#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x3q n SER 2 N 0.00 0.00 -4.64 1.61 3.41 -1.26 -5.02 113.62 107.71 1x3q n SER 2 Ca 0.00 0.00 -0.48 0.00 -0.26 0.00 0.00 58.87 58.13 1x3q n SER 2 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 1x3q n SER 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x3q n GLN 3 N 0.00 2.08 0.00 4.33 6.02 -1.26 -4.00 117.38 124.55 1x3q n GLN 3 Ca 0.00 0.73 0.00 0.00 -0.01 0.00 0.00 57.00 57.72 1x3q n GLN 3 Cb 0.00 -2.72 0.00 0.00 1.02 0.00 0.00 30.24 28.54 1x3q n GLN 3 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1x3q n VAL 4 N 5.72 0.00 0.00 5.09 0.31 -1.26 -4.90 118.33 123.29 1x3q n VAL 4 Ca 0.25 0.55 0.00 0.00 -0.01 0.00 0.00 64.34 65.13 1x3q n VAL 4 Cb 0.31 -1.11 0.00 0.00 -0.91 0.00 0.00 33.84 32.13 1x3q n VAL 4 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 1x3q n PHE 5 N -0.86 0.00 -0.02 3.52 7.35 -1.26 -4.93 117.46 121.27 1x3q n PHE 5 Ca 0.00 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.56 1x3q n PHE 5 Cb 0.00 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 39.73 1x3q n PHE 5 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 1x3q h GLU 6 N 0.00 -0.04 -4.06 -4.13 5.08 -2.04 -3.48 114.58 105.92 1x3q h GLU 6 Ca 0.00 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.14 1x3q h GLU 6 Cb 0.00 0.01 0.09 0.00 0.50 0.00 0.00 28.75 29.35 1x3q h GLU 6 CO 0.00 0.57 -0.44 0.66 -1.00 0.00 0.00 179.01 178.81 1x3q n TYR 7 N -4.80 -1.56 -2.51 4.33 4.01 -1.26 -4.97 117.16 110.39 1x3q n TYR 7 Ca -0.09 0.60 -0.26 0.00 -0.16 0.00 0.00 57.90 57.98 1x3q n TYR 7 Cb 0.31 -3.64 -0.00 0.00 -0.31 0.00 0.00 39.34 35.70 1x3q n TYR 7 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1x3q n ALA 8 N -3.51 4.99 -0.26 -0.72 0.00 -1.26 -4.84 120.51 114.91 1x3q n ALA 8 Ca -0.08 -4.31 0.02 0.00 0.00 0.00 0.00 53.44 49.08 1x3q n ALA 8 Cb 0.57 -0.56 0.15 0.00 0.00 0.00 0.00 19.45 19.60 1x3q n ALA 8 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1x3q h GLU 9 N 2.62 0.63 -6.11 0.00 4.39 -1.85 -3.45 114.58 110.80 1x3q h GLU 9 Ca 0.28 -0.04 -0.43 0.00 0.34 0.00 0.00 59.36 59.51 1x3q h GLU 9 Cb 0.91 -0.14 -0.17 0.00 -0.10 0.00 0.00 28.75 29.24 1x3q h GLU 9 CO 0.84 0.41 -0.63 1.55 -1.16 0.00 0.00 179.01 180.02 1x3q n VAL 10 N -4.84 -0.65 0.00 3.13 3.14 -1.18 -3.58 118.33 114.34 1x3q n VAL 10 Ca 0.12 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.50 1x3q n VAL 10 Cb 0.28 -1.26 0.00 0.00 -1.06 0.00 0.00 33.84 31.80 1x3q n VAL 10 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1x3q n ASP 11 N -2.32 0.00 -3.69 6.55 -0.08 -1.26 -4.46 116.55 111.29 1x3q n ASP 11 Ca 0.04 0.00 -0.28 0.00 -1.51 0.00 0.00 54.79 53.05 1x3q n ASP 11 Cb 0.50 0.00 -0.10 0.00 2.34 0.00 0.00 41.12 43.86 1x3q n ASP 11 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1x3q n GLU 12 N 0.00 2.08 -0.90 -0.67 1.02 -1.24 -4.83 120.64 116.10 1x3q n GLU 12 Ca 0.00 -4.53 0.00 0.00 -0.02 0.00 