#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x3q s SER 2 N 0.00 -0.03 -0.30 1.61 1.04 -1.26 -5.17 113.70 109.60 1x3q s SER 2 Ca 0.00 0.04 -0.19 0.00 0.48 0.00 0.00 55.95 56.28 1x3q s SER 2 Cb 0.00 0.03 0.19 0.00 0.10 0.00 0.00 66.02 66.34 1x3q s SER 2 CO 0.00 -0.02 1.25 0.00 0.98 0.00 0.00 173.24 175.45 1x3q s GLN 3 N -0.81 0.05 0.00 4.02 -2.07 -1.26 -5.02 119.66 114.57 1x3q s GLN 3 Ca 0.09 0.12 0.00 0.00 -1.82 0.00 0.00 55.36 53.75 1x3q s GLN 3 Cb -0.02 0.07 0.00 0.00 -1.09 0.00 0.00 33.01 31.98 1x3q s GLN 3 CO -0.10 -0.03 0.00 0.28 -1.32 0.00 0.00 175.29 174.12 1x3q n VAL 4 N 4.82 0.00 0.00 3.63 0.31 -1.26 -4.86 118.33 120.97 1x3q n VAL 4 Ca -0.07 0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.53 1x3q n VAL 4 Cb 0.55 -1.16 0.00 0.00 -0.91 0.00 0.00 33.84 32.32 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 -0.02 -0.28 3.52 7.35 -1.26 -4.82 117.46 121.95 1x3q n PHE 5 Ca 0.00 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.64 1x3q n PHE 5 Cb 0.00 0.00 0.09 0.00 0.35 0.00 0.00 39.48 39.92 1x3q n PHE 5 CO 0.00 0.00 0.00 1.05 -0.76 0.00 0.00 176.76 177.05 1x3q h GLU 6 N 0.00 1.17 -4.39 -4.13 4.11 -2.05 -3.45 114.58 105.83 1x3q h GLU 6 Ca 0.00 -0.19 -0.24 0.00 0.07 0.00 0.00 59.36 59.00 1x3q h GLU 6 Cb 0.00 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.02 1x3q h GLU 6 CO 0.00 0.93 -0.32 0.98 0.07 0.00 0.00 179.01 180.67 1x3q n TYR 7 N -4.29 -1.59 -2.40 2.06 4.19 -1.26 -4.83 117.16 109.03 1x3q n TYR 7 Ca 0.07 0.11 -0.29 0.00 3.31 0.00 0.00 57.90 61.10 1x3q n TYR 7 Cb 0.17 -2.50 0.01 0.00 0.49 0.00 0.00 39.34 37.50 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 -2.56 5.26 -0.25 2.98 0.00 -1.26 -4.87 120.51 119.81 1x3q n ALA 8 Ca -0.09 -4.29 0.04 0.00 0.00 0.00 0.00 53.44 49.10 1x3q n ALA 8 Cb 0.58 -0.72 0.14 0.00 0.00 0.00 0.00 19.45 19.45 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 0.09 -6.04 0.00 4.39 -1.88 -3.44 114.58 110.32 1x3q h GLU 9 Ca 0.34 -0.01 -0.41 0.00 0.34 0.00 0.00 59.36 59.63 1x3q h GLU 9 Cb 0.82 -0.02 -0.17 0.00 -0.10 0.00 0.00 28.75 29.28 1x3q h GLU 9 CO 0.92 0.06 -0.60 1.55 -1.16 0.00 0.00 179.01 179.79 1x3q n VAL 10 N -5.36 -0.55 0.00 3.13 3.14 -1.26 -3.47 118.33 113.96 1x3q n VAL 10 Ca 0.13 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.51 1x3q n VAL 10 Cb 0.45 -1.12 0.00 0.00 -1.06 0.00 0.00 33.84 32.11 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 -2.25 0.00 -3.80 6.55 -0.08 -1.26 -4.14 116.55 111.57 1x3q n ASP 11 Ca 0.04 0.00 -0.28 0.00 -1.51 0.00 0.00 54.79 53.04 1x3q n ASP 11 Cb 0.50 0.00 -0.12 0.00 2.34 0.00 0.00 41.12 43.84 1x3q n ASP 11 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1x3q s GLU 12 N 0.00 2.13 0.00 -0.67 2.02 -1.23 -4.87 118.70 116.09 1x3q s GLU 12 Ca 0.00 -3.07 0.00 0.00 0.02 0.00 0.00 54.97 51.92 1x3q s GLU 12 Cb 0.00 -3.02 0.00 0.00 0.10 0.00 0.00 34.13 31.21 1x3q s GLU 12 CO 0.00 -1.30 0.00 0.44 0.02 0.00 0.00 175.26 174.42 1x3q n ILE 13 N 2.19 0.00 -0.11 -1.63 -0.00 -1.26 -4.65 119.36 113.90 1x3q n ILE 13 Ca 0.21 0.00 -0.17 0.00 -0.00 0.00 0.00 62.75 62.79 1x3q n ILE 13 Cb 0.37 -0.10 -0.13 0.00 -0.00 0.00 0.00 39.64 39.79 1x3q n ILE 13 CO 0.00 0.00 0.00 0.55 -0.00 0.00 0.00 176.55 177.10 1x3q n VAL 14 N 0.81 1.51 -3.10 7.28 3.14 -1.26 -4.85 118.33 121.86 1x3q n VAL 14 Ca 0.00 -0.63 0.00 0.00 -2.96 0.00 0.00 64.34 60.75 1x3q n VAL 14 Cb 0.00 -1.29 0.00 0.00 -1.06 0.00 0.00 33.84 31.49 1x3q n VAL 14 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 1x3q n GLU 15 N -3.20 3.33 0.00 1.45 2.13 -1.26 -4.84 120.64 118.25 1x3q n GLU 15 Ca -0.41 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.41 1x3q n GLU 15 Cb 1.03 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.74 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 -0.04 0.00 0.00 5.31 -0.00 -1.26 -4.31 118.16 117.86 1x3q n LYS 16 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1x3q n LYS 16 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 1x3q n LYS 16 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 1x3q n ARG 17 N -0.31 0.00 -3.63 -1.58 1.85 -1.23 -5.00 116.66 106.76 1x3q n ARG 17 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 57.85 56.81 1x3q n ARG 17 Cb 0.00 0.00 -0.05 0.00 -1.05 0.00 0.00 32.46 31.36 1x3q n ARG 17 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1x3q s GLY 18 N 0.00 0.03 0.00 2.89 0.00 -1.25 -4.01 107.32 104.97 1x3q s GLY 18 Ca 0.00 2.71 0.00 0.00 0.00 0.00 0.00 44.72 47.43 1x3q s GLY 18 CO 0.00 1.18 0.00 0.28 0.00 0.00 0.00 173.10 174.56 1x3q n LYS 19 N 0.69 -0.23 0.17 2.90 4.76 0.24 -4.75 118.16 121.94 1x3q n LYS 19 Ca -0.03 0.00 0.03 0.00 -2.87 0.00 0.00 58.31 55.43 1x3q n LYS 19 Cb 0.58 0.00 0.38 0.00 -1.84 0.00 0.00 35.03 34.16 1x3q n LYS 19 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 1x3q h GLY 20 N -0.31 0.09 -4.30 0.72 0.00 -2.04 -3.22 103.07 94.02 1x3q h GLY 20 Ca 0.00 -0.07 -0.52 0.00 0.00 0.00 0.00 47.33 46.74 1x3q h GLY 20 CO 0.00 0.06 -0.84 0.28 0.00 0.00 0.00 176.54 176.04 1x3q n LYS 21 N -4.18 3.17 0.00 4.80 5.02 -1.26 -4.96 118.16 120.75 1x3q n LYS 21 Ca -0.02 -4.16 0.00 0.00 -2.02 0.00 0.00 58.31 52.11 1x3q n LYS 21 Cb 0.35 -2.12 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 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 -0.56 0.00 -3.64 4.39 2.03 -1.21 -5.19 116.55 112.37 1x3q n ASP 22 Ca 0.36 0.00 -0.09 0.00 0.52 0.00 0.00 54.79 55.58 1x3q n ASP 22 Cb 0.83 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 41.21 1x3q n ASP 22 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1x3q s VAL 23 N 0.00 0.00 -0.12 5.18 1.01 -1.26 0.82 120.40 126.03 1x3q s VAL 23 Ca 0.00 -0.46 -0.30 0.00 0.00 0.00 