#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 2.11 -2.62 4.61 0.00 -1.26 -5.01 120.51 118.34 1uph n ALA 3 Ca 0.00 -0.27 -0.38 0.00 0.00 0.00 0.00 53.44 52.79 1uph n ALA 3 Cb 0.00 0.13 -0.06 0.00 0.00 0.00 0.00 19.45 19.52 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 -2.05 4.30 0.94 0.00 0.52 -1.26 -5.05 118.95 116.36 1uph s ARG 4 Ca -0.09 0.59 -0.12 0.00 -0.52 0.00 0.00 55.73 55.59 1uph s ARG 4 Cb 0.01 -3.39 0.07 0.00 0.52 0.00 0.00 34.95 32.17 1uph s ARG 4 CO 0.13 0.27 0.65 0.00 0.02 0.00 0.00 175.30 176.36 1uph n ALA 5 N 3.20 -2.04 -2.59 2.13 0.00 -1.26 -4.96 120.51 114.99 1uph n ALA 5 Ca -0.07 -0.60 -0.18 0.00 0.00 0.00 0.00 53.44 52.59 1uph n ALA 5 Cb 0.51 -1.93 0.01 0.00 0.00 0.00 0.00 19.45 18.05 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 -2.29 3.05 0.00 0.00 7.64 -1.26 -4.89 113.62 115.88 1uph n SER 6 Ca 0.08 -3.22 0.00 0.00 1.01 0.00 0.00 58.87 56.74 1uph n SER 6 Cb 0.53 -0.50 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 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 -0.26 0.00 -4.26 0.44 0.31 -1.26 -4.03 118.33 109.28 1uph n VAL 7 Ca 0.24 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.25 1uph n VAL 7 Cb 0.73 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 33.57 1uph n VAL 7 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1uph s LEU 8 N -1.99 3.56 0.00 7.52 1.02 -1.26 -4.84 118.68 122.70 1uph s LEU 8 Ca 0.00 0.01 -0.12 0.00 0.02 0.00 0.00 54.13 54.04 1uph s LEU 8 Cb 0.00 -2.05 0.18 0.00 0.02 0.00 0.00 46.19 44.34 1uph s LEU 8 CO 0.00 0.28 0.55 -1.20 0.02 0.00 0.00 176.35 176.00 1uph n SER 9 N 1.35 -2.11 0.35 2.29 7.64 -1.26 -4.44 113.62 117.45 1uph n SER 9 Ca -0.14 -0.74 -0.18 0.00 1.01 0.00 0.00 58.87 58.82 1uph n SER 9 Cb 0.53 -0.54 -0.09 0.00 -1.01 0.00 0.00 64.21 63.09 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 -1.93 -1.13 1.22 0.23 0.00 -1.99 0.48 103.07 99.95 1uph h GLY 10 Ca -0.22 0.48 -0.13 0.00 0.00 0.00 0.00 47.33 47.46 1uph h GLY 10 CO 0.14 -0.38 -0.24 -1.33 0.00 0.00 0.00 176.54 174.73 1uph h GLY 11 N -1.01 0.96 1.30 4.60 0.00 -1.98 -1.30 103.07 105.64 1uph h GLY 11 Ca -0.08 -0.85 -0.00 0.00 0.00 0.00 0.00 47.33 46.40 1uph h GLY 11 CO 0.05 0.77 0.41 0.83 0.00 0.00 0.00 176.54 178.60 1uph h GLU 12 N 0.76 0.93 -0.11 4.80 5.08 -1.85 0.22 114.58 124.41 1uph h GLU 12 Ca 0.10 -0.08 -0.10 0.00 -1.00 0.00 0.00 59.36 58.28 1uph h GLU 12 Cb 0.79 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1uph h GLU 12 CO 0.07 0.66 -0.31 1.25 -1.00 0.00 0.00 179.01 179.67 1uph h LEU 13 N 0.95 0.47 -1.65 1.33 7.12 0.18 0.20 115.31 123.90 1uph h LEU 13 Ca 0.25 -0.59 0.08 0.00 0.13 0.00 0.00 57.88 57.74 1uph h LEU 13 Cb -0.03 -0.14 -0.03 0.00 -0.53 0.00 0.00 40.66 39.93 1uph h LEU 13 CO -0.05 0.97 0.36 -0.78 -0.13 0.00 0.00 178.44 178.82 1uph h ASP 14 N -0.02 0.37 0.29 1.25 1.82 -0.73 0.61 116.42 120.00 1uph h ASP 14 Ca -0.01 0.00 -0.33 0.00 -0.39 0.00 0.00 57.03 56.30 1uph h ASP 14 Cb 0.92 -0.07 0.04 0.00 0.68 0.00 0.00 39.33 40.89 1uph h ASP 14 CO 0.07 0.23 -1.46 0.11 -1.61 0.00 0.00 179.24 176.57 1uph h LYS 15 N 0.41 0.53 -0.44 0.28 1.57 -0.83 -3.18 116.57 114.92 1uph h LYS 15 Ca 0.24 -0.89 0.09 0.00 -1.87 0.00 0.00 60.65 58.22 1uph h LYS 15 Cb 0.41 0.33 -0.02 0.00 0.08 0.00 0.00 32.23 33.03 1uph h LYS 15 CO -0.06 1.43 0.30 2.35 -0.57 0.00 0.00 179.45 182.90 1uph h TRP 16 N 0.14 0.19 -0.43 -1.35 2.91 0.93 0.43 115.95 118.78 1uph h TRP 16 Ca -0.25 0.01 -0.21 0.00 1.13 0.00 0.00 58.89 59.57 1uph h TRP 16 Cb 2.16 -0.06 -0.13 0.00 -0.51 0.00 0.00 29.16 30.62 1uph h TRP 16 CO 0.12 0.09 0.27 0.39 -1.03 0.00 0.00 178.44 178.28 1uph n GLU 17 N -4.45 1.68 0.00 2.65 1.02 0.05 -3.26 120.64 118.33 1uph n GLU 17 Ca 0.07 -1.35 0.00 0.00 -0.02 0.00 0.00 57.16 55.85 1uph n GLU 17 Cb 0.38 -1.56 0.00 0.00 -0.02 0.00 0.00 31.44 30.24 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 -0.19 1.15 -3.08 3.49 0.00 0.15 -4.64 118.16 115.04 1uph n LYS 18 Ca 0.25 -0.32 -0.40 0.00 0.00 0.00 0.00 58.31 57.84 1uph n LYS 18 Cb 0.99 -0.81 -0.05 0.00 0.00 0.00 0.00 35.03 35.16 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 -0.26 5.03 0.28 3.15 1.09 -1.20 -4.86 121.20 124.42 1uph s ILE 19 Ca 0.00 1.31 -0.19 0.00 -1.10 0.00 0.00 60.65 60.67 1uph s ILE 19 Cb 0.00 -3.99 -0.09 0.00 -1.06 0.00 0.00 42.46 37.32 1uph s ILE 19 