0.00 57.16 52.61 1x3q n GLU 12 Cb 0.00 -2.25 0.00 0.00 -0.02 0.00 0.00 31.44 29.17 1x3q n GLU 12 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1x3q n ILE 13 N 1.52 0.00 -0.03 -3.67 -5.35 -1.26 -4.74 119.36 105.82 1x3q n ILE 13 Ca 0.24 0.00 -0.03 0.00 -0.27 0.00 0.00 62.75 62.70 1x3q n ILE 13 Cb 0.38 -0.21 -0.05 0.00 -1.74 0.00 0.00 39.64 38.02 1x3q n ILE 13 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 1x3q n VAL 14 N 0.85 0.41 -4.19 7.28 0.31 -1.25 -4.83 118.33 116.91 1x3q n VAL 14 Ca 0.00 -0.27 -0.12 0.00 -0.01 0.00 0.00 64.34 63.95 1x3q n VAL 14 Cb 0.00 -0.72 -0.04 0.00 -0.91 0.00 0.00 33.84 32.17 1x3q n VAL 14 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1x3q n GLU 15 N -2.20 0.35 -0.12 5.55 2.13 -1.26 -4.89 120.64 120.21 1x3q n GLU 15 Ca -0.10 -1.86 0.00 0.00 0.66 0.00 0.00 57.16 55.86 1x3q n GLU 15 Cb 0.66 1.40 0.00 0.00 0.27 0.00 0.00 31.44 33.77 1x3q n GLU 15 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 1x3q n LYS 16 N -0.39 0.00 -0.10 5.31 -0.00 -1.25 -3.48 118.16 118.25 1x3q n LYS 16 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.33 1x3q n LYS 16 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.37 1x3q n LYS 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1x3q n ARG 17 N 0.00 0.00 0.00 -1.58 1.74 -1.25 -4.94 116.66 110.63 1x3q n ARG 17 Ca 0.00 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.18 1x3q n ARG 17 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1x3q n ARG 17 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1x3q n GLY 18 N 1.24 3.86 3.77 -0.13 0.00 -1.23 -4.71 105.19 107.98 1x3q n GLY 18 Ca 0.00 -0.73 -0.32 0.00 0.00 0.00 0.00 46.02 44.97 1x3q n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x3q s LYS 19 N 1.74 2.46 0.43 1.61 1.02 0.34 -4.84 119.74 122.49 1x3q s LYS 19 Ca 0.00 1.28 0.27 0.00 0.02 0.00 0.00 55.97 57.55 1x3q s LYS 19 Cb 0.00 -1.91 1.35 0.00 -0.52 0.00 0.00 37.83 36.74 1x3q s LYS 19 CO 0.00 -1.50 1.67 0.78 -0.92 0.00 0.00 175.35 175.37 1x3q h GLY 20 N -0.63 1.23 -4.52 -3.33 0.00 -2.04 0.18 103.07 93.95 1x3q h GLY 20 Ca -0.45 -0.13 -0.57 0.00 0.00 0.00 0.00 47.33 46.18 1x3q h GLY 20 CO 0.52 -0.32 -0.78 0.28 0.00 0.00 0.00 176.54 176.25 1x3q n LYS 21 N -4.65 3.24 -3.15 4.80 5.02 -1.26 -4.94 118.16 117.21 1x3q n LYS 21 Ca 0.34 -4.38 0.06 0.00 -2.02 0.00 0.00 58.31 52.31 1x3q n LYS 21 Cb 1.29 -2.16 -0.02 0.00 -0.02 0.00 0.00 35.03 34.12 1x3q n LYS 21 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1x3q s ASP 22 N -3.51 -0.14 0.15 4.39 -1.08 0.63 -5.18 116.67 111.93 1x3q s ASP 22 Ca 0.46 0.09 -0.03 0.00 -0.52 0.00 0.00 52.55 52.55 1x3q s ASP 22 Cb 0.41 1.12 -0.03 0.00 -1.46 0.00 0.00 42.92 42.95 1x3q s ASP 22 CO -0.16 -0.03 0.12 -0.69 0.52 0.00 0.00 175.17 174.94 1x3q s VAL 23 N 2.98 0.08 -0.06 1.11 1.01 -1.26 0.13 120.40 124.39 1x3q s VAL 23 Ca -0.09 -1.79 -0.29 0.00 0.00 0.00 0.00 61.98 59.81 1x3q s VAL 23 Cb -0.09 -2.04 