#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qa4 n GLY 3 N 0.00 0.24 3.49 -0.02 0.00 -1.26 -5.01 105.19 102.63 1qa4 n GLY 3 Ca 0.00 -1.42 -0.21 0.00 0.00 0.00 0.00 46.02 44.39 1qa4 n GLY 3 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1qa4 n LYS 4 N 2.45 -3.09 -3.62 1.61 3.00 -1.26 -5.02 118.16 112.23 1qa4 n LYS 4 Ca 0.00 0.70 -0.24 0.00 -0.00 0.00 0.00 58.31 58.77 1qa4 n LYS 4 Cb 0.00 -5.23 0.01 0.00 0.00 0.00 0.00 35.03 29.81 1qa4 n LYS 4 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 1qa4 s TRP 5 N -3.47 1.70 -0.82 5.64 0.51 -1.26 -4.79 118.94 116.44 1qa4 s TRP 5 Ca 0.31 -0.77 -0.02 0.00 -2.12 0.00 0.00 56.10 53.49 1qa4 s TRP 5 Cb -0.07 -2.02 -0.03 0.00 -0.81 0.00 0.00 33.47 30.54 1qa4 s TRP 5 CO 0.79 -0.61 0.70 0.45 -0.51 0.00 0.00 176.95 177.77 1qa4 n SER 6 N -1.87 -3.80 -3.65 2.95 2.88 -1.26 -5.05 113.62 103.82 1qa4 n SER 6 Ca 0.04 -0.49 -0.10 0.00 -1.33 0.00 0.00 58.87 56.98 1qa4 n SER 6 Cb 0.63 -3.93 -0.08 0.00 -0.75 0.00 0.00 64.21 60.09 1qa4 n SER 6 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 1qa4 s LYS 7 N -4.49 0.71 0.01 -1.46 0.00 -1.26 -5.18 119.74 108.07 1qa4 s LYS 7 Ca 0.18 1.05 -0.10 0.00 0.00 0.00 0.00 55.97 57.09 1qa4 s LYS 7 Cb -0.02 0.23 0.01 0.00 0.00 0.00 0.00 37.83 38.05 1qa4 s LYS 7 CO 0.54 -0.13 0.21 0.45 0.00 0.00 0.00 175.35 176.42 1qa4 s SER 8 N 1.04 -0.04 -0.26 0.03 0.15 -1.26 -5.14 113.70 108.22 1qa4 s SER 8 Ca -0.05 -0.15 -0.20 0.00 0.70 0.00 0.00 55.95 56.24 1qa4 s SER 8 Cb -0.05 0.26 -0.02 0.00 -1.71 0.00 0.00 66.02 64.50 1qa4 s SER 8 CO -0.10 -0.44 0.60 -0.94 1.20 0.00 0.00 173.24 173.55 1qa4 s SER 9 N -1.54 6.53 0.12 5.45 1.04 -1.26 -5.06 113.70 118.97 1qa4 s SER 9 Ca -0.12 0.64 -0.02 0.00 0.48 0.00 0.00 55.95 56.92 1qa4 s SER 9 Cb -0.05 -2.32 -0.05 0.00 0.10 0.00 0.00 66.02 63.70 1qa4 s SER 9 CO 0.01 -0.35 0.31 0.54 0.98 0.00 0.00 173.24 174.73 1qa4 s VAL 10 N 2.45 5.26 0.24 5.02 0.11 -1.26 -4.98 120.40 127.24 1qa4 s VAL 10 Ca 0.25 -0.20 0.00 0.00 -2.93 0.00 0.00 61.98 59.10 1qa4 s VAL 10 Cb -0.15 -3.64 0.00 0.00 -1.53 0.00 0.00 36.38 31.05 1qa4 s VAL 10 CO 0.09 0.05 0.00 0.55 -3.33 0.00 0.00 175.10 172.46 1qa4 n VAL 11 N 0.05 -0.52 -4.24 2.04 3.14 -1.26 -5.08 118.33 112.47 1qa4 n VAL 11 Ca -0.04 0.41 -0.15 0.00 -2.96 0.00 0.00 64.34 61.60 1qa4 n VAL 11 Cb 0.52 -0.63 -0.09 0.00 -1.06 0.00 0.00 33.84 32.57 1qa4 n VAL 11 