CO 0.00 0.16 0.76 0.00 -0.10 0.00 0.00 174.94 175.76 1uph s ARG 20 N 1.47 4.19 0.15 2.79 1.70 0.78 -0.84 118.95 129.19 1uph s ARG 20 Ca 0.32 0.85 -0.03 0.00 -0.47 0.00 0.00 55.73 56.41 1uph s ARG 20 Cb -0.16 -2.68 -0.02 0.00 -0.57 0.00 0.00 34.95 31.52 1uph s ARG 20 CO 0.13 0.28 1.37 -0.07 -1.08 0.00 0.00 175.30 175.93 1uph h LEU 21 N 2.91 0.51 -8.61 -1.89 3.38 -0.49 -0.62 115.31 110.50 1uph h LEU 21 Ca -0.48 -0.37 -0.43 0.00 0.09 0.00 0.00 57.88 56.69 1uph h LEU 21 Cb 1.19 -0.15 -0.19 0.00 0.09 0.00 0.00 40.66 41.60 1uph h LEU 21 CO 0.65 1.14 -0.77 -0.13 0.09 0.00 0.00 178.44 179.42 1uph s ARG 22 N -3.45 1.03 0.15 1.13 0.52 -1.26 -4.31 118.95 112.76 1uph s ARG 22 Ca -0.06 -1.22 -0.03 0.00 -0.52 0.00 0.00 55.73 53.91 1uph s ARG 22 Cb 0.10 -0.97 -0.03 0.00 0.52 0.00 0.00 34.95 34.57 1uph s ARG 22 CO 0.85 0.19 1.36 -1.00 0.02 0.00 0.00 175.30 176.72 1uph h PRO 23 N 3.62 0.40 -0.02 3.54 0.13 -1.96 -3.26 132.00 134.45 1uph h PRO 23 Ca -0.41 -0.39 0.00 0.00 -0.87 0.00 0.00 66.00 64.34 1uph h PRO 23 Cb 1.20 0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1uph h PRO 23 CO 0.49 1.05 -0.02 0.41 -0.23 0.00 0.00 178.00 179.69 1uph n GLY 24 N 0.79 -0.15 0.00 1.56 0.00 -1.26 -5.00 105.19 101.13 1uph n GLY 24 Ca -0.06 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 0.75 -0.24 2.67 -0.02 0.00 -1.23 -5.05 105.19 102.07 1uph n GLY 25 Ca 0.07 -1.79 -0.09 0.00 0.00 0.00 0.00 46.02 44.22 1uph n GLY 25 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1uph n LYS 26 N -0.82 1.40 -4.27 1.61 2.85 -1.26 -4.85 118.16 112.81 1uph n LYS 26 Ca 0.00 -3.38 -0.23 0.00 -1.05 0.00 0.00 58.31 53.65 1uph n LYS 26 Cb 0.00 -1.37 -0.12 0.00 -0.65 0.00 0.00 35.03 32.89 1uph n LYS 26 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1uph s LYS 27 N -3.26 1.09 0.16 -1.58 1.02 -1.26 -5.03 119.74 110.88 1uph s LYS 27 Ca 0.29 -1.14 -0.07 0.00 0.02 0.00 0.00 55.97 55.06 1uph s LYS 27 Cb 0.43 -1.31 -0.02 0.00 -0.52 0.00 0.00 37.83 36.42 1uph s LYS 27 CO 0.01 0.30 0.24 -0.65 -0.92 0.00 0.00 175.35 174.34 1uph s GLN 28 N -1.91 1.14 0.89 1.68 -0.21 -1.26 0.28 119.66 120.27 1uph s GLN 28 Ca 0.05 -1.26 -0.12 0.00 0.02 0.00 0.00 55.36 54.06 1uph s GLN 28 Cb -0.10 0.35 0.12 0.00 1.00 0.00 0.00 33.01 34.38 1uph s GLN 28 CO 0.04 -0.40 1.10 0.71 -2.12 0.00 0.00 175.29 174.61 1uph s TYR 29 N -4.00 2.40 0.09 0.91 1.51 -0.02 -4.83 117.35 113.41 1uph s TYR 29 Ca 0.20 1.19 -0.26 0.00 -1.01 0.00 0.00 57.07 57.19 1uph s TYR 29 Cb 0.04 -3.18 0.09 0.00 -0.11 0.00 0.00 41.96 38.80 1uph s TYR 29 CO 0.02 -2.33 1.13 -1.59 -1.11 0.00 0.00 175.55 171.67 1uph s LYS 30 N -5.00 0.89 0.61 -0.62 -2.85 -1.26 -4.47 119.74 107.04 1uph s LYS 30 Ca 0.63 -0.55 0.33 0.00 -1.00 0.00 0.00 55.97 55.38 1uph s LYS 30 Cb -0.17 0.27 1.77 0.00 -2.06 0.00 0.00 37.83 37.64 1uph s LYS 30 CO 0.56 -0.42 1.99 1.25 0.10 0.00 0.00 175.35 178.84 1uph h LEU 31 N 2.00 0.00 -0.18 2.77 7.12 -1.97 0.22 115.31 125.28 1uph h LEU 31 Ca -0.26 0.00 -0.08 0.00 0.13 0.00 0.00 57.88 57.66 1uph h LEU 31 Cb 1.21 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 41.34 1uph h LEU 31 CO 0.31 0.00 -0.22 0.50 -0.13 0.00 0.00 178.44 178.90 1uph h LYS 32 N 0.00 0.46 -0.18 1.25 3.64 -1.98 -0.49 116.57 119.27 1uph h LYS 32 Ca 0.00 -0.26 -0.15 0.00 -1.27 0.00 0.00 60.65 58.97 1uph h LYS 32 Cb 0.39 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 1uph h LYS 32 CO 0.00 0.84 -0.51 0.45 -2.27 0.00 0.00 179.45 177.96 1uph h HIS 33 N 0.11 0.61 -0.33 1.91 3.86 -1.00 0.17 115.15 120.49 1uph h HIS 33 Ca 0.02 -0.21 -0.02 0.00 -1.16 0.00 0.00 60.37 59.01 1uph h HIS 33 Cb 0.78 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 29.11 1uph h HIS 33 CO 0.09 0.91 0.13 0.82 0.86 0.00 0.00 177.93 180.73 1uph h ILE 34 N 0.39 1.18 -0.18 2.45 1.08 -1.15 0.29 117.51 121.57 1uph h ILE 34 Ca 0.01 -0.55 -0.11 0.00 -0.39 0.00 0.00 64.86 63.82 1uph h ILE 34 Cb 1.03 0.94 -0.01 0.00 -3.07 0.00 0.00 36.82 35.71 1uph h ILE 34 CO 0.09 0.19 -0.38 0.58 -0.69 0.00 0.00 178.15 177.95 1uph h VAL 35 N 0.38 1.30 -0.06 1.67 2.07 -0.98 0.25 116.25 120.88 1uph h VAL 35 Ca 0.11 -1.49 -0.00 0.00 0.82 0.00 0.00 66.70 66.14 1uph h VAL 35 Cb 0.18 1.57 -0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1uph h VAL 35 CO -0.01 0.46 0.02 -0.25 0.02 0.00 0.00 177.57 177.81 1uph h TRP 36 N 0.33 0.10 -0.44 1.57 