0.10 0.00 0.00 0.00 0.00 36.38 34.35 1x3q s VAL 23 CO -0.08 -0.38 0.82 -1.83 0.00 0.00 0.00 175.10 173.64 1x3q s GLU 24 N -4.04 0.87 -0.26 2.72 -1.05 -1.26 -0.13 118.70 115.55 1x3q s GLU 24 Ca 0.24 0.04 -0.01 0.00 -0.15 0.00 0.00 54.97 55.09 1x3q s GLU 24 Cb 0.06 0.41 0.08 0.00 -0.44 0.00 0.00 34.13 34.24 1x3q s GLU 24 CO 0.02 -0.31 0.05 0.71 0.95 0.00 0.00 175.26 176.69 1x3q s TYR 25 N -1.77 1.62 0.00 4.83 1.51 -1.26 -3.85 117.35 118.44 1x3q s TYR 25 Ca -0.04 -1.46 0.00 0.00 -1.01 0.00 0.00 57.07 54.56 1x3q s TYR 25 Cb -0.00 -1.48 0.00 0.00 -0.11 0.00 0.00 41.96 40.36 1x3q s TYR 25 CO 0.01 -0.77 0.00 1.28 -1.11 0.00 0.00 175.55 174.96 1x3q n LEU 26 N 4.88 0.00 -2.67 -1.29 4.77 -1.23 -4.73 117.00 116.73 1x3q n LEU 26 Ca -0.06 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.85 1x3q n LEU 26 Cb 0.44 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.57 1x3q n LEU 26 CO 0.13 0.00 -0.00 0.52 -1.33 0.00 0.00 177.39 176.71 1x3q n VAL 27 N 0.00 1.43 0.00 4.08 0.31 -1.26 -0.02 118.33 122.87 1x3q n VAL 27 Ca 0.00 -3.23 0.00 0.00 -0.01 0.00 0.00 64.34 61.10 1x3q n VAL 27 Cb 0.00 0.69 0.00 0.00 -0.91 0.00 0.00 33.84 33.62 1x3q n VAL 27 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 1x3q n ARG 28 N -0.48 0.00 0.00 5.55 -4.01 -1.26 -3.95 116.66 112.51 1x3q n ARG 28 Ca 0.14 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.95 1x3q n ARG 28 Cb 0.82 -0.62 0.00 0.00 -3.04 0.00 0.00 32.46 29.62 1x3q n ARG 28 CO 0.00 0.00 0.00 -2.67 -3.04 0.00 0.00 177.63 171.92 1x3q n TRP 29 N -2.10 0.00 0.00 2.89 -0.00 -1.26 -3.11 117.44 113.86 1x3q n TRP 29 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 1x3q n TRP 29 Cb 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.53 1x3q n TRP 29 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 1x3q n LYS 30 N -0.23 0.00 -0.06 -2.67 5.02 -1.26 -4.60 118.16 114.36 1x3q n LYS 30 Ca 0.00 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.30 1x3q n LYS 30 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1x3q n LYS 30 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1x3q n ASP 31 N 0.00 -1.17 0.00 4.39 5.68 -1.26 -5.00 116.55 119.19 1x3q n ASP 31 Ca 0.00 0.07 0.00 0.00 -0.50 0.00 0.00 54.79 54.36 1x3q n ASP 31 Cb 0.00 -0.28 0.00 0.00 -1.14 0.00 0.00 41.12 39.70 1x3q n ASP 31 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1x3q n GLY 32 N -0.27 -0.25 0.12 6.12 0.00 -1.26 -4.97 105.19 104.68 1x3q n GLY 32 Ca 0.00 0.28 -0.22 0.00 0.00 0.00 0.00 46.02 46.09 1x3q n GLY 32 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1x3q h GLY 33 N 0.00 0.11 0.00 -0.02 0.00 -2.04 -3.49 103.07 97.64 1x3q h GLY 33 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.04 1x3q h GLY 33 CO 0.00 0.26 0.00 1.22 0.00 0.00 0.00 176.54 178.02 1x3q n ASP 34 N -4.12 1.00 -4.90 0.19 8.00 -1.26 -5.16 116.55 110.30 1x3q n ASP 34 Ca -0.31 -0.83 -0.31 0.00 0.71 0.00 0.00 54.79 54.04 1x3q n ASP 34 