#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x3q h SER 2 N 0.00 0.30 -2.44 1.61 4.64 -2.02 -3.41 113.55 112.23 1x3q h SER 2 Ca 0.00 -0.05 -0.53 0.00 -0.47 0.00 0.00 61.79 60.74 1x3q h SER 2 Cb 0.00 -0.08 0.02 0.00 -0.31 0.00 0.00 62.40 62.04 1x3q h SER 2 CO 0.00 0.26 1.19 0.00 -0.87 0.00 0.00 176.83 177.40 1x3q s GLN 3 N -6.01 4.14 0.00 4.77 -2.07 -1.26 -4.40 119.66 114.83 1x3q s GLN 3 Ca -0.13 2.58 0.00 0.00 -1.82 0.00 0.00 55.36 55.99 1x3q s GLN 3 Cb 0.09 -3.98 0.00 0.00 -1.09 0.00 0.00 33.01 28.03 1x3q s GLN 3 CO 0.70 -0.91 0.00 0.28 -1.32 0.00 0.00 175.29 174.04 1x3q n VAL 4 N 5.30 0.00 0.00 3.63 0.31 -1.26 -4.94 118.33 121.37 1x3q n VAL 4 Ca 0.19 0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.62 1x3q n VAL 4 Cb 0.40 -0.72 0.00 0.00 -0.91 0.00 0.00 33.84 32.61 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 0.00 -0.69 -0.34 3.52 7.35 -1.26 -4.81 117.46 121.24 1x3q n PHE 5 Ca 0.00 0.00 -0.02 0.00 -0.76 0.00 0.00 57.45 56.67 1x3q n PHE 5 Cb 0.00 0.00 0.10 0.00 0.35 0.00 0.00 39.48 39.93 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 1.16 -2.58 -4.13 5.08 -2.05 -3.46 114.58 108.60 1x3q h GLU 6 Ca 0.00 -0.07 -0.38 0.00 -1.00 0.00 0.00 59.36 57.91 1x3q h GLU 6 Cb 0.00 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 28.96 1x3q h GLU 6 CO 0.00 0.77 -0.48 0.98 -1.00 0.00 0.00 179.01 179.28 1x3q n TYR 7 N -4.48 -0.84 -2.19 4.33 4.19 -1.26 -4.90 117.16 112.02 1x3q n TYR 7 Ca 0.11 0.00 -0.26 0.00 3.31 0.00 0.00 57.90 61.06 1x3q n TYR 7 Cb 0.05 -3.68 0.01 0.00 0.49 0.00 0.00 39.34 36.21 1x3q n TYR 7 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1x3q n ALA 8 N -1.68 5.10 -0.27 2.98 0.00 -1.26 -4.87 120.51 120.51 1x3q n ALA 8 Ca -0.22 -4.01 0.04 0.00 0.00 0.00 0.00 53.44 49.25 1x3q n ALA 8 Cb 0.67 -0.48 0.12 0.00 0.00 0.00 0.00 19.45 19.77 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 2.35 0.03 -6.59 0.00 4.39 -1.87 -3.44 114.58 109.44 1x3q h GLU 9 Ca 0.35 -0.00 -0.52 0.00 0.34 0.00 0.00 59.36 59.53 1x3q h GLU 9 Cb 1.24 -0.01 -0.21 0.00 -0.10 0.00 0.00 28.75 29.68 1x3q h GLU 9 CO 0.83 0.02 -0.78 0.28 -1.16 0.00 0.00 179.01 178.20 1x3q n VAL 10 N -5.47 -0.83 0.00 3.13 0.31 -1.20 -3.35 118.33 110.93 1x3q n VAL 10 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 1x3q n VAL 10 Cb 0.44 -1.47 0.00 0.00 -0.91 0.00 0.00 33.84 31.89 1x3q n VAL 10 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1x3q n ASP 11 N -2.54 0.00 -3.68 4.52 8.00 -1.26 -4.40 116.55 117.19 1x3q n ASP 11 Ca 0.07 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.30 1x3q n ASP 11 Cb 0.49 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.49 1x3q n ASP 11 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1x3q n GLU 12 N 0.00 2.02 -0.45 -1.24 0.00 -1.21 -4.87 120.64 114.88 1x3q n GLU 12 Ca 0.00 -4.48 0.00 0.00 0.00 0.00 0.00 57.16 52.68 1x3q n