7.01 -0.45 0.26 115.95 124.33 1uph h TRP 36 Ca 0.03 -0.01 -0.04 0.00 2.11 0.00 0.00 58.89 60.98 1uph h TRP 36 Cb 0.82 -0.03 -0.02 0.00 -2.10 0.00 0.00 29.16 27.83 1uph h TRP 36 CO 0.02 0.25 0.11 0.00 -2.79 0.00 0.00 178.44 176.04 1uph h ALA 37 N 0.84 0.58 -0.65 2.65 0.00 -0.25 -0.89 119.26 121.54 1uph h ALA 37 Ca 0.02 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.79 1uph h ALA 37 Cb 0.20 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 1uph h ALA 37 CO -0.00 0.25 0.36 0.66 0.00 0.00 0.00 179.25 180.52 1uph h SER 38 N 0.57 0.54 -0.58 0.00 4.64 -0.28 -0.42 113.55 118.03 1uph h SER 38 Ca 0.14 0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.46 1uph h SER 38 Cb 0.30 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 62.29 1uph h SER 38 CO -0.00 0.35 0.24 0.03 -0.87 0.00 0.00 176.83 176.59 1uph h ARG 39 N 0.67 0.85 -0.14 4.77 2.47 -0.17 -0.51 114.38 122.32 1uph h ARG 39 Ca 0.29 -0.15 0.03 0.00 -1.26 0.00 0.00 59.98 58.89 1uph h ARG 39 Cb 0.16 -0.14 -0.03 0.00 -1.65 0.00 0.00 29.97 28.31 1uph h ARG 39 CO -0.17 0.72 -0.04 1.49 0.56 0.00 0.00 179.97 182.53 1uph h GLU 40 N 0.79 -0.01 0.04 0.04 4.57 -0.25 0.38 114.58 120.15 1uph h GLU 40 Ca 0.19 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.38 1uph h GLU 40 Cb 0.18 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.76 1uph h GLU 40 CO -0.02 -0.00 -0.07 -0.07 -1.18 0.00 0.00 179.01 177.67 1uph h LEU 41 N -0.01 -0.18 -1.71 1.64 4.07 -0.89 0.44 115.31 118.67 1uph h LEU 41 Ca 0.07 0.02 0.09 0.00 0.08 0.00 0.00 57.88 58.14 1uph h LEU 41 Cb 0.11 0.07 -0.03 0.00 1.08 0.00 0.00 40.66 41.89 1uph h LEU 41 CO -0.15 -0.10 0.35 -0.33 -1.08 0.00 0.00 178.44 177.12 1uph h GLU 42 N -0.14 0.32 0.00 1.13 5.08 -0.67 0.29 114.58 120.59 1uph h GLU 42 Ca 0.01 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 1uph h GLU 42 Cb 0.15 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1uph h GLU 42 CO -0.04 0.21 -0.31 0.00 -1.00 0.00 0.00 179.01 177.88 1uph h ARG 43 N 0.33 0.00 -0.31 2.33 3.08 0.87 -3.07 114.38 117.61 1uph h ARG 43 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 1uph h ARG 43 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1uph h ARG 43 CO -0.06 0.31 0.00 1.19 -1.07 0.00 0.00 179.97 180.34 1uph n PHE 44 N -3.18 0.29 -2.77 3.04 3.01 0.14 -4.84 117.46 113.15 1uph n PHE 44 Ca 0.03 -0.13 -0.15 0.00 1.01 0.00 0.00 57.45 58.20 1uph n PHE 44 Cb 0.65 -0.04 0.02 0.00 -0.01 0.00 0.00 39.48 40.11 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 0.05 -0.65 -2.53 4.37 0.00 -1.05 -5.01 120.51 115.70 1uph n ALA 45 Ca 0.06 0.20 -0.24 0.00 0.00 0.00 0.00 53.44 53.46 1uph n ALA 45 Cb 0.21 -2.80 -0.12 0.00 0.00 0.00 0.00 19.45 16.74 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 -2.97 1.75 0.23 0.00 1.01 -0.33 -5.03 120.40 115.07 1uph s VAL 46 Ca 0.20 -1.57 -0.30 0.00 0.00 0.00 0.00 61.98 60.32 1uph s VAL 46 Cb -0.09 -1.60 -0.09 0.00 0.00 0.00 0.00 36.38 34.61 1uph s VAL 46 CO 0.25 -0.06 1.08 0.20 0.00 0.00 0.00 175.10 176.57 1uph s ASN 47 N -1.94 7.32 0.08 3.32 -0.87 -1.26 -3.25 114.94 118.34 1uph s ASN 47 Ca 0.07 2.15 -0.13 0.00 -1.57 0.00 0.00 52.86 53.37 1uph s ASN 47 Cb -0.10 -2.61 -0.21 0.00 -0.02 0.00 0.00 41.25 38.31 1uph s ASN 47 CO 0.04 -0.13 1.23 1.55 -2.57 0.00 0.00 177.10 177.22 1uph h PRO 48 N 4.41 0.74 -0.01 -0.60 0.13 -1.91 -3.18 132.00 131.59 1uph h PRO 48 Ca -0.45 -0.73 -0.05 0.00 -0.87 0.00 0.00 66.00 63.90 1uph h PRO 48 Cb 1.21 0.19 -0.01 0.00 0.13 0.00 0.00 31.00 32.52 1uph h PRO 48 CO 0.69 1.31 -0.24 0.78 -0.23 0.00 0.00 178.00 180.31 1uph h GLY 49 N 0.45 0.01 2.00 1.56 0.00 -1.93 -0.76 103.07 104.41 1uph h GLY 49 Ca -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.22 1uph h GLY 49 CO 0.19 0.01 0.00 -2.00 0.00 0.00 0.00 176.54 174.74 1uph h LEU 50 N 0.01 0.00 -1.07 3.11 7.12 -1.91 0.24 115.31 122.81 1uph h LEU 50 Ca -0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 1uph h LEU 50 Cb 0.44 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.57 1uph h LEU 50 CO 0.03 0.00 -0.04 -0.11 -0.13 0.00 0.00 178.44 178.19 1uph n LEU 51 N -2.48 1.70 0.00 2.25 7.94 -0.29 -3.74 117.00 122.38 1uph n LEU 51 Ca 0.00 -0.56 0.12 0.00 -1.11 0.00 0.00 56.01 54.46 1uph n LEU 51 Cb 0.16 -0.02 0.65 0.00 0.53 0.00 0.00 43.42 44.75 1uph n LEU 51 CO 0.18 0.29 0.92 -1.84 -1.11 0.00 0.00 177.39 