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1qa4 s GLY 12 N -5.00 1.85 0.02 7.55 0.00 -1.26 -5.18 107.32 105.29 1qa4 s GLY 12 Ca 0.00 -1.87 -0.22 0.00 0.00 0.00 0.00 44.72 42.63 1qa4 s GLY 12 CO 0.00 -1.44 0.49 0.66 0.00 0.00 0.00 173.10 172.82 1qa4 s TRP 13 N -3.83 -0.39 0.89 1.90 -2.14 -1.26 -5.18 118.94 108.93 1qa4 s TRP 13 Ca 0.40 0.52 -0.12 0.00 2.66 0.00 0.00 56.10 59.55 1qa4 s TRP 13 Cb 0.05 0.29 0.12 0.00 -3.10 0.00 0.00 33.47 30.83 1qa4 s TRP 13 CO 0.19 -0.58 1.10 -1.25 -2.66 0.00 0.00 176.95 173.76 1qa4 s PRO 14 N -2.00 1.33 -0.77 3.25 0.04 -1.26 -4.99 135.00 130.61 1qa4 s PRO 14 Ca -0.08 0.59 -0.00 0.00 0.04 0.00 0.00 61.00 61.55 1qa4 s PRO 14 Cb -0.01 -1.84 0.36 0.00 0.04 0.00 0.00 34.50 33.05 1qa4 s PRO 14 CO 0.02 -2.13 1.76 0.00 0.04 0.00 0.00 177.00 176.68 1qa4 n ALA 15 N -3.78 6.08 0.00 8.56 0.00 -1.26 -4.95 120.51 125.16 1qa4 n ALA 15 Ca 0.07 -4.24 0.00 0.00 0.00 0.00 0.00 53.44 49.26 1qa4 n ALA 15 Cb 0.57 -1.64 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1qa4 n ALA 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1qa4 n VAL 16 N -0.46 0.00 0.00 0.00 0.31 -1.26 -4.76 118.33 112.16 1qa4 n VAL 16 Ca 0.49 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.82 1qa4 n VAL 16 Cb 0.34 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.27 1qa4 n VAL 16 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1qa4 n ARG 17 N 0.00 0.00 -0.31 5.55 0.00 -1.26 -4.77 116.66 115.87 1qa4 n ARG 17 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.85 57.82 1qa4 n ARG 17 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 32.46 32.48 1qa4 n ARG 17 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1qa4 h GLU 18 N 0.00 -0.07 -3.73 -0.14 3.07 -2.04 -2.55 114.58 109.12 1qa4 h GLU 18 Ca 0.00 0.00 -0.72 0.00 -0.50 0.00 0.00 59.36 58.15 1qa4 h GLU 18 Cb 0.00 0.02 -0.07 0.00 -0.84 0.00 0.00 28.75 27.86 1qa4 h GLU 18 CO 0.00 -0.05 2.89 -2.13 -1.40 0.00 0.00 179.01 178.32 1qa4 n ARG 19 N -5.45 3.19 -0.09 2.33 3.00 -1.26 -4.43 116.66 113.94 1qa4 n ARG 19 Ca 0.07 -2.83 -0.12 0.00 -0.00 0.00 0.00 57.85 54.97 1qa4 n ARG 19 Cb 0.38 -3.13 -0.10 0.00 0.00 0.00 0.00 32.46 29.61 1qa4 n ARG 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1qa4 n MET 20 N 5.15 0.74 -2.38 -0.14 0.00 -0.96 -4.92 117.12 114.60 1qa4 n MET 20 Ca 0.52 0.08 -0.43 0.00 0.00 0.00 0.00 57.70 57.87 1qa4 n MET 20 Cb 0.36 -1.39 -0.02 0.00 