GLU 12 Cb 0.00 -2.23 0.00 0.00 0.00 0.00 0.00 31.44 29.21 1x3q n GLU 12 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 1x3q n ILE 13 N 1.55 0.00 -0.07 6.31 -5.35 -1.26 -4.63 119.36 115.91 1x3q n ILE 13 Ca 0.24 0.00 -0.09 0.00 -0.27 0.00 0.00 62.75 62.63 1x3q n ILE 13 Cb 0.38 -0.11 -0.07 0.00 -1.74 0.00 0.00 39.64 38.11 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 0.62 0.79 -4.28 7.28 0.31 -1.26 -4.85 118.33 116.95 1x3q n VAL 14 Ca 0.00 -0.34 -0.15 0.00 -0.01 0.00 0.00 64.34 63.85 1x3q n VAL 14 Cb 0.00 -0.94 -0.10 0.00 -0.91 0.00 0.00 33.84 31.89 1x3q n VAL 14 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1x3q s GLU 15 N -2.28 1.23 0.10 5.55 2.12 -1.26 -4.87 118.70 119.28 1x3q s GLU 15 Ca -0.16 -1.62 -0.14 0.00 0.36 0.00 0.00 54.97 53.41 1x3q s GLU 15 Cb 0.05 -0.33 0.05 0.00 0.26 0.00 0.00 34.13 34.15 1x3q s GLU 15 CO 0.35 -0.16 0.68 0.36 -0.54 0.00 0.00 175.26 175.94 1x3q n LYS 16 N -0.33 0.37 0.00 4.30 2.85 -1.26 -3.15 118.16 120.94 1x3q n LYS 16 Ca -0.05 -0.87 0.00 0.00 -1.05 0.00 0.00 58.31 56.34 1x3q n LYS 16 Cb 0.64 1.21 0.00 0.00 -0.65 0.00 0.00 35.03 36.23 1x3q n LYS 16 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 177.40 180.24 1x3q n ARG 17 N -0.48 0.00 0.00 -1.58 1.85 -1.24 -5.00 116.66 110.21 1x3q n ARG 17 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.84 1x3q n ARG 17 Cb 0.37 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.78 1x3q n ARG 17 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1x3q n GLY 18 N 0.00 0.00 3.69 2.89 0.00 -1.26 -4.75 105.19 105.76 1x3q n GLY 18 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 0.00 1.41 0.29 1.61 -0.14 -0.27 -4.87 119.74 117.77 1x3q s LYS 19 Ca 0.00 1.66 0.03 0.00 -1.36 0.00 0.00 55.97 56.30 1x3q s LYS 19 Cb 0.00 -1.76 0.72 0.00 -1.68 0.00 0.00 37.83 35.11 1x3q s LYS 19 CO 0.00 -2.36 1.68 0.78 -0.76 0.00 0.00 175.35 174.68 1x3q h GLY 20 N -1.29 1.46 -4.85 -3.33 0.00 -2.05 -3.00 103.07 90.01 1x3q h GLY 20 Ca -0.45 -0.12 -0.42 0.00 0.00 0.00 0.00 47.33 46.34 1x3q h GLY 20 CO 0.44 -0.31 -1.05 0.28 0.00 0.00 0.00 176.54 175.91 1x3q n LYS 21 N -5.11 1.91 0.00 4.80 5.02 -1.26 -5.02 118.16 118.49 1x3q n LYS 21 Ca 0.22 -3.65 0.00 0.00 -2.02 0.00 0.00 58.31 52.85 1x3q n LYS 21 Cb 0.66 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 34.09 1x3q n LYS 21 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1x3q n ASP 22 N -0.24 0.00 -3.92 4.39 -0.08 -1.13 -5.18 116.55 110.39 1x3q n ASP 22 Ca 0.18 0.00 -0.09 0.00 -1.51 0.00 0.00 54.79 53.37 1x3q n ASP 22 Cb 0.78 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 44.19 1x3q n ASP 22 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1x3q s VAL 23 N 0.00 0.02 -0.24 5.18 1.01 -1.26 -1.11 120.40 123.99 1x3q s VAL 23 Ca 0.00 -1.22 -0.30 0.00 0.00 0.00 0.00 61.98 60.46 1x3q s VAL 23 Cb 0.00 -1.96 0.17 0.00 0.00 0.00 