Cb 0.80 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.85 1x3q n ASP 34 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1x3q n GLU 36 N 0.09 0.44 -0.15 0.00 -0.58 -1.26 -5.07 120.64 114.12 1x3q n GLU 36 Ca -0.02 -1.79 -0.09 0.00 -0.42 0.00 0.00 57.16 54.84 1x3q n GLU 36 Cb 0.52 -0.73 0.09 0.00 -0.57 0.00 0.00 31.44 30.75 1x3q n GLU 36 CO 0.00 0.00 0.00 -2.67 -0.48 0.00 0.00 177.13 173.98 1x3q n TRP 37 N -0.32 -2.14 0.05 -0.32 -0.00 0.97 -4.92 117.44 110.75 1x3q n TRP 37 Ca 0.07 -0.17 0.00 0.00 -0.00 0.00 0.00 57.50 57.40 1x3q n TRP 37 Cb 0.78 -0.53 0.00 0.00 -0.00 0.00 0.00 31.31 31.56 1x3q n TRP 37 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 1x3q n VAL 38 N -3.70 0.55 -3.67 -1.67 0.31 -1.26 -4.97 118.33 103.91 1x3q n VAL 38 Ca 0.04 0.18 -0.14 0.00 -0.01 0.00 0.00 64.34 64.41 1x3q n VAL 38 Cb 0.18 -1.08 -0.08 0.00 -0.91 0.00 0.00 33.84 31.95 1x3q n VAL 38 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1x3q s LYS 39 N -1.60 0.71 -0.13 5.55 3.01 -1.26 -4.89 119.74 121.12 1x3q s LYS 39 Ca 0.00 0.49 -0.19 0.00 -1.01 0.00 0.00 55.97 55.26 1x3q s LYS 39 Cb 0.00 0.34 -0.17 0.00 -1.01 0.00 0.00 37.83 36.99 1x3q s LYS 39 CO 0.00 -0.14 0.48 0.78 0.51 0.00 0.00 175.35 176.98 1x3q h GLY 40 N 4.65 0.00 -0.80 -3.33 0.00 -0.83 -1.76 103.07 101.01 1x3q h GLY 40 Ca -0.28 0.00 0.38 0.00 0.00 0.00 0.00 47.33 47.43 1x3q h GLY 40 CO 0.25 0.00 0.65 -0.24 0.00 0.00 0.00 176.54 177.19 1x3q h VAL 41 N -1.00 0.18 0.23 4.60 3.04 -1.90 1.54 116.25 122.95 1x3q h VAL 41 Ca -0.02 -0.06 -0.33 0.00 -1.01 0.00 0.00 66.70 65.28 1x3q h VAL 41 Cb 0.69 -0.01 0.03 0.00 -2.01 0.00 0.00 31.29 29.99 1x3q h VAL 41 CO -0.01 0.03 -1.51 -0.74 -1.01 0.00 0.00 177.57 174.34 1x3q h HIS 42 N 0.17 0.87 -0.87 3.17 6.17 -1.95 -3.31 115.15 119.41 1x3q h HIS 42 Ca 0.78 -0.64 -0.53 0.00 0.71 0.00 0.00 60.37 60.69 1x3q h HIS 42 Cb 2.07 -0.03 -0.26 0.00 2.52 0.00 0.00 27.41 31.71 1x3q h HIS 42 CO -0.01 1.55 0.69 0.28 0.71 0.00 0.00 177.93 181.15 1x3q n VAL 43 N -3.67 3.22 -3.16 5.26 0.31 0.41 -4.90 118.33 115.81 1x3q n VAL 43 Ca -0.17 -2.23 -0.05 0.00 -0.01 0.00 0.00 64.34 61.87 1x3q n VAL 43 Cb 1.09 -0.94 0.02 0.00 -0.91 0.00 0.00 33.84 33.09 1x3q n VAL 43 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1x3q n ALA 44 N -0.73 -2.52 -0.02 3.52 0.00 0.43 -4.64 120.51 116.54 1x3q n ALA 44 Ca 0.54 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.89 1x3q n ALA 44 Cb 0.99 -2.39 -0.03 0.00 0.00 0.00 0.00 19.45 18.02 1x3q n ALA 44 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1x3q h GLU 45 N 0.03 -0.09 -0.75 0.00 4.81 0.48 -1.55 114.58 117.52 1x3q h GLU 45 Ca -0.18 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 1x3q h GLU 45 Cb 1.10 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1x3q h GLU 45 CO 0.34 -0.06 0.00 -3.47 -0.73 0.00 0.00 179.01 175.09 1x3q n ASP 46 N -5.25 1.76 -0.04 1.04 2.03 -1.26 -2.58 116.55 112.25 1x3q n ASP 46 