175.83 1uph n GLU 52 N 0.26 0.43 -4.48 1.96 0.28 0.83 -4.44 120.64 115.47 1uph n GLU 52 Ca 0.17 0.04 -0.31 0.00 -0.16 0.00 0.00 57.16 56.90 1uph n GLU 52 Cb 0.40 -1.50 -0.11 0.00 1.43 0.00 0.00 31.44 31.66 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 -2.49 3.26 0.41 3.84 -4.23 -1.25 -4.73 115.64 110.46 1uph s THR 53 Ca 0.26 -1.05 0.11 0.00 -1.18 0.00 0.00 61.69 59.84 1uph s THR 53 Cb 0.17 -2.43 0.31 0.00 1.34 0.00 0.00 72.50 71.90 1uph s THR 53 CO 0.37 0.30 1.98 0.77 -0.54 0.00 0.00 174.62 177.51 1uph h SER 54 N 4.31 0.45 -0.08 3.99 4.64 -1.89 -0.61 113.55 124.36 1uph h SER 54 Ca -0.48 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 60.84 1uph h SER 54 Cb 1.16 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 63.16 1uph h SER 54 CO 0.51 0.28 0.01 -0.33 -0.87 0.00 0.00 176.83 176.43 1uph h GLU 55 N 0.50 0.13 -0.93 4.77 5.08 -1.95 -0.76 114.58 121.42 1uph h GLU 55 Ca 0.28 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.62 1uph h GLU 55 Cb 0.43 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 1uph h GLU 55 CO -0.08 0.34 0.62 0.78 -1.00 0.00 0.00 179.01 179.67 1uph h GLY 56 N -0.11 1.32 0.98 -3.84 0.00 -1.41 0.42 103.07 100.44 1uph h GLY 56 Ca 0.02 -0.48 -0.04 0.00 0.00 0.00 0.00 47.33 46.83 1uph h GLY 56 CO 0.00 0.46 0.17 0.00 0.00 0.00 0.00 176.54 177.18 1uph h ARG 58 N 0.74 0.62 0.16 0.00 1.12 -0.19 -0.42 114.38 116.40 1uph h ARG 58 Ca 0.17 -0.24 -0.01 0.00 -1.11 0.00 0.00 59.98 58.80 1uph h ARG 58 Cb 0.27 -0.03 0.00 0.00 -0.01 0.00 0.00 29.97 30.20 1uph h ARG 58 CO -0.01 0.80 -0.08 0.37 -3.11 0.00 0.00 179.97 177.95 1uph h GLN 59 N 0.54 -0.20 -0.25 0.20 5.75 0.32 0.32 115.11 121.78 1uph h GLN 59 Ca 0.08 0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.61 1uph h GLN 59 Cb 0.70 0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.28 1uph h GLN 59 CO 0.05 0.07 0.13 0.82 -2.65 0.00 0.00 178.83 177.25 1uph h ILE 60 N -0.47 1.00 -0.95 2.39 5.03 -0.76 0.40 117.51 124.15 1uph h ILE 60 Ca -0.02 -0.09 0.09 0.00 -0.12 0.00 0.00 64.86 64.72 1uph h ILE 60 Cb 0.37 0.71 -0.07 0.00 -3.03 0.00 0.00 36.82 34.79 1uph h ILE 60 CO 0.04 0.05 0.61 0.25 -0.68 0.00 0.00 178.15 178.41 1uph h LEU 61 N 0.27 0.89 -0.65 1.44 5.85 -1.01 0.23 115.31 122.33 1uph h LEU 61 Ca 0.10 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.78 1uph h LEU 61 Cb 0.02 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 1uph h LEU 61 CO -0.07 0.53 -0.30 1.23 -0.34 0.00 0.00 178.44 179.49 1uph h GLY 62 N 0.99 0.00 1.10 3.75 0.00 0.19 0.44 103.07 109.54 1uph h GLY 62 Ca 0.44 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.58 1uph h GLY 62 CO -0.19 0.00 -0.60 -1.61 0.00 0.00 0.00 176.54 174.13 1uph h GLN 63 N 0.00 0.78 0.00 4.80 5.75 0.30 -3.16 115.11 123.58 1uph h GLN 63 Ca -0.00 -0.56 0.00 0.00 -0.15 0.00 0.00 58.65 57.94 1uph h GLN 63 Cb 0.98 0.09 0.00 0.00 1.07 0.00 0.00 27.48 29.62 1uph h GLN 63 CO 0.04 1.18 -0.94 1.28 -2.65 0.00 0.00 178.83 177.73 1uph n LEU 64 N -4.04 0.69 -0.35 -2.39 4.77 -0.25 -4.21 117.00 111.22 1uph n LEU 64 Ca -0.06 0.18 0.01 0.00 -0.03 0.00 0.00 56.01 56.11 1uph n LEU 64 Cb 0.65 -0.11 0.07 0.00 -2.33 0.00 0.00 43.42 41.70 1uph n LEU 64 CO 0.50 -0.07 0.56 0.00 -1.33 0.00 0.00 177.39 177.05 1uph n GLN 65 N -2.27 -0.17 0.02 3.23 6.02 0.15 0.68 117.38 125.05 1uph n GLN 65 Ca 0.01 1.42 -0.18 0.00 -0.01 0.00 0.00 57.00 58.24 1uph n GLN 65 Cb 0.48 -2.11 -0.08 0.00 1.02 0.00 0.00 30.24 29.55 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 0.69 0.00 -1.09 0.13 -1.74 -2.99 132.00 127.00 1uph h PRO 66 Ca 0.36 -0.68 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1uph h PRO 66 Cb 0.59 0.18 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1uph h PRO 66 CO -0.92 1.27 0.02 1.03 -0.23 0.00 0.00 178.00 179.17 1uph h SER 67 N 0.42 0.00 0.05 1.44 0.87 -0.30 0.12 113.55 116.16 1uph h SER 67 Ca -0.10 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.27 1uph h SER 67 Cb 1.58 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.54 1uph h SER 67 CO 0.18 0.00 -0.71 -0.07 -0.53 0.00 0.00 176.83 175.70 1uph h LEU 68 N 0.00 0.70 -0.93 2.23 3.38 0.41 0.15 115.31 121.25 1uph h LEU 68 Ca 0.00 -0.44 0.31 0.00 0.09 0.00 0.00 57.88 57.84 1uph h LEU 68 Cb 0.05 -0.20 -0.17 0.00 0.09 0.00 0.00 40.66 40.42 1uph h LEU 68 CO 0.00 1.20 0.22 1.67 0.09 0.00 0.00 