0.00 36.38 34.59 1x3q s VAL 23 CO 0.00 -0.09 1.24 -1.83 0.00 0.00 0.00 175.10 174.42 1x3q s GLU 24 N -3.97 0.24 -0.15 2.72 -1.05 -1.26 -1.66 118.70 113.57 1x3q s GLU 24 Ca 0.17 0.05 -0.02 0.00 -0.15 0.00 0.00 54.97 55.02 1x3q s GLU 24 Cb -0.00 0.11 0.05 0.00 -0.44 0.00 0.00 34.13 33.85 1x3q s GLU 24 CO 0.04 -0.08 0.02 0.71 0.95 0.00 0.00 175.26 176.91 1x3q s TYR 25 N -1.12 0.90 0.00 4.83 1.51 -1.07 -3.60 117.35 118.80 1x3q s TYR 25 Ca 0.06 -0.62 0.00 0.00 -1.01 0.00 0.00 57.07 55.49 1x3q s TYR 25 Cb -0.01 -0.95 0.00 0.00 -0.11 0.00 0.00 41.96 40.89 1x3q s TYR 25 CO -0.05 -0.52 0.00 1.28 -1.11 0.00 0.00 175.55 175.15 1x3q n LEU 26 N 5.09 0.00 -2.34 -1.29 4.77 -1.19 -4.65 117.00 117.38 1x3q n LEU 26 Ca -0.08 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.73 1x3q n LEU 26 Cb 0.48 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.60 1x3q n LEU 26 CO 0.12 0.00 0.11 0.52 -1.33 0.00 0.00 177.39 176.81 1x3q n VAL 27 N 0.00 2.07 0.02 4.08 0.31 -1.26 -1.30 118.33 122.24 1x3q n VAL 27 Ca 0.00 -3.89 0.00 0.00 -0.01 0.00 0.00 64.34 60.44 1x3q n VAL 27 Cb 0.00 -0.38 0.00 0.00 -0.91 0.00 0.00 33.84 32.55 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 -0.61 0.00 0.00 5.55 -4.01 -1.26 -4.28 116.66 112.05 1x3q n ARG 28 Ca 0.31 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 57.12 1x3q n ARG 28 Cb 0.87 -0.26 0.00 0.00 -3.04 0.00 0.00 32.46 30.03 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 -2.90 0.00 -0.09 2.89 -0.00 -1.26 -3.22 117.44 112.87 1x3q n TRP 29 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.50 57.29 1x3q n TRP 29 Cb 0.22 0.00 -0.12 0.00 -0.00 0.00 0.00 31.31 31.41 1x3q n TRP 29 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 177.69 177.47 1x3q h LYS 30 N 0.00 0.03 -2.04 -2.67 1.63 -1.95 -3.43 116.57 108.14 1x3q h LYS 30 Ca 0.00 -0.05 -0.22 0.00 -0.85 0.00 0.00 60.65 59.53 1x3q h LYS 30 Cb 0.00 0.02 0.05 0.00 -0.60 0.00 0.00 32.23 31.70 1x3q h LYS 30 CO 0.00 1.02 -0.26 -0.40 -3.45 0.00 0.00 179.45 176.36 1x3q n ASP 31 N -4.36 -0.75 0.12 4.20 5.75 -1.26 -4.86 116.55 115.39 1x3q n ASP 31 Ca -0.30 0.32 0.00 0.00 -0.01 0.00 0.00 54.79 54.80 1x3q n ASP 31 Cb 0.70 -0.31 0.00 0.00 -1.03 0.00 0.00 41.12 40.48 1x3q n ASP 31 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1x3q n GLY 32 N 0.75 -1.30 0.11 6.12 0.00 -1.26 -4.92 105.19 104.69 1x3q n GLY 32 Ca 0.05 0.28 -0.15 0.00 0.00 0.00 0.00 46.02 46.19 1x3q n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x3q n GLY 33 N -1.41 -0.75 3.06 -0.02 0.00 -1.26 -4.97 105.19 99.84 1x3q n GLY 33 Ca 0.00 -0.18 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 1x3q n GLY 33 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1x3q s ASP 34 N -6.48 0.70 0.39 1.61 -1.08 -1.26 -5.15 116.67 105.39 1x3q s ASP 34 Ca -0.16 -0.65 -0.24 0.00 -0.52 0.00 0.00 52.55 50.99 1x3q s ASP 34 Cb 0.07 