0.00 0.00 0.00 33.22 32.17 1qa4 n MET 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 175.97 176.47 1qa4 s ARG 21 N -2.38 3.79 -0.04 3.17 3.00 -1.26 -4.91 118.95 120.32 1qa4 s ARG 21 Ca -0.21 1.16 -0.24 0.00 -1.00 0.00 0.00 55.73 55.43 1qa4 s ARG 21 Cb 0.06 -3.94 -0.22 0.00 0.00 0.00 0.00 34.95 30.86 1qa4 s ARG 21 CO 0.49 -1.28 1.09 -0.09 0.00 0.00 0.00 175.30 175.51 1qa4 h ARG 22 N 9.83 0.16 -6.37 5.12 2.43 -1.99 -3.44 114.38 120.12 1qa4 h ARG 22 Ca -0.27 -0.15 -0.53 0.00 -0.81 0.00 0.00 59.98 58.22 1qa4 h ARG 22 Cb 1.10 0.03 0.02 0.00 -0.42 0.00 0.00 29.97 30.70 1qa4 h ARG 22 CO 1.05 0.84 1.14 0.00 -1.51 0.00 0.00 179.97 181.49 1qa4 s ALA 23 N -3.40 3.63 -0.05 2.80 0.00 -1.26 -5.00 121.76 118.49 1qa4 s ALA 23 Ca -0.16 1.23 0.03 0.00 0.00 0.00 0.00 51.96 53.06 1qa4 s ALA 23 Cb 0.01 -3.79 0.01 0.00 0.00 0.00 0.00 23.12 19.35 1qa4 s ALA 23 CO 0.73 -1.41 -0.13 -2.00 0.00 0.00 0.00 175.76 172.95 1qa4 s GLU 24 N 3.83 1.65 -1.05 0.00 -6.30 -1.26 -5.06 118.70 110.51 1qa4 s GLU 24 Ca 0.81 -0.46 -0.17 0.00 -2.50 0.00 0.00 54.97 52.66 1qa4 s GLU 24 Cb -0.40 -1.39 -0.08 0.00 0.00 0.00 0.00 34.13 32.26 1qa4 s GLU 24 CO 0.36 0.10 2.11 -0.35 0.02 0.00 0.00 175.26 177.51 1qa4 n PRO 25 N 3.55 2.13 -4.43 4.30 -0.04 -1.26 -4.86 135.00 134.39 1qa4 n PRO 25 Ca -0.21 -2.04 -0.22 0.00 -0.04 0.00 0.00 63.50 60.99 1qa4 n PRO 25 Cb 0.52 -2.95 -0.16 0.00 -0.04 0.00 0.00 33.50 30.87 1qa4 n PRO 25 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1qa4 s ALA 26 N 4.05 1.01 -0.28 0.55 0.00 -1.26 -5.12 121.76 120.71 1qa4 s ALA 26 Ca 0.53 -0.29 0.03 0.00 0.00 0.00 0.00 51.96 52.23 1qa4 s ALA 26 Cb 0.14 -0.47 0.07 0.00 0.00 0.00 0.00 23.12 22.86 1qa4 s ALA 26 CO 0.02 0.09 -0.07 0.00 0.00 0.00 0.00 175.76 175.80 1qa4 s ALA 27 N 0.63 2.64 0.21 0.00 0.00 -1.26 -5.06 121.76 118.91 1qa4 s ALA 27 Ca -0.11 -1.95 0.00 0.00 0.00 0.00 0.00 51.96 49.90 1qa4 s ALA 27 Cb -0.14 -1.68 0.00 0.00 0.00 0.00 0.00 23.12 21.30 1qa4 s ALA 27 CO 0.02 -1.32 0.00 -3.47 0.00 0.00 0.00 175.76 170.99 1qa4 n ASP 28 N 4.39 -6.28 0.00 0.00 -0.08 -1.26 -5.06 116.55 108.27 1qa4 n ASP 28 Ca -0.10 0.97 0.00 0.00 -1.51 0.00 0.00 54.79 54.16 1qa4 n ASP 28 Cb 0.42 -2.73 0.00 0.00 2.34 0.00 0.00 41.12 41.15 1qa4 n ASP 28 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1qa4 n GLY 29 N -2.83 -1.26 3.25 0.27 0.00 -1.26 -5.15 105.19 98.21 1qa4 n GLY 29 Ca 0.01 0.48 -0.09 0.00 0.00 0.00 0.00 46.02 46.42 1qa4 n GLY 29 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1qa4 s VAL 30 N 0.00 0.11 -0.36 1.61 -7.23 -1.26 -5.11 120.40 108.16 1qa4 s VAL 30 Ca 0.00 -1.46 -0.28 0.00 -1.81 0.00 0.00 61.98 58.43 1qa4 s VAL 30 Cb 0.00 -1.72 -0.03 0.00 0.56 0.00 0.00 36.38 35.20 1qa4 s VAL 30 CO 0.00 -0.48 1.89 -0.83 -0.31 0.00 0.00 175.10 175.37 1qa4 s GLY 31 N -2.95 0.61 -1.20 2.32 0.00 -1.26 -4.89 107.32 99.95 1qa4 s GLY 31 Ca 0.14 0.19 -0.19 0.00 0.00 0.00 0.00 44.72 44.86 1qa4 s GLY 31 CO -0.04 3.40 1.95 0.00 0.00 0.00 0.00 173.10 178.41 1qa4 n ALA 32 N 11.11 3.61 -0.02 3.20 0.00 -1.26 -4.67 120.51 132.47 1qa4 n ALA 32 Ca 0.24 -3.55 -0.01 0.00 0.00 0.00 0.00 53.44 50.12 1qa4 n ALA 32 Cb 0.48 -3.57 -0.00 0.00 0.00 0.00 0.00 19.45 16.36 1qa4 n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qa4 h ALA 33 N 7.73 0.00 -1.18 0.00 0.00 -2.04 -3.43 119.26 120.34 1qa4 h ALA 33 Ca 0.42 -0.21 -0.51 0.00 0.00 0.00 0.00 54.91 54.61 1qa4 h ALA 33 Cb 0.78 0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.61 1qa4 h ALA 33 CO 1.62 0.11 1.21 -1.54 0.00 0.00 0.00 179.25 180.65 1qa4 s SER 34 N -4.19 5.98 0.00 0.00 1.04 -1.26 -4.89 113.70 110.37 1qa4 s SER 34 Ca -0.03 -0.73 0.00 0.00 0.48 0.00 0.00 55.95 55.66 1qa4 s SER 34 Cb 0.00 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.57 1qa4 s SER 34 CO 0.05 -1.96 0.00 0.54 0.98 0.00 0.00 173.24 172.85 1qa4 n ARG 35 N 9.08 0.00 0.00 4.02 1.74 -1.26 -3.89 116.66 126.36 1qa4 n ARG 35 Ca 0.23 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.31 1qa4 n ARG 35 Cb 0.50 -0.33 0.00 0.00 -1.02 0.00 0.00 32.46 31.61 1qa4 n ARG 35 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1qa4 n ASP 36 N -0.48 0.00 0.13 0.55 8.00 -1.26 -4.30 116.55 119.19 1qa4 n ASP 36 Ca 0.00 0.09 -0.11 0.00 0.71 0.00 0.00 54.79 55.48 1qa4 n ASP 36 Cb 0.00 -0.38 -0.07 0.00 -0.02 0.00 0.00 41.12 40.66 1qa4 n ASP 36 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1qa4 h LEU 37 N 0.00 -0.34 -1.15 0.64 5.85 -1.99 -3.17 115.31 115.16 1qa4 h LEU 37 Ca 0.00 -0.19 0.25 0.00 0.84 0.00 0.00 57.88 58.79 1qa4 h LEU 37 Cb 0.00 0.09 -0.11 0.00 0.37 0.00 0.00 40.66 41.00 1qa4 h LEU 37 CO 0.00 0.13 0.63 -0.08 -0.34 0.00 0.00 178.44 178.78 1qa4 h GLU 38 N -0.94 0.49 0.50 1.25 4.81 -1.89 0.75 114.58 119.56 1qa4 h GLU 38 Ca -0.04 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 