178.44 181.62 1uph n GLN 69 N -3.90 -0.07 -2.79 1.13 7.27 0.42 -1.42 117.38 118.03 1uph n GLN 69 Ca -0.05 1.34 -0.02 0.00 0.07 0.00 0.00 57.00 58.34 1uph n GLN 69 Cb 0.70 -2.24 0.05 0.00 2.41 0.00 0.00 30.24 31.16 1uph n GLN 69 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38 1uph n THR 70 N -5.25 1.25 -2.14 1.69 -2.24 -1.20 -5.11 114.28 101.28 1uph n THR 70 Ca 0.27 -2.98 -0.27 0.00 -2.27 0.00 0.00 64.05 58.80 1uph n THR 70 Cb 0.91 1.12 0.11 0.00 -2.10 0.00 0.00 70.33 70.38 1uph n THR 70 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1uph s GLY 71 N -3.68 1.71 0.68 3.38 0.00 0.51 -5.06 107.32 104.86 1uph s GLY 71 Ca 0.28 -1.09 -0.04 0.00 0.00 0.00 0.00 44.72 43.87 1uph s GLY 71 CO -0.02 -0.54 0.96 -1.35 0.00 0.00 0.00 173.10 172.14 1uph s SER 72 N -4.66 4.82 0.16 1.64 1.04 -1.26 -4.86 113.70 110.58 1uph s SER 72 Ca 0.65 0.24 -0.14 0.00 0.48 0.00 0.00 55.95 57.18 1uph s SER 72 Cb -0.08 -0.90 0.05 0.00 0.10 0.00 0.00 66.02 65.20 1uph s SER 72 CO 0.48 -1.55 1.78 -0.33 0.98 0.00 0.00 173.24 174.60 1uph h GLU 73 N -0.45 0.72 -0.43 4.02 4.39 -1.98 0.24 114.58 121.09 1uph h GLU 73 Ca -0.43 -0.08 -0.10 0.00 0.34 0.00 0.00 59.36 59.09 1uph h GLU 73 Cb 1.30 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.80 1uph h GLU 73 CO 0.55 0.55 -0.13 1.05 -1.16 0.00 0.00 179.01 179.87 1uph h GLU 74 N 0.70 0.84 -0.65 2.33 4.11 -1.99 -1.37 114.58 118.55 1uph h GLU 74 Ca 0.18 -0.33 -0.01 0.00 0.07 0.00 0.00 59.36 59.27 1uph h GLU 74 Cb 0.03 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 1uph h GLU 74 CO -0.03 0.96 0.36 1.25 0.07 0.00 0.00 179.01 181.62 1uph h LEU 75 N 0.67 0.81 -0.07 3.06 5.85 -1.85 -0.92 115.31 122.85 1uph h LEU 75 Ca 0.11 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1uph h LEU 75 Cb 0.67 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.49 1uph h LEU 75 CO 0.05 0.67 0.04 -0.09 -0.34 0.00 0.00 178.44 178.77 1uph h ARG 76 N 0.88 0.10 -0.96 1.25 2.43 -0.35 -0.91 114.38 116.82 1uph h ARG 76 Ca 0.23 -0.01 0.10 0.00 -0.81 0.00 0.00 59.98 59.49 1uph h ARG 76 Cb 0.04 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 29.50 1uph h ARG 76 CO -0.04 0.11 0.62 1.03 -1.51 0.00 0.00 179.97 180.18 1uph h SER 77 N 0.05 0.91 -0.24 -3.80 0.87 -0.93 -0.26 113.55 110.15 1uph h SER 77 Ca 0.03 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.60 1uph h SER 77 Cb 0.04 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 1uph h SER 77 CO -0.00 0.53 0.11 0.25 -0.53 0.00 0.00 176.83 177.19 1uph h LEU 78 N 1.00 0.32 -1.10 2.23 7.12 -0.62 -1.08 115.31 123.18 1uph h LEU 78 Ca 0.45 -0.14 0.05 0.00 0.13 0.00 0.00 57.88 58.37 1uph h LEU 78 Cb 0.37 -0.08 -0.06 0.00 -0.53 0.00 0.00 40.66 40.36 1uph h LEU 78 CO -0.20 0.37 0.61 0.22 -0.13 0.00 0.00 178.44 179.30 1uph h TYR 79 N 0.25 1.11 -0.25 1.25 3.20 0.17 0.13 116.97 122.83 1uph h TYR 79 Ca 0.08 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 1uph h TYR 79 Cb 0.14 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.03 1uph h TYR 79 CO -0.02 0.60 0.09 -0.97 -1.64 0.00 0.00 178.16 176.22 1uph h ASN 80 N 1.11 0.36 -0.69 -2.11 -0.73 -0.67 0.53 115.58 113.39 1uph h ASN 80 Ca 0.39 -0.19 -0.00 0.00 1.87 0.00 0.00 56.30 58.36 1uph h ASN 80 Cb 0.12 -0.10 -0.03 0.00 0.27 0.00 0.00 38.32 38.58 1uph h ASN 80 CO -0.14 0.46 0.41 0.74 -0.37 0.00 0.00 177.43 178.53 1uph h THR 81 N 0.25 1.20 -0.27 -3.57 2.02 -0.38 -0.09 112.91 112.06 1uph h THR 81 Ca 0.08 -0.45 -0.00 0.00 0.77 0.00 0.00 66.41 66.81 1uph h THR 81 Cb 0.22 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 1uph h THR 81 CO -0.00 0.21 0.16 0.40 0.37 0.00 0.00 175.52 176.65 1uph h ILE 82 N 0.93 1.11 -0.53 3.11 1.08 -0.52 0.29 117.51 122.99 1uph h ILE 82 Ca 0.25 -0.28 0.05 0.00 -0.39 0.00 0.00 64.86 64.48 1uph h ILE 82 Cb -0.02 0.80 -0.05 0.00 -3.07 0.00 0.00 36.82 34.48 1uph h ILE 82 CO -0.05 0.11 0.26 0.00 -0.69 0.00 0.00 178.15 177.79 1uph h ALA 83 N 1.04 0.68 -0.60 1.87 0.00 -0.45 0.28 119.26 122.09 1uph h ALA 83 Ca 0.10 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1uph h ALA 83 Cb 0.04 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1uph h ALA 83 CO -0.02 -0.09 0.28 0.28 0.00 0.00 0.00 179.25 179.71 1uph h VAL 84 N 0.51 1.21 -0.61 0.00 2.07 -0.54 -0.41 116.25 118.49 1uph h VAL 84 Ca 0.24 -0.60 0.02 0.00 0.82 0.00 0.00 66.70 67.17 1uph h VAL 84 