0.00 61.98 61.22 1x3q s VAL 23 Cb 0.00 -1.49 0.11 0.00 0.00 0.00 0.00 36.38 35.00 1x3q s VAL 23 CO 0.00 0.00 0.90 -1.83 0.00 0.00 0.00 175.10 174.17 1x3q s GLU 24 N -3.71 0.73 -0.04 2.72 -1.05 -1.26 0.24 118.70 116.33 1x3q s GLU 24 Ca 0.06 0.16 0.00 0.00 -0.15 0.00 0.00 54.97 55.04 1x3q s GLU 24 Cb -0.03 0.34 0.02 0.00 -0.44 0.00 0.00 34.13 34.03 1x3q s GLU 24 CO -0.03 -0.23 -0.02 0.71 0.95 0.00 0.00 175.26 176.64 1x3q s TYR 25 N -1.22 0.53 0.00 4.83 1.51 -0.94 -3.55 117.35 118.51 1x3q s TYR 25 Ca -0.04 -0.10 0.00 0.00 -1.01 0.00 0.00 57.07 55.92 1x3q s TYR 25 Cb -0.00 -0.57 0.00 0.00 -0.11 0.00 0.00 41.96 41.28 1x3q s TYR 25 CO 0.03 -0.18 0.00 1.28 -1.11 0.00 0.00 175.55 175.57 1x3q n LEU 26 N 4.26 0.00 -1.63 -1.29 7.99 -1.26 -4.18 117.00 120.89 1x3q n LEU 26 Ca -0.23 0.00 0.04 0.00 -0.01 0.00 0.00 56.01 55.81 1x3q n LEU 26 Cb 0.50 0.00 0.02 0.00 -0.11 0.00 0.00 43.42 43.84 1x3q n LEU 26 CO 0.21 0.00 0.05 0.52 -1.51 0.00 0.00 177.39 176.66 1x3q n VAL 27 N 0.00 0.13 0.00 4.08 0.31 -1.26 -2.03 118.33 119.55 1x3q n VAL 27 Ca 0.00 -1.19 0.00 0.00 -0.01 0.00 0.00 64.34 63.14 1x3q n VAL 27 Cb 0.00 1.03 0.00 0.00 -0.91 0.00 0.00 33.84 33.96 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 0.39 0.00 -0.03 5.55 -4.01 -1.26 -4.41 116.66 112.89 1x3q n ARG 28 Ca 0.06 0.00 -0.01 0.00 -1.04 0.00 0.00 57.85 56.86 1x3q n ARG 28 Cb 1.11 0.00 -0.01 0.00 -3.04 0.00 0.00 32.46 30.53 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 -0.93 -0.03 -0.11 2.89 -0.00 -1.26 -3.46 117.44 114.54 1x3q n TRP 29 Ca 0.00 0.10 -0.22 0.00 -0.00 0.00 0.00 57.50 57.37 1x3q n TRP 29 Cb 0.00 -0.25 -0.08 0.00 -0.00 0.00 0.00 31.31 30.98 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 -2.88 0.49 -1.49 -2.67 5.02 -1.26 -4.78 118.16 110.58 1x3q n LYS 30 Ca 0.00 0.19 -0.59 0.00 -2.02 0.00 0.00 58.31 55.90 1x3q n LYS 30 Cb 0.02 -1.32 -0.08 0.00 -0.02 0.00 0.00 35.03 33.63 1x3q n LYS 30 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1x3q n ASP 31 N -3.84 0.10 0.03 4.39 -0.08 -1.22 -4.61 116.55 111.31 1x3q n ASP 31 Ca -0.43 1.14 0.00 0.00 -1.51 0.00 0.00 54.79 53.99 1x3q n ASP 31 Cb 0.83 -0.90 0.00 0.00 2.34 0.00 0.00 41.12 43.39 1x3q n ASP 31 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1x3q n GLY 32 N 1.70 -0.71 0.14 0.27 0.00 -1.26 -4.67 105.19 100.65 1x3q n GLY 32 Ca 0.21 0.20 -0.21 0.00 0.00 0.00 0.00 46.02 46.22 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 -1.18 -0.51 3.24 -0.02 0.00 -1.26 -4.99 105.19 100.47 1x3q n GLY 33 Ca 0.00 -0.25 -0.14 0.00 0.00 0.00 0.00 46.02 45.63 1x3q n GLY 33 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x3q s ASP 34 N -6.91 1.65 0.20 1.61 1.11 -1.26 -5.15 116.67 107.92 1x3q s ASP 34 Ca -0.26 -1.03 -0.22 0.00 0.18 0.00 0.00 52.55 51.22 1x3q s ASP 34 Cb 0.07 0.02 -0.08 0.00 1.07 0.00 0.00 42.92 44.00 1x3q