0.08 -0.09 0.00 -1.46 0.00 0.00 42.92 41.52 1x3q s ASP 34 CO 0.78 -0.31 1.01 0.00 0.52 0.00 0.00 175.17 177.17 1x3q n GLU 36 N -0.08 0.36 -1.70 0.00 1.02 -1.26 -5.05 120.64 113.93 1x3q n GLU 36 Ca 0.05 -0.68 -0.44 0.00 -0.02 0.00 0.00 57.16 56.07 1x3q n GLU 36 Cb 0.51 -0.57 -0.03 0.00 -0.02 0.00 0.00 31.44 31.33 1x3q n GLU 36 CO 0.00 0.00 0.00 -2.67 1.18 0.00 0.00 177.13 175.64 1x3q n TRP 37 N -0.08 2.50 -3.92 -0.32 2.14 -0.42 -4.97 117.44 112.38 1x3q n TRP 37 Ca 0.00 0.24 -0.10 0.00 2.07 0.00 0.00 57.50 59.71 1x3q n TRP 37 Cb 0.49 -2.57 -0.10 0.00 -0.81 0.00 0.00 31.31 28.32 1x3q n TRP 37 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 1x3q s VAL 38 N 0.57 0.09 0.50 -1.67 1.01 -1.26 -4.89 120.40 114.74 1x3q s VAL 38 Ca 0.72 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.95 1x3q s VAL 38 Cb -0.59 -0.35 0.00 0.00 0.00 0.00 0.00 36.38 35.44 1x3q s VAL 38 CO 0.41 -0.41 0.00 0.29 0.00 0.00 0.00 175.10 175.39 1x3q n LYS 39 N 1.58 -4.69 0.03 2.72 5.02 -1.26 -4.42 118.16 117.14 1x3q n LYS 39 Ca -0.23 3.47 0.00 0.00 -2.02 0.00 0.00 58.31 59.53 1x3q n LYS 39 Cb 0.55 -3.93 0.00 0.00 -0.02 0.00 0.00 35.03 31.63 1x3q n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1x3q n GLY 40 N -0.58 -0.03 0.39 0.72 0.00 -0.66 -2.59 105.19 102.43 1x3q n GLY 40 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.21 1x3q n GLY 40 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1x3q h VAL 41 N 0.00 0.61 0.13 1.61 3.04 -1.89 1.45 116.25 121.19 1x3q h VAL 41 Ca 0.00 -0.18 -0.24 0.00 -1.01 0.00 0.00 66.70 65.28 1x3q h VAL 41 Cb 0.39 0.05 0.03 0.00 -2.01 0.00 0.00 31.29 29.74 1x3q h VAL 41 CO 0.00 0.09 -1.00 0.45 -1.01 0.00 0.00 177.57 176.10 1x3q h HIS 42 N 0.51 0.76 -0.54 3.17 -0.00 -1.95 -3.31 115.15 113.80 1x3q h HIS 42 Ca 0.57 -0.51 -0.35 0.00 -0.00 0.00 0.00 60.37 60.08 1x3q h HIS 42 Cb 1.25 -0.05 -0.15 0.00 -0.00 0.00 0.00 27.41 28.47 1x3q h HIS 42 CO -0.00 1.37 0.42 0.28 -0.00 0.00 0.00 177.93 180.00 1x3q n VAL 43 N -3.99 2.85 -3.10 2.45 0.31 0.10 -4.84 118.33 112.12 1x3q n VAL 43 Ca -0.14 -1.81 -0.06 0.00 -0.01 0.00 0.00 64.34 62.33 1x3q n VAL 43 Cb 0.89 -1.36 0.00 0.00 -0.91 0.00 0.00 33.84 32.46 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 0.37 -2.65 0.34 3.52 0.00 0.56 -4.60 120.51 118.05 1x3q n ALA 44 Ca 0.33 0.27 -0.16 0.00 0.00 0.00 0.00 53.44 53.87 1x3q n ALA 44 Cb 0.58 -2.00 -0.08 0.00 0.00 0.00 0.00 19.45 17.95 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 0.81 -0.94 -0.91 0.00 4.81 0.16 -1.30 114.58 117.22 1x3q h GLU 45 Ca -0.08 0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 1x3q h GLU 45 Cb 1.05 0.21 -0.01 0.00 0.63 0.00 0.00 28.75 30.63 1x3q h GLU 45 CO 0.28 -0.63 0.03 -0.25 -0.73 0.00 0.00 179.01 177.71 1x3q n ASP 46 N -4.96 2.42 -0.02 1.04 9.92 -1.26 -3.36 116.55 120.32 1x3q n ASP 46 Ca -0.12 -2.28 -0.03 0.00 -0.53 0.00 