Cb 0.16 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.40 1uph h VAL 84 CO -0.17 0.24 0.39 0.25 0.02 0.00 0.00 177.57 178.30 1uph h LEU 85 N 0.82 0.65 -0.86 2.57 7.12 0.69 -0.75 115.31 125.54 1uph h LEU 85 Ca 0.21 -0.01 -0.02 0.00 0.13 0.00 0.00 57.88 58.19 1uph h LEU 85 Cb 0.12 -0.15 -0.04 0.00 -0.53 0.00 0.00 40.66 40.06 1uph h LEU 85 CO -0.03 0.46 0.45 0.22 -0.13 0.00 0.00 178.44 179.41 1uph h TYR 86 N 0.78 1.21 -0.49 1.25 3.20 0.04 0.81 116.97 123.77 1uph h TYR 86 Ca 0.24 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.06 1uph h TYR 86 Cb -0.03 -0.38 -0.02 0.00 1.54 0.00 0.00 36.73 37.83 1uph h TYR 86 CO -0.04 0.86 0.31 0.00 -1.64 0.00 0.00 178.16 177.64 1uph h VAL 88 N 0.66 1.20 -0.05 0.00 2.07 -0.59 1.65 116.25 121.20 1uph h VAL 88 Ca 0.18 -0.88 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 1uph h VAL 88 Cb -0.04 1.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 1uph h VAL 88 CO -0.04 0.28 0.03 0.45 0.02 0.00 0.00 177.57 178.31 1uph h HIS 89 N 0.33 0.07 -0.09 1.57 -0.00 0.48 -1.79 115.15 115.71 1uph h HIS 89 Ca 0.06 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.43 1uph h HIS 89 Cb 0.42 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 27.80 1uph h HIS 89 CO 0.01 0.11 0.00 0.94 -0.00 0.00 0.00 177.93 178.99 1uph n GLN 90 N -5.02 1.51 -2.95 2.45 7.27 -0.37 -4.85 117.38 115.42 1uph n GLN 90 Ca -0.06 -0.76 -0.08 0.00 0.07 0.00 0.00 57.00 56.17 1uph n GLN 90 Cb 0.06 -1.40 0.04 0.00 2.41 0.00 0.00 30.24 31.35 1uph n GLN 90 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1uph n ARG 91 N -0.04 -1.63 -4.26 3.69 1.74 0.14 -5.01 116.66 111.29 1uph n ARG 91 Ca 0.17 0.99 -0.34 0.00 -0.77 0.00 0.00 57.85 57.90 1uph n ARG 91 Cb 0.26 -5.23 -0.11 0.00 -1.02 0.00 0.00 32.46 26.37 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 -3.20 4.29 -0.08 0.55 1.01 0.52 -4.96 121.20 119.33 1uph s ILE 92 Ca 0.24 -0.22 -0.35 0.00 0.00 0.00 0.00 60.65 60.32 1uph s ILE 92 Cb -0.03 -2.89 -0.13 0.00 0.01 0.00 0.00 42.46 39.42 1uph s ILE 92 CO 0.64 0.51 1.77 -0.67 0.00 0.00 0.00 174.94 177.19 1uph n ASP 93 N 3.24 3.07 -4.11 3.58 -0.08 -1.26 -4.51 116.55 116.48 1uph n ASP 93 Ca -0.17 1.02 -0.11 0.00 -1.51 0.00 0.00 54.79 54.01 1uph n ASP 93 Cb 0.53 -1.32 -0.11 0.00 2.34 0.00 0.00 41.12 42.56 1uph n ASP 93 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 1uph s VAL 94 N 3.26 0.57 0.00 5.18 -7.23 -1.26 -4.92 120.40 116.00 1uph s VAL 94 Ca 0.91 -1.53 0.00 0.00 -1.81 0.00 0.00 61.98 59.55 1uph s VAL 94 Cb -0.78 -1.17 0.00 0.00 0.56 0.00 0.00 36.38 34.99 1uph s VAL 94 CO 0.52 -0.67 0.00 2.29 -0.31 0.00 0.00 175.10 176.93 1uph n LYS 95 N 0.66 0.00 -4.15 4.82 0.00 -1.26 -4.90 118.16 113.33 1uph n LYS 95 Ca -0.17 0.00 -0.12 0.00 -0.00 0.00 0.00 58.31 58.02 1uph n LYS 95 Cb 0.58 -0.10 -0.11 0.00 -0.00 0.00 0.00 35.03 35.40 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 -4.14 1.17 0.46 -5.58 -4.77 -1.26 -0.16 116.67 102.40 1uph s ASP 96 Ca 0.00 -0.85 0.12 0.00 -3.30 0.00 0.00 52.55 48.51 1uph s ASP 96 Cb 0.00 0.06 1.05 0.00 -1.09 0.00 0.00 42.92 42.94 1uph s ASP 96 CO 0.00 -0.35 2.09 0.71 0.70 0.00 0.00 175.17 178.32 1uph h THR 97 N 3.46 1.04 -0.19 2.11 1.35 -1.29 0.41 112.91 119.81 1uph h THR 97 Ca -0.36 -0.10 -0.08 0.00 -0.55 0.00 0.00 66.41 65.31 1uph h THR 97 Cb 1.18 0.71 -0.00 0.00 -1.73 0.00 0.00 68.15 68.31 1uph h THR 97 CO 0.56 0.06 -0.21 0.50 -0.25 0.00 0.00 175.52 176.18 1uph h LYS 98 N 0.30 0.47 -0.17 4.72 1.63 -1.84 1.00 116.57 122.69 1uph h LYS 98 Ca 0.10 -0.26 -0.10 0.00 -0.85 0.00 0.00 60.65 59.54 1uph h LYS 98 Cb 0.02 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.65 1uph h LYS 98 CO -0.02 0.84 -0.34 1.49 -3.45 0.00 0.00 179.45 177.97 1uph h GLU 99 N 0.13 0.34 0.00 1.90 4.57 -1.71 0.39 114.58 120.21 1uph h GLU 99 Ca 0.03 -0.14 -0.00 0.00 -1.18 0.00 0.00 59.36 58.06 1uph h GLU 99 Cb 0.76 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.34 1uph h GLU 99 CO 0.05 0.64 -0.00 0.00 -1.18 0.00 0.00 179.01 178.52 1uph h ALA 100 N 1.35 -0.00 -0.19 2.92 0.00 -0.11 0.37 119.26 123.60 1uph h ALA 100 Ca 0.04 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 1uph h ALA 100 Cb 0.74 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1uph h ALA 100 CO 0.06 -0.26 -0.20 -0.07 0.00 0.00 0.00 179.25 178.78 1uph h LEU 101 N -0.50 0.31 -0.25 