s ASP 34 CO 0.73 -0.38 0.76 0.00 1.18 0.00 0.00 175.17 177.45 1x3q n GLU 36 N 1.11 0.00 -2.19 0.00 1.02 -1.26 -5.03 120.64 114.28 1x3q n GLU 36 Ca -0.04 -1.12 -0.42 0.00 -0.02 0.00 0.00 57.16 55.56 1x3q n GLU 36 Cb 0.50 -0.18 -0.03 0.00 -0.02 0.00 0.00 31.44 31.72 1x3q n GLU 36 CO 0.00 0.00 0.00 1.67 1.18 0.00 0.00 177.13 179.98 1x3q s TRP 37 N 0.00 2.69 0.41 -0.32 -2.14 -0.86 -4.90 118.94 113.81 1x3q s TRP 37 Ca 0.10 0.71 -0.01 0.00 2.66 0.00 0.00 56.10 59.55 1x3q s TRP 37 Cb 0.11 -3.71 -0.02 0.00 -3.10 0.00 0.00 33.47 26.75 1x3q s TRP 37 CO -0.05 -2.69 0.64 0.08 -2.66 0.00 0.00 176.95 172.27 1x3q s VAL 38 N 2.77 4.71 0.17 -0.66 1.01 -1.26 -4.85 120.40 122.29 1x3q s VAL 38 Ca 0.65 -0.34 -0.11 0.00 0.00 0.00 0.00 61.98 62.19 1x3q s VAL 38 Cb -0.31 -3.74 -0.08 0.00 0.00 0.00 0.00 36.38 32.25 1x3q s VAL 38 CO 0.26 -0.55 0.08 0.29 0.00 0.00 0.00 175.10 175.18 1x3q n LYS 39 N -1.98 0.00 -0.10 2.72 4.76 -1.26 -2.21 118.16 120.09 1x3q n LYS 39 Ca -0.02 0.00 -0.19 0.00 -2.87 0.00 0.00 58.31 55.23 1x3q n LYS 39 Cb 0.56 -0.47 -0.11 0.00 -1.84 0.00 0.00 35.03 33.17 1x3q n LYS 39 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 1x3q h GLY 40 N 0.21 0.00 -0.80 0.72 0.00 -0.51 -2.50 103.07 100.18 1x3q h GLY 40 Ca -0.17 0.00 0.38 0.00 0.00 0.00 0.00 47.33 47.54 1x3q h GLY 40 CO 0.23 0.00 0.73 -2.08 0.00 0.00 0.00 176.54 175.42 1x3q h VAL 41 N -1.00 0.22 0.21 4.60 2.07 -1.90 1.49 116.25 121.94 1x3q h VAL 41 Ca -0.27 -0.06 -0.34 0.00 0.82 0.00 0.00 66.70 66.85 1x3q h VAL 41 Cb 1.18 0.02 0.02 0.00 -1.52 0.00 0.00 31.29 30.99 1x3q h VAL 41 CO -0.16 0.03 -1.61 0.45 0.02 0.00 0.00 177.57 176.30 1x3q h HIS 42 N 0.18 0.81 -1.08 1.57 3.86 -1.94 -3.35 115.15 115.21 1x3q h HIS 42 Ca 0.77 -0.59 -0.53 0.00 -1.16 0.00 0.00 60.37 58.86 1x3q h HIS 42 Cb 2.16 -0.03 -0.20 0.00 1.06 0.00 0.00 27.41 30.40 1x3q h HIS 42 CO -0.01 1.60 0.57 0.28 0.86 0.00 0.00 177.93 181.23 1x3q n VAL 43 N -3.63 3.28 -3.41 2.45 0.31 0.44 -4.84 118.33 112.92 1x3q n VAL 43 Ca -0.20 -2.90 -0.15 0.00 -0.01 0.00 0.00 64.34 61.07 1x3q n VAL 43 Cb 1.09 -1.43 0.02 0.00 -0.91 0.00 0.00 33.84 32.61 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 0.31 -2.59 0.06 3.52 0.00 0.63 -4.64 120.51 117.79 1x3q n ALA 44 Ca 0.47 -0.12 -0.14 0.00 0.00 0.00 0.00 53.44 53.66 1x3q n ALA 44 Cb 0.52 -2.29 -0.07 0.00 0.00 0.00 0.00 19.45 17.60 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 -0.42 -0.56 -0.93 0.00 4.81 0.41 -1.11 114.58 116.77 1x3q h GLU 45 Ca -0.37 0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 58.84 1x3q h GLU 45 Cb 1.22 0.13 -0.03 0.00 0.63 0.00 0.00 28.75 30.69 1x3q h GLU 45 CO 0.37 -0.37 0.07 -0.25 -0.73 0.00 0.00 179.01 178.10 1x3q n ASP 46 N -5.45 2.63 -0.01 1.04 8.00 -1.26 -3.62 116.55 117.88 1x3q n ASP 46 Ca -0.06 -2.32 -0.01 0.00 0.71 0.00 0.00 54.79 53.11 1x3q n