0.00 54.79 51.83 1x3q n ASP 46 Cb 0.41 -0.56 -0.02 0.00 -0.64 0.00 0.00 41.12 40.31 1x3q n ASP 46 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1x3q n VAL 47 N 0.15 0.23 0.09 2.53 0.31 -1.07 -4.74 118.33 115.84 1x3q n VAL 47 Ca 0.09 -0.09 -0.14 0.00 -0.01 0.00 0.00 64.34 64.19 1x3q n VAL 47 Cb 0.56 -0.69 -0.11 0.00 -0.91 0.00 0.00 33.84 32.68 1x3q n VAL 47 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1x3q h ALA 48 N -0.01 0.20 0.24 3.52 0.00 -1.31 -3.30 119.26 118.58 1x3q h ALA 48 Ca -0.09 -0.84 -0.00 0.00 0.00 0.00 0.00 54.91 53.97 1x3q h ALA 48 Cb 1.14 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 1x3q h ALA 48 CO -0.02 0.96 -0.38 -0.22 0.00 0.00 0.00 179.25 179.59 1x3q h LYS 49 N 0.10 -0.63 -0.75 0.00 3.64 -1.78 -2.39 116.57 114.76 1x3q h LYS 49 Ca -0.11 0.04 0.14 0.00 -1.27 0.00 0.00 60.65 59.45 1x3q h LYS 49 Cb 1.85 0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 33.76 1x3q h LYS 49 CO 0.19 -0.42 0.50 -0.44 -2.27 0.00 0.00 179.45 177.00 1x3q h ASP 50 N -0.65 0.42 -0.08 4.20 3.32 -1.85 0.12 116.42 121.89 1x3q h ASP 50 Ca -0.03 0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.08 1x3q h ASP 50 Cb 0.60 -0.06 -0.06 0.00 0.22 0.00 0.00 39.33 40.03 1x3q h ASP 50 CO -0.13 0.22 -0.49 0.22 -1.72 0.00 0.00 179.24 177.35 1x3q h TYR 51 N 0.45 -1.43 0.00 4.55 5.03 -1.51 -3.38 116.97 120.67 1x3q h TYR 51 Ca 0.36 0.05 0.00 0.00 2.58 0.00 0.00 58.73 61.72 1x3q h TYR 51 Cb 0.78 0.63 0.00 0.00 1.55 0.00 0.00 36.73 39.70 1x3q h TYR 51 CO -0.00 -0.53 -0.03 0.39 -1.32 0.00 0.00 178.16 176.67 1x3q n GLU 52 N -5.45 0.02 0.00 1.82 -0.58 -0.92 -4.78 120.64 110.75 1x3q n GLU 52 Ca -0.06 0.15 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 1x3q n GLU 52 Cb 0.38 -0.68 0.00 0.00 -0.57 0.00 0.00 31.44 30.57 1x3q n GLU 52 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1x3q n ASP 53 N -2.44 0.00 0.19 1.62 2.03 0.38 0.15 116.55 118.49 1x3q n ASP 53 Ca -0.00 0.00 0.18 0.00 0.52 0.00 0.00 54.79 55.48 1x3q n ASP 53 Cb 0.01 0.00 0.82 0.00 -0.72 0.00 0.00 41.12 41.23 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 0.00 0.00 0.27 0.00 -1.81 -2.92 103.07 98.61 1x3q h GLY 54 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1x3q h GLY 54 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 176.54 178.01 1x3q n LEU 55 N -3.76 0.00 -2.83 3.11 -0.00 0.40 -4.31 117.00 109.62 1x3q n LEU 55 Ca 0.03 0.00 -0.22 0.00 -0.00 0.00 0.00 56.01 55.81 1x3q n LEU 55 Cb 0.38 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.74 1x3q n LEU 55 CO 0.27 0.00 2.30 -0.62 -0.00 0.00 0.00 177.39 179.34 1x3q n GLU 56 N 0.00 2.36 0.00 1.47 1.02 -1.26 -4.98 120.64 119.25 1x3q n GLU 56 Ca 0.00 -1.42 0.00 0.00 -0.02 0.00 0.00 57.16 55.72 1x3q n GLU 56 Cb 0.00 -2.34 0.00 0.00 -0.02 0.00 0.00 31.44 29.08 1x3q n GLU 56 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29