0.00 3.38 -0.70 0.15 115.31 117.71 1uph h LEU 101 Ca -0.00 -0.09 -0.15 0.00 0.09 0.00 0.00 57.88 57.74 1uph h LEU 101 Cb 0.49 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1uph h LEU 101 CO 0.00 0.53 -0.42 -0.78 0.09 0.00 0.00 178.44 177.86 1uph h ASP 102 N 0.30 0.80 -0.06 -0.43 3.58 -0.13 0.40 116.42 120.87 1uph h ASP 102 Ca 0.05 -0.53 -0.01 0.00 0.42 0.00 0.00 57.03 56.96 1uph h ASP 102 Cb 0.52 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 41.34 1uph h ASP 102 CO 0.03 1.18 0.01 0.11 -2.88 0.00 0.00 179.24 177.69 1uph h LYS 103 N 0.45 0.11 -0.34 0.28 6.56 0.17 0.38 116.57 124.17 1uph h LYS 103 Ca 0.02 -0.03 -0.07 0.00 -1.06 0.00 0.00 60.65 59.51 1uph h LYS 103 Cb 1.02 -0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 32.65 1uph h LYS 103 CO 0.10 0.32 -0.07 0.97 -2.06 0.00 0.00 179.45 178.70 1uph h ILE 104 N -0.13 1.23 -0.49 1.86 6.09 -0.72 -0.07 117.51 125.28 1uph h ILE 104 Ca 0.02 -0.97 -0.13 0.00 -1.37 0.00 0.00 64.86 62.40 1uph h ILE 104 Cb 0.26 1.05 -0.01 0.00 0.47 0.00 0.00 36.82 38.59 1uph h ILE 104 CO 0.00 0.33 -0.21 -0.08 -3.07 0.00 0.00 178.15 175.12 1uph h GLU 105 N 0.53 1.01 -0.06 2.19 4.81 0.12 -1.27 114.58 121.92 1uph h GLU 105 Ca 0.10 -0.43 -0.01 0.00 -0.13 0.00 0.00 59.36 58.89 1uph h GLU 105 Cb 0.46 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.80 1uph h GLU 105 CO 0.02 1.11 -0.01 1.49 -0.73 0.00 0.00 179.01 180.89 1uph h GLU 106 N 0.87 0.11 -0.29 1.92 4.22 0.21 -1.29 114.58 120.33 1uph h GLU 106 Ca 0.11 -0.04 0.05 0.00 0.08 0.00 0.00 59.36 59.56 1uph h GLU 106 Cb 0.79 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.00 1uph h GLU 106 CO 0.07 0.43 0.03 1.49 -2.18 0.00 0.00 179.01 178.84 1uph h GLU 107 N -0.21 0.12 -0.04 1.92 4.57 -0.99 0.62 114.58 120.57 1uph h GLU 107 Ca 0.02 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.21 1uph h GLU 107 Cb 0.39 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.92 1uph h GLU 107 CO 0.01 0.08 -0.11 0.37 -1.18 0.00 0.00 179.01 178.17 1uph h GLN 108 N 0.12 -0.16 -0.43 1.92 4.15 -1.19 0.30 115.11 119.82 1uph h GLN 108 Ca 0.14 0.01 0.08 0.00 0.77 0.00 0.00 58.65 59.65 1uph h GLN 108 Cb 0.16 0.04 -0.07 0.00 0.21 0.00 0.00 27.48 27.82 1uph h GLN 108 CO -0.21 -0.11 -0.00 -0.91 -1.93 0.00 0.00 178.83 175.68 1uph h ASN 109 N -0.17 -0.18 -0.73 -0.69 4.21 -0.75 0.22 115.58 117.50 1uph h ASN 109 Ca 0.05 0.10 0.02 0.00 1.21 0.00 0.00 56.30 57.69 1uph h ASN 109 Cb 0.24 0.18 -0.04 0.00 -1.12 0.00 0.00 38.32 37.57 1uph h ASN 109 CO -0.14 -0.05 0.47 0.50 -1.29 0.00 0.00 177.43 176.92 1uph h LYS 110 N 0.11 0.90 0.40 0.81 3.64 -0.27 -0.32 116.57 121.82 1uph h LYS 110 Ca 0.21 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1uph h LYS 110 Cb 0.31 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1uph h LYS 110 CO -0.36 0.59 -0.33 1.03 -2.27 0.00 0.00 179.45 178.12 1uph h SER 111 N 0.92 -0.87 -0.32 4.20 0.87 0.16 0.17 113.55 118.68 1uph h SER 111 Ca 0.29 0.07 0.07 0.00 -1.23 0.00 0.00 61.79 60.99 1uph h SER 111 Cb -0.02 0.28 -0.08 0.00 -0.44 0.00 0.00 62.40 62.15 1uph h SER 111 CO -0.09 -0.48 -0.21 0.50 -0.53 0.00 0.00 176.83 176.02 1uph h LYS 112 N -0.73 -0.17 -0.32 2.24 3.64 -0.32 0.15 116.57 121.07 1uph h LYS 112 Ca -0.03 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 -0.02 -0.11 -0.20 0.87 -2.27 0.00 0.00 179.45 177.71 1uph h LYS 113 N -0.17 -0.16 -0.25 1.90 1.79 -0.72 0.20 116.57 119.15 1uph h LYS 113 Ca 0.16 0.01 0.06 0.00 -2.18 0.00 0.00 60.65 58.71 1uph h LYS 113 Cb 0.42 0.04 -0.07 0.00 -1.58 0.00 0.00 32.23 31.04 1uph h LYS 113 CO -0.42 -0.11 -0.23 -0.22 -1.08 0.00 0.00 179.45 177.40 1uph h LYS 114 N -0.17 -0.22 -0.30 3.15 3.64 0.73 0.20 116.57 123.61 1uph h LYS 114 Ca 0.16 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.63 1uph h LYS 114 Cb 0.42 0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 32.22 1uph h LYS 114 CO -0.42 -0.15 -0.21 0.00 -2.27 0.00 0.00 179.45 176.40 1uph h ALA 115 N 0.85 -0.02 -0.31 5.00 0.00 0.56 0.43 119.26 125.76 1uph h ALA 115 Ca 0.14 0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.22 1uph h ALA 115 Cb 0.44 0.47 -0.07 0.00 0.00 0.00 0.00 17.79 18.63 1uph h ALA 115 CO -0.38 -0.61 -0.15 0.37 0.00 0.00 0.00 179.25 178.48 1uph h GLN 116 N -0.18 -0.10 -0.35 0.00 -0.00 0.57 0.17 115.11 115.22 1uph h GLN 116 Ca 0.16 0.01 0.07 0.00 -0.00 