ASP 46 Cb 0.37 -0.57 -0.01 0.00 -0.02 0.00 0.00 41.12 40.90 1x3q n ASP 46 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1x3q n VAL 47 N 0.13 0.09 0.10 2.53 0.31 -0.50 -4.77 118.33 116.21 1x3q n VAL 47 Ca 0.11 -0.03 -0.14 0.00 -0.01 0.00 0.00 64.34 64.26 1x3q n VAL 47 Cb 0.63 -0.70 -0.12 0.00 -0.91 0.00 0.00 33.84 32.73 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 0.16 -0.18 3.52 0.00 -1.45 -3.30 119.26 118.00 1x3q h ALA 48 Ca -0.03 -0.87 0.05 0.00 0.00 0.00 0.00 54.91 54.06 1x3q h ALA 48 Cb 1.05 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.76 1x3q h ALA 48 CO -0.01 0.99 -0.29 -0.22 0.00 0.00 0.00 179.25 179.72 1x3q h LYS 49 N 0.08 -0.32 0.00 0.00 1.63 -1.80 -1.10 116.57 115.05 1x3q h LYS 49 Ca -0.11 0.02 -0.04 0.00 -0.85 0.00 0.00 60.65 59.67 1x3q h LYS 49 Cb 1.90 0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 33.59 1x3q h LYS 49 CO 0.19 -0.21 -0.20 -0.44 -3.45 0.00 0.00 179.45 175.33 1x3q h ASP 50 N -0.33 0.00 0.59 4.20 5.19 -1.86 -0.35 116.42 123.86 1x3q h ASP 50 Ca 0.11 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.50 1x3q h ASP 50 Cb 0.51 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.01 1x3q h ASP 50 CO -0.37 0.20 -0.42 0.22 -3.12 0.00 0.00 179.24 175.76 1x3q h TYR 51 N 0.00 -1.12 0.02 4.55 5.03 -1.28 -3.26 116.97 120.92 1x3q h TYR 51 Ca -0.00 -0.01 -0.34 0.00 2.58 0.00 0.00 58.73 60.96 1x3q h TYR 51 Cb 0.41 0.41 -0.05 0.00 1.55 0.00 0.00 36.73 39.05 1x3q h TYR 51 CO 0.00 -0.61 -1.88 -1.91 -1.32 0.00 0.00 178.16 172.44 1x3q n GLU 52 N -5.54 0.61 -0.56 1.82 4.07 -1.06 -3.78 120.64 116.21 1x3q n GLU 52 Ca -0.13 0.39 0.45 0.00 -0.06 0.00 0.00 57.16 57.82 1x3q n GLU 52 Cb 0.43 -1.65 0.76 0.00 -0.06 0.00 0.00 31.44 30.93 1x3q n GLU 52 CO 0.00 0.00 0.00 0.38 -0.06 0.00 0.00 177.13 177.45 1x3q h ASP 53 N -0.72 0.06 0.60 4.31 3.04 -1.23 1.52 116.42 124.00 1x3q h ASP 53 Ca -0.49 0.03 -0.28 0.00 -3.24 0.00 0.00 57.03 53.05 1x3q h ASP 53 Cb 1.58 0.03 -0.00 0.00 -1.04 0.00 0.00 39.33 39.90 1x3q h ASP 53 CO -0.21 -0.04 -1.33 1.23 -2.04 0.00 0.00 179.24 176.85 1x3q h GLY 54 N 0.03 0.27 0.00 7.15 0.00 -1.73 -3.12 103.07 105.67 1x3q h GLY 54 Ca 0.82 -0.69 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1x3q h GLY 54 CO -0.11 0.60 0.00 1.04 0.00 0.00 0.00 176.54 178.07 1x3q n LEU 55 N -3.48 1.49 -2.34 3.11 4.77 0.51 -3.99 117.00 117.07 1x3q n LEU 55 Ca -0.11 0.27 -0.20 0.00 -0.03 0.00 0.00 56.01 55.94 1x3q n LEU 55 Cb 1.02 -0.04 -0.12 0.00 -2.33 0.00 0.00 43.42 41.96 1x3q n LEU 55 CO 0.52 -0.04 1.82 1.21 -1.33 0.00 0.00 177.39 179.57 1x3q n GLU 56 N -0.62 2.41 0.00 3.23 2.13 -0.65 -4.69 120.64 122.45 1x3q n GLU 56 Ca 0.00 -1.63 0.00 0.00 0.66 0.00 0.00 57.16 56.19 1x3q n GLU 56 Cb 0.00 -2.15 0.00 0.00 0.27 0.00 0.00 31.44 29.56 1x3q n GLU 56 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70