1qa4 h GLU 38 Cb 0.50 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 1qa4 h GLU 38 CO 0.07 0.33 -0.34 -0.22 -0.73 0.00 0.00 179.01 178.12 1qa4 h LYS 39 N 0.51 -0.78 -0.06 1.92 3.11 -1.67 -0.14 116.57 119.47 1qa4 h LYS 39 Ca 0.63 0.05 -0.24 0.00 -2.81 0.00 0.00 60.65 58.28 1qa4 h LYS 39 Cb 1.35 0.18 0.01 0.00 -1.00 0.00 0.00 32.23 32.76 1qa4 h LYS 39 CO -0.40 -0.52 -0.91 0.45 -2.81 0.00 0.00 179.45 175.26 1qa4 h HIS 40 N -0.81 0.93 -0.40 1.91 3.86 -1.27 -3.32 115.15 116.06 1qa4 h HIS 40 Ca -0.06 -0.47 0.01 0.00 -1.16 0.00 0.00 60.37 58.70 1qa4 h HIS 40 Cb 0.67 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 29.00 1qa4 h HIS 40 CO -0.12 1.29 0.25 0.78 0.86 0.00 0.00 177.93 181.00 1qa4 h GLY 41 N 0.69 0.56 -4.27 2.45 0.00 0.51 -3.03 103.07 99.97 1qa4 h GLY 41 Ca -0.09 -0.20 -0.32 0.00 0.00 0.00 0.00 47.33 46.72 1qa4 h GLY 41 CO 0.18 0.19 0.28 0.00 0.00 0.00 0.00 176.54 177.18 1qa4 n ALA 42 N -2.22 6.53 -3.91 3.60 0.00 -0.07 -4.78 120.51 119.65 1qa4 n ALA 42 Ca 0.01 -2.34 -0.30 0.00 0.00 0.00 0.00 53.44 50.81 1qa4 n ALA 42 Cb 0.04 -2.40 -0.15 0.00 0.00 0.00 0.00 19.45 16.94 1qa4 n ALA 42 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1qa4 s ILE 43 N 0.32 1.57 -0.98 0.00 -1.09 -1.15 -4.98 121.20 114.89 1qa4 s ILE 43 Ca 0.65 -1.55 -0.08 0.00 -2.23 0.00 0.00 60.65 57.44 1qa4 s ILE 43 Cb 0.32 -1.99 0.25 0.00 -1.58 0.00 0.00 42.46 39.45 1qa4 s ILE 43 CO -0.06 -0.36 0.94 -0.89 -1.23 0.00 0.00 174.94 173.34 1qa4 s THR 44 N 1.32 5.44 -0.26 2.92 2.01 -1.26 -4.98 115.64 120.83 1qa4 s THR 44 Ca 0.02 -3.32 -0.01 0.00 0.31 0.00 0.00 61.69 58.69 1qa4 s THR 44 Cb -0.19 -4.31 0.08 0.00 0.01 0.00 0.00 72.50 68.09 1qa4 s THR 44 CO -0.11 -1.12 0.05 -0.55 -0.69 0.00 0.00 174.62 172.20 1qa4 s SER 45 N 1.12 3.67 0.05 3.53 0.15 -1.26 -5.12 113.70 115.84 1qa4 s SER 45 Ca 0.27 -1.31 0.04 0.00 0.70 0.00 0.00 55.95 55.65 1qa4 s SER 45 Cb -0.10 -0.87 -0.02 0.00 -1.71 0.00 0.00 66.02 63.31 1qa4 s SER 45 CO -0.09 -0.34 -0.12 -0.44 1.20 0.00 0.00 173.24 173.45 1qa4 s SER 46 N 1.62 1.36 -0.16 5.45 0.01 -1.26 -5.15 113.70 115.58 1qa4 s SER 46 Ca 0.03 -0.53 -0.07 0.00 1.31 0.00 0.00 55.95 56.69 1qa4 s SER 46 Cb -0.18 -0.04 -0.04 0.00 0.21 0.00 0.00 66.02 65.98 1qa4 s SER 46 CO -0.15 -0.08 0.07 0.21 0.41 0.00 0.00 173.24 173.69 1qa4 s ASN 47 N -1.47 5.72 -0.50 2.44 2.47 -1.26 -5.07 114.94 117.27 1qa4 s ASN 47 Ca -0.03 0.16 -0.08 0.00 0.42 0.00 0.00 52.86 53.32 1qa4 s ASN 47 Cb -0.09 -1.92 0.13 0.00 -1.45 0.00 0.00 41.25 37.92 1qa4 s ASN 47 CO 0.01 0.24 0.37 0.42 -3.72 0.00 0.00 177.10 174.42 1qa4 s THR 48 N -0.03 4.14 0.13 -5.21 -4.23 -1.26 -5.03 115.64 104.16 1qa4 s THR 48 Ca 0.07 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.59 1qa4 s THR 48 Cb -0.12 -3.72 0.00 0.00 1.34 0.00 0.00 72.50 70.00 1qa4 s THR 48 CO 0.01 -0.79 0.00 0.00 -0.54 0.00 0.00 174.62 173.29 1qa4 n ALA 49 N 4.67 -1.50 -0.92 3.99 0.00 -1.26 -5.01 120.51 120.48 1qa4 n ALA 49 Ca -0.04 0.18 0.05 0.00 0.00 0.00 0.00 53.44 53.63 1qa4 n ALA 49 Cb 0.41 -0.52 -0.01 0.00 0.00 0.00 0.00 19.45 19.33 1qa4 n ALA 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qa4 n ALA 50 N -0.96 -0.88 -3.72 0.00 0.00 -1.26 -4.91 120.51 108.79 1qa4 n ALA 50 Ca 0.00 0.11 -0.14 0.00 0.00 0.00 0.00 53.44 53.41 1qa4 n ALA 50 Cb 0.26 -0.30 -0.15 0.00 0.00 0.00 0.00 19.45 19.26 1qa4 n ALA 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1qa4 s ASN 51 N -4.64 0.02 0.34 0.00 2.20 -1.26 -5.12 114.94 106.47 1qa4 s ASN 51 Ca 0.00 0.11 0.00 0.00 -0.94 0.00 0.00 52.86 52.03 1qa4 s ASN 51 Cb 0.00 0.01 0.00 0.00 -2.00 0.00 0.00 41.25 39.26 1qa4 s ASN 51 CO 0.00 -0.13 0.00 -3.20 -2.94 0.00 0.00 177.10 170.83 1qa4 n ASN 52 N 4.13 -6.31 -4.38 3.54 2.85 -1.26 -4.23 115.26 109.60 1qa4 n ASN 52 Ca -0.27 1.02 -0.43 0.00 -0.11 0.00 0.00 54.58 54.79 1qa4 n ASN 52 Cb 0.51 -2.85 0.00 0.00 1.24 0.00 0.00 39.78 38.68 1qa4 n ASN 52 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1qa4 n ALA 53 N -1.68 4.02 -0.61 5.20 0.00 -1.26 -4.79 120.51 121.38 1qa4 n ALA 53 Ca 0.01 -3.87 0.00 0.00 0.00 0.00 0.00 53.44 49.57 1qa4 n ALA 53 Cb 0.43 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 16.31 1qa4 n ALA 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qa4 n ALA 54 N 7.77 0.00 -3.83 0.00 0.00 -1.26 -4.79 120.51 118.40 1qa4 n ALA 54 Ca 0.49 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.64 1qa4 n ALA 54 Cb 0.44 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.92 1qa4 n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qa4 s ALA 56 N -3.26 -1.98 0.00 0.00 0.00 -1.26 -5.16 121.76 110.09 1qa4 s ALA 56 Ca 0.63 1.75 0.00 0.00 0.00 0.00 0.00 51.96 54.34 1qa4 s ALA 56 Cb -0.32 -1.18 0.00 0.00 0.00 0.00 0.00 23.12 21.63 1qa4 s ALA 56 CO 0.78 -0.25 0.00 1.87 0.00 0.00 0.00 175.76 178.16