0.00 0.00 58.65 58.89 1uph h GLN 116 Cb 0.43 0.02 -0.07 0.00 0.00 0.00 0.00 27.48 27.85 1uph h GLN 116 CO -0.41 -0.06 -0.14 0.37 0.00 0.00 0.00 178.83 178.59 1uph h GLN 117 N -0.10 -0.06 0.54 1.69 4.15 0.54 0.58 115.11 122.44 1uph h GLN 117 Ca 0.16 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.57 1uph h GLN 117 Cb 0.34 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.03 1uph h GLN 117 CO -0.38 -0.04 -0.44 0.00 -1.93 0.00 0.00 178.83 176.04 1uph h ALA 118 N 1.24 -1.03 -0.64 3.38 0.00 0.02 -1.23 119.26 120.99 1uph h ALA 118 Ca 0.17 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.97 1uph h ALA 118 Cb 0.33 0.61 -0.09 0.00 0.00 0.00 0.00 17.79 18.64 1uph h ALA 118 CO -0.40 -1.11 -0.51 0.00 0.00 0.00 0.00 179.25 177.23 1uph h ALA 119 N -0.72 -0.60 -0.63 0.00 0.00 -0.14 0.21 119.26 117.38 1uph h ALA 119 Ca -0.06 0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.97 1uph h ALA 119 Cb 0.82 1.22 -0.09 0.00 0.00 0.00 0.00 17.79 19.74 1uph h ALA 119 CO -0.01 -0.91 -0.51 0.00 0.00 0.00 0.00 179.25 177.82 1uph h ALA 120 N 0.09 -0.61 -0.66 0.00 0.00 -0.68 0.13 119.26 117.52 1uph h ALA 120 Ca 0.11 0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.17 1uph h ALA 120 Cb 0.44 1.21 -0.12 0.00 0.00 0.00 0.00 17.79 19.32 1uph h ALA 120 CO -0.69 -0.92 -0.40 0.22 0.00 0.00 0.00 179.25 177.46 1uph h ASP 121 N -0.18 -1.38 -3.77 0.00 3.58 0.22 -3.40 116.42 111.49 1uph h ASP 121 Ca 0.10 0.25 -0.43 0.00 0.42 0.00 0.00 57.03 57.37 1uph h ASP 121 Cb 0.45 0.66 0.18 0.00 1.72 0.00 0.00 39.33 42.34 1uph h ASP 121 CO -0.69 -0.31 0.26 0.42 -2.88 0.00 0.00 179.24 176.04 1uph s THR 122 N -5.90 1.79 0.30 2.25 -4.23 0.56 -5.03 115.64 105.38 1uph s THR 122 Ca -0.14 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.37 1uph s THR 122 Cb 0.15 -2.71 0.00 0.00 1.34 0.00 0.00 72.50 71.28 1uph s THR 122 CO 0.68 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.37 1uph n GLY 123 N -2.15 -0.51 3.25 3.99 0.00 -1.26 -4.85 105.19 103.66 1uph n GLY 123 Ca 0.13 0.05 -0.14 0.00 0.00 0.00 0.00 46.02 46.06 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 -4.55 0.96 0.22 1.61 3.84 -1.26 -5.12 114.94 110.63 1uph s ASN 124 Ca 0.00 -1.29 0.02 0.00 0.21 0.00 0.00 52.86 51.80 1uph s ASN 124 Cb 0.00 0.19 -0.05 0.00 -0.55 0.00 0.00 41.25 40.84 1uph s ASN 124 CO 0.00 -0.69 0.05 0.20 -2.79 0.00 0.00 177.10 173.88 1uph s ASN 125 N -3.21 1.21 0.23 -4.21 -0.87 -1.26 -5.17 114.94 101.66 1uph s ASN 125 Ca 0.31 -1.29 0.00 0.00 -1.57 0.00 0.00 52.86 50.32 1uph s ASN 125 Cb 0.07 0.14 -0.05 0.00 -0.02 0.00 0.00 41.25 41.40 1uph s ASN 125 CO 0.09 -0.66 0.11 -0.44 -2.57 0.00 0.00 177.10 173.62 1uph s SER 126 N -3.25 0.77 0.10 -1.22 0.01 -1.26 -5.17 113.70 103.67 1uph s SER 126 Ca 0.32 -1.38 -0.16 0.00 1.31 0.00 0.00 55.95 56.04 1uph s SER 126 Cb 0.07 0.25 0.03 0.00 0.21 0.00 0.00 66.02 66.58 1uph s SER 126 CO 0.09 -0.77 0.39 -1.58 0.41 0.00 0.00 173.24 171.79 1uph s GLN 127 N -4.08 1.01 0.27 12.44 0.74 -1.26 -5.15 119.66 123.63 1uph s GLN 127 Ca 0.38 -0.61 -0.29 0.00 0.05 0.00 0.00 55.36 54.88 1uph s GLN 127 Cb 0.07 0.44 -0.09 0.00 1.10 0.00 0.00 33.01 34.54 1uph s GLN 127 CO 0.13 -0.38 1.11 0.54 -0.55 0.00 0.00 175.29 176.14 1uph s VAL 128 N -3.38 3.51 -0.07 1.34 0.11 -1.26 -4.97 120.40 115.68 1uph s VAL 128 Ca 0.00 1.49 -0.12 0.00 -2.93 0.00 0.00 61.98 60.43 1uph s VAL 128 Cb 0.01 -3.95 -0.08 0.00 -1.53 0.00 0.00 36.38 30.84 1uph s VAL 128 CO -0.09 0.34 0.46 0.28 -3.33 0.00 0.00 175.10 172.76 1uph h SER 129 N 4.00 -0.23 -5.63 3.54 0.02 -2.08 -3.49 113.55 109.67 1uph h SER 129 Ca -0.46 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 1uph h SER 129 Cb 1.21 0.06 -0.05 0.00 0.14 0.00 0.00 62.40 63.76 1uph h SER 129 CO 0.68 0.27 -0.88 1.67 -1.14 0.00 0.00 176.83 177.43 1uph n GLN 130 N -4.95 -2.67 -4.42 3.45 7.27 -1.26 -5.03 117.38 109.76 1uph n GLN 130 Ca -0.05 2.21 -0.21 0.00 0.07 0.00 0.00 57.00 59.02 1uph n GLN 130 Cb 0.16 -3.06 -0.10 0.00 2.41 0.00 0.00 30.24 29.65 1uph n GLN 130 CO 0.00 0.00 0.00 -0.80 0.07 0.00 0.00 177.06 176.33 1uph s ASN 131 N -0.64 2.43 0.00 1.69 0.01 -1.26 -5.32 114.94 111.86 1uph s ASN 131 Ca -0.11 -1.29 0.30 0.00 -0.71 0.00 0.00 52.86 51.06 1uph s ASN 131 Cb 0.01 -0.10 1.80 0.00 0.41 0.00 0.00 41.25 43.36 1uph s ASN 131 CO 0.40 -0.50 2.13 0.00 -1.51 0.00 0.00 177.10 177.62