CO 0.64 0.36 -0.15 0.50 -0.01 0.00 0.00 175.52 176.86 1uph h LYS 98 N 1.10 1.01 -0.37 0.00 1.63 -1.83 0.15 116.57 118.26 1uph h LYS 98 Ca 0.24 -0.39 -0.09 0.00 -0.85 0.00 0.00 60.65 59.56 1uph h LYS 98 Cb 0.31 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.86 1uph h LYS 98 CO -0.01 1.08 -0.13 1.49 -3.45 0.00 0.00 179.45 178.43 1uph h GLU 99 N 0.89 0.65 0.00 1.90 4.57 -1.85 0.28 114.58 121.02 1uph h GLU 99 Ca 0.13 -0.21 -0.00 0.00 -1.18 0.00 0.00 59.36 58.10 1uph h GLU 99 Cb 0.72 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.25 1uph h GLU 99 CO 0.06 0.77 -0.00 0.00 -1.18 0.00 0.00 179.01 178.65 1uph h ALA 100 N 1.26 -0.00 -0.80 2.92 0.00 -0.47 0.45 119.26 122.62 1uph h ALA 100 Ca 0.10 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.75 1uph h ALA 100 Cb 0.57 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1uph h ALA 100 CO 0.04 -0.22 0.52 1.25 0.00 0.00 0.00 179.25 180.84 1uph h LEU 101 N -0.57 0.88 -0.77 0.00 5.85 -0.60 0.23 115.31 120.33 1uph h LEU 101 Ca -0.00 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.57 1uph h LEU 101 Cb 0.57 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 1uph h LEU 101 CO 0.00 0.62 -0.56 -0.78 -0.34 0.00 0.00 178.44 177.39 1uph h ASP 102 N 1.04 0.18 -0.06 1.25 3.58 -0.43 0.41 116.42 122.38 1uph h ASP 102 Ca 0.31 -0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.65 1uph h ASP 102 Cb -0.06 -0.05 -0.00 0.00 1.72 0.00 0.00 39.33 40.94 1uph h ASP 102 CO -0.09 0.70 0.01 0.11 -2.88 0.00 0.00 179.24 177.09 1uph h LYS 103 N 0.12 0.10 -0.18 0.28 1.79 0.14 0.40 116.57 119.21 1uph h LYS 103 Ca -0.00 -0.03 -0.17 0.00 -2.18 0.00 0.00 60.65 58.27 1uph h LYS 103 Cb 1.02 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.66 1uph h LYS 103 CO 0.08 0.33 -0.59 -0.84 -1.08 0.00 0.00 179.45 177.35 1uph h ILE 104 N -0.15 1.32 -0.78 1.86 3.07 -0.52 -1.39 117.51 120.92 1uph h ILE 104 Ca 0.02 -1.85 -0.05 0.00 1.55 0.00 0.00 64.86 64.52 1uph h ILE 104 Cb 0.28 1.82 -0.03 0.00 -0.27 0.00 0.00 36.82 38.62 1uph h ILE 104 CO 0.00 0.58 0.29 -0.33 -1.05 0.00 0.00 178.15 177.63 1uph h GLU 105 N 0.43 1.19 0.11 0.16 5.08 -0.03 0.17 114.58 121.68 1uph h GLU 105 Ca -0.00 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.12 1uph h GLU 105 Cb 1.15 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.21 1uph h GLU 105 CO 0.11 0.98 -0.05 1.49 -1.00 0.00 0.00 179.01 180.54 1uph h GLU 106 N 1.15 -0.14 -0.28 2.33 4.22 -0.09 -1.12 114.58 120.65 1uph h GLU 106 Ca 0.26 0.01 0.04 0.00 0.08 0.00 0.00 59.36 59.75 1uph h GLU 106 Cb 0.25 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 1uph h GLU 106 CO -0.02 0.27 0.03 1.49 -2.18 0.00 0.00 179.01 178.60 1uph h GLU 107 N -0.59 0.12 -0.18 1.92 4.57 -1.15 0.06 114.58 119.33 1uph h GLU 107 Ca -0.01 -0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.19 1uph h GLU 107 Cb 0.47 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.01 1uph h GLU 107 CO 0.02 0.08 -0.01 0.37 -1.18 0.00 0.00 179.01 178.29 1uph h GLN 108 N 0.12 0.04 -0.34 1.92 4.15 -0.70 0.28 115.11 120.58 1uph h GLN 108 Ca 0.13 -0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.62 1uph h GLN 108 Cb 0.16 -0.01 -0.07 0.00 0.21 0.00 0.00 27.48 27.78 1uph h GLN 108 CO -0.20 