Ca -0.02 -2.16 -0.06 0.00 0.52 0.00 0.00 54.79 53.07 1x3q n ASP 46 Cb 0.17 -0.44 -0.03 0.00 -0.72 0.00 0.00 41.12 40.10 1x3q n ASP 46 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1x3q n VAL 47 N 0.10 0.42 0.81 5.18 0.31 -0.65 -4.64 118.33 119.86 1x3q n VAL 47 Ca 0.06 -0.14 0.12 0.00 -0.01 0.00 0.00 64.34 64.37 1x3q n VAL 47 Cb 0.38 -1.03 0.26 0.00 -0.91 0.00 0.00 33.84 32.54 1x3q n VAL 47 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1x3q n ALA 48 N -2.92 3.14 -0.33 3.52 0.00 -0.81 -3.94 120.51 119.16 1x3q n ALA 48 Ca -0.14 -0.28 -0.01 0.00 0.00 0.00 0.00 53.44 53.02 1x3q n ALA 48 Cb 0.63 -1.18 0.12 0.00 0.00 0.00 0.00 19.45 19.02 1x3q n ALA 48 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1x3q h LYS 49 N 0.00 1.09 0.00 0.00 2.10 -1.72 -1.00 116.57 117.04 1x3q h LYS 49 Ca 0.00 -0.07 -0.10 0.00 -2.00 0.00 0.00 60.65 58.48 1x3q h LYS 49 Cb 0.61 -0.25 -0.01 0.00 -0.90 0.00 0.00 32.23 31.68 1x3q h LYS 49 CO 0.00 0.72 -0.49 0.22 -2.00 0.00 0.00 179.45 177.91 1x3q h ASP 50 N 1.12 0.00 0.83 7.07 3.58 -1.86 -2.54 116.42 124.63 1x3q h ASP 50 Ca 0.36 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.77 1x3q h ASP 50 Cb 0.01 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.07 1x3q h ASP 50 CO -0.12 0.49 -0.41 0.22 -2.88 0.00 0.00 179.24 176.53 1x3q h TYR 51 N 0.00 -1.07 0.00 0.28 5.03 -1.33 -3.27 116.97 116.61 1x3q h TYR 51 Ca -0.00 -0.02 -0.09 0.00 2.58 0.00 0.00 58.73 61.19 1x3q h TYR 51 Cb 1.11 0.36 -0.01 0.00 1.55 0.00 0.00 36.73 39.74 1x3q h TYR 51 CO 0.00 -0.66 -0.78 1.49 -1.32 0.00 0.00 178.16 176.89 1x3q h GLU 52 N -1.13 0.00 -0.67 1.82 4.22 -1.59 -3.21 114.58 114.01 1x3q h GLU 52 Ca -0.11 0.00 0.28 0.00 0.08 0.00 0.00 59.36 59.60 1x3q h GLU 52 Cb 0.88 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.01 1x3q h GLU 52 CO 0.18 0.38 0.37 -3.47 -2.18 0.00 0.00 179.01 174.28 1x3q n ASP 53 N -4.55 0.22 -0.03 1.04 2.03 -0.95 0.16 116.55 114.47 1x3q n ASP 53 Ca -0.16 1.08 -0.17 0.00 0.52 0.00 0.00 54.79 56.05 1x3q n ASP 53 Cb 0.42 -0.53 -0.13 0.00 -0.72 0.00 0.00 41.12 40.16 1x3q n ASP 53 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1x3q h GLY 54 N 0.00 0.12 0.00 0.27 0.00 -1.74 -3.29 103.07 98.43 1x3q h GLY 54 Ca 0.56 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.57 1x3q h GLY 54 CO -0.49 0.28 0.00 1.04 0.00 0.00 0.00 176.54 177.36 1x3q n LEU 55 N -4.39 0.00 -3.27 3.11 4.77 0.43 -3.92 117.00 113.74 1x3q n LEU 55 Ca -0.15 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.53 1x3q n LEU 55 Cb 0.64 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.71 1x3q n LEU 55 CO 0.37 0.00 2.73 1.21 -1.33 0.00 0.00 177.39 180.37 1x3q n GLU 56 N 0.00 2.65 0.00 3.23 2.13 -0.46 -4.69 120.64 123.50 1x3q n GLU 56 Ca 0.00 -1.78 0.01 0.00 0.66 0.00 0.00 57.16 56.05 1x3q n GLU 56 Cb 0.00 -2.63 0.05 0.00 0.27 0.00 0.00 31.44 29.13 1x3q n GLU 56 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70