0.02 -0.09 -0.97 -1.93 0.00 0.00 178.83 175.66 1uph h ASN 109 N 0.04 -0.34 -0.74 -0.69 -0.73 -0.64 0.18 115.58 112.65 1uph h ASN 109 Ca 0.08 0.11 0.02 0.00 1.87 0.00 0.00 56.30 58.38 1uph h ASN 109 Cb 0.11 0.22 -0.04 0.00 0.27 0.00 0.00 38.32 38.88 1uph h ASN 109 CO -0.15 -0.12 0.47 0.50 -0.37 0.00 0.00 177.43 177.76 1uph h LYS 110 N -0.01 0.91 0.20 6.67 1.63 -0.41 0.15 116.57 125.71 1uph h LYS 110 Ca 0.17 -0.05 0.01 0.00 -0.85 0.00 0.00 60.65 59.92 1uph h LYS 110 Cb 0.27 -0.21 -0.03 0.00 -0.60 0.00 0.00 32.23 31.66 1uph h LYS 110 CO -0.36 0.60 -0.31 1.03 -3.45 0.00 0.00 179.45 176.97 1uph h SER 111 N 0.94 -0.86 0.62 4.20 0.87 0.14 0.33 113.55 119.78 1uph h SER 111 Ca 0.29 0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.92 1uph h SER 111 Cb -0.02 0.31 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 1uph h SER 111 CO -0.10 -0.41 -0.44 0.11 -0.53 0.00 0.00 176.83 175.46 1uph h LYS 112 N -0.58 -0.98 -0.94 2.24 1.57 -0.35 0.28 116.57 117.81 1uph h LYS 112 Ca 0.01 0.07 0.28 0.00 -1.87 0.00 0.00 60.65 59.13 1uph h LYS 112 Cb 0.57 0.22 -0.15 0.00 0.08 0.00 0.00 32.23 32.96 1uph h LYS 112 CO -0.13 -0.65 0.38 0.87 -0.57 0.00 0.00 179.45 179.35 1uph h LYS 113 N -1.02 0.25 -0.59 3.15 1.57 -0.52 1.39 116.57 120.79 1uph h LYS 113 Ca -0.08 -0.01 -0.09 0.00 -1.87 0.00 0.00 60.65 58.60 1uph h LYS 113 Cb 0.84 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.08 1uph h LYS 113 CO 0.04 0.16 0.01 -0.22 -0.57 0.00 0.00 179.45 178.87 1uph h LYS 114 N 0.25 1.04 0.78 3.15 3.64 0.51 -0.50 116.57 125.44 1uph h LYS 114 Ca 0.64 -0.33 -0.04 0.00 -1.27 0.00 0.00 60.65 59.66 1uph h LYS 114 Cb 1.38 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 1uph h LYS 114 CO -0.64 1.02 -0.44 0.00 -2.27 0.00 0.00 179.45 177.12 1uph h ALA 115 N 0.98 -1.27 -1.00 5.00 0.00 0.53 -1.08 119.26 122.43 1uph h ALA 115 Ca 0.17 -0.24 0.17 0.00 0.00 0.00 0.00 54.91 55.01 1uph h ALA 115 Cb 0.55 0.53 -0.10 0.00 0.00 0.00 0.00 17.79 18.77 1uph h ALA 115 CO 0.03 -1.21 0.62 -0.56 0.00 0.00 0.00 179.25 178.12 1uph h GLN 116 N -1.13 0.77 0.09 0.00 3.07 -0.64 0.17 115.11 117.45 1uph h GLN 116 Ca -0.11 -0.05 0.02 0.00 0.09 0.00 0.00 58.65 58.61 1uph h GLN 116 Cb 0.89 -0.17 -0.04 0.00 0.08 0.00 0.00 27.48 28.24 1uph h GLN 116 CO 0.13 0.51 -0.28 0.37 0.09 0.00 0.00 178.83 179.65 1uph h GLN 117 N 0.80 -0.47 0.15 0.06 4.15 -0.65 0.34 115.11 119.49 1uph h GLN 117 Ca 0.55 0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.99 1uph h GLN 117 Cb 0.82 0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.61 1uph h GLN 117 CO -0.34 -0.31 -0.07 0.00 -1.93 0.00 0.00 178.83 176.18 1uph h ALA 118 N 0.24 -0.20 -0.61 3.38 0.00 0.05 0.20 119.26 122.31 1uph h ALA 118 Ca 0.04 -0.08 0.18 0.00 0.00 0.00 0.00 54.91 55.05 1uph h ALA 118 Cb 0.52 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1uph h ALA 118 CO -0.18 -0.57 0.55 0.00 0.00 0.00 0.00 179.25 179.05 1uph h ALA 119 N 0.56 2.43 0.01 0.00 0.00 -0.39 0.44 119.26 122.30 1uph h ALA 119 Ca -0.02 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1uph h ALA 119 Cb 0.22 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1uph h ALA 119 CO 0.03 -0.87 -0.00 0.00 0.00 0.00 0.00 179.25 178.41 1uph h ALA 120 N 1.48 -0.01 -0.20 0.00 0.00 0.87 -3.45 119.26 117.94 1uph h ALA 120 Ca 0.29 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.91 1uph h ALA 120 Cb 1.39 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 19.04 1uph h ALA 120 CO -0.00 -0.01 -0.38 -0.25 0.00 0.00 0.00 179.25 178.61 1uph n ASP 121 N -4.74 -2.60 -4.56 0.00 9.92 0.59 -5.09 116.55 110.07 1uph n ASP 121 Ca -0.03 -2.77 -0.43 0.00 -0.53 0.00 0.00 54.79 51.03 1uph n ASP 121 Cb 0.13 1.53 -0.04 0.00 -0.64 0.00 0.00 41.12 42.10 1uph n ASP 121 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 1uph n THR 122 N 1.94 0.22 -0.00 -3.53 5.66 0.14 -4.73 114.28 113.96 1uph n THR 122 Ca 0.09 -0.49 0.00 0.00 -3.05 0.00 0.00 64.05 60.61 1uph n THR 122 Cb 0.63 -2.40 0.00 0.00 -1.55 0.00 0.00 70.33 67.01 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 5.99 2.33 3.61 1.09 0.00 -1.26 -4.83 105.19 112.11 1uph n GLY 123 Ca 0.34 -0.04 -0.04 0.00 0.00 0.00 0.00 46.02 46.29 1uph n GLY 123 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1uph s ASN 124 N -4.00 -0.12 0.07 1.61 2.47 -1.26 -5.13 114.94 108.58 1uph s ASN 124 Ca 0.00 0.03 -0.37 0.00 0.42 0.00 0.00 52.86 52.94 1uph s ASN 124 Cb 0.00 0.12 -0.18 0.00 -1.45 0.00 0.00 41.25 39.75 1uph s ASN 124 CO 0.00 -0.19 1.23 -3.20 -3.72 0.00 0.00 177.10 171.22 1uph n ASN 125 N 0.06 1.08 -3.72 -4.21 2.85 -1.26 -4.93 115.26 105.13 1uph n ASN 125 Ca 0.00 1.13 -0.05 0.00 -0.11 0.00 0.00 54.58 55.56 1uph n ASN 125 Cb 0.58 -1.11 -0.02 0.00 1.24 0.00 0.00 39.78 40.48 1uph n ASN 125 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 1uph s SER 126 N 0.27 -0.23 0.00 1.20 1.04 -1.26 -5.17 113.70 109.55 1uph s SER 126 Ca 0.85 -0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.92 1uph s SER 126 Cb -1.04 0.51 0.00 0.00 0.10 0.00 0.00 66.02 65.59 1uph s SER 126 CO 0.50 -0.93 0.00 1.67 0.98 0.00 0.00 173.24 175.47 1uph n GLN 127 N -0.43 0.00 -2.84 4.02 7.27 -1.26 -5.18 117.38 118.96 1uph n GLN 127 Ca -0.07 0.00 -0.21 0.00 0.07 0.00 0.00 57.00 56.80 1uph n GLN 127 Cb 0.61 0.00 0.07 0.00 2.41 0.00 0.00 30.24 33.32 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 0.00 2.33 0.30 1.69 -7.23 -1.26 -4.96 120.40 111.27 1uph s VAL 128 Ca 0.00 -0.83 0.00 0.00 -1.81 0.00 0.00 61.98 59.34 1uph s VAL 128 Cb 0.00 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.44 1uph s VAL 128 CO 0.00 0.00 0.00 -0.24 -0.31 0.00 0.00 175.10 174.55 1uph n SER 129 N -2.39 -8.56 -3.60 4.85 2.88 -1.26 -5.09 113.62 100.45 1uph n SER 129 Ca 0.13 1.21 -0.09 0.00 -1.33 0.00 0.00 58.87 58.80 1uph n SER 129 Cb 0.61 -4.48 -0.06 0.00 -0.75 0.00 0.00 64.21 59.53 1uph n SER 129 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 1uph s GLN 130 N -1.92 0.50 0.14 -1.46 0.74 -1.26 -5.18 119.66 111.22 1uph s GLN 130 Ca 0.00 0.24 -0.19 0.00 0.05 0.00 0.00 55.36 55.46 1uph s GLN 130 Cb 0.00 0.24 0.05 0.00 1.10 0.00 0.00 33.01 34.39 1uph s GLN 130 CO 0.00 -0.13 0.48 1.21 -0.55 0.00 0.00 175.29 176.30 1uph s ASN 131 N -0.73 -0.36 0.00 6.67 2.47 -1.26 -5.33 114.94 116.40 1uph s ASN 131 Ca 0.01 -0.22 0.29 0.00 0.42 0.00 0.00 52.86 53.36 1uph s ASN 131 Cb -0.02 0.53 1.28 0.00 -1.45 0.00 0.00 41.25 41.59 1uph s ASN 131 CO -0.02 -0.91 1.88 0.00 -3.72 0.00 0.00 177.10 174.32