#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k28 n SER 2 N 0.00 7.58 0.21 1.61 3.41 -1.26 -4.72 113.62 120.45 2k28 n SER 2 Ca 0.00 -3.82 0.05 0.00 -0.26 0.00 0.00 58.87 54.84 2k28 n SER 2 Cb 0.00 -1.04 0.46 0.00 -0.26 0.00 0.00 64.21 63.37 2k28 n SER 2 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2k28 h GLU 3 N 2.69 0.00 -2.54 4.33 4.81 -2.07 -3.29 114.58 118.50 2k28 h GLU 3 Ca 0.58 0.00 -0.61 0.00 -0.13 0.00 0.00 59.36 59.20 2k28 h GLU 3 Cb 0.27 0.00 -0.42 0.00 0.63 0.00 0.00 28.75 29.24 2k28 h GLU 3 CO 1.49 0.28 -0.54 0.72 -0.73 0.00 0.00 179.01 180.22 2k28 n HIS 4 N -4.06 3.52 -2.54 0.92 8.25 -1.26 -5.06 115.22 114.98 2k28 n HIS 4 Ca -0.02 -4.18 -0.43 0.00 -0.26 0.00 0.00 57.72 52.83 2k28 n HIS 4 Cb 0.34 -0.61 -0.02 0.00 1.12 0.00 0.00 29.99 30.82 2k28 n HIS 4 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2k28 s VAL 5 N -2.12 4.15 -0.20 1.59 -7.23 -1.24 -4.99 120.40 110.35 2k28 s VAL 5 Ca 0.34 1.19 -0.03 0.00 -1.81 0.00 0.00 61.98 61.67 2k28 s VAL 5 Cb 0.08 -4.49 0.07 0.00 0.56 0.00 0.00 36.38 32.59 2k28 s VAL 5 CO -0.07 -0.91 0.06 -0.36 -0.31 0.00 0.00 175.10 173.52 2k28 s PHE 6 N 4.63 0.75 -0.05 2.82 0.08 -1.26 -4.67 117.98 120.27 2k28 s PHE 6 Ca 0.51 -0.73 -0.02 0.00 0.12 0.00 0.00 56.93 56.81 2k28 s PHE 6 Cb -0.09 -0.95 0.03 0.00 -0.57 0.00 0.00 43.02 41.45 2k28 s PHE 6 CO 0.31 -0.61 0.10 0.00 -0.10 0.00 0.00 175.22 174.92 2k28 s ALA 7 N 1.95 -0.12 0.00 5.36 0.00 -1.25 -5.02 121.76 122.68 2k28 s ALA 7 Ca 0.01 0.53 -0.30 0.00 0.00 0.00 0.00 51.96 52.20 2k28 s ALA 7 Cb -0.17 -0.37 -0.06 0.00 0.00 0.00 0.00 23.12 22.52 2k28 s ALA 7 CO -0.11 -0.14 1.51 0.08 0.00 0.00 0.00 175.76 177.10 2k28 s VAL 8 N 1.12 3.51 -0.11 0.00 1.01 -1.26 -1.23 120.40 123.44 2k28 s VAL 8 Ca -0.09 0.86 -0.03 0.00 0.00 0.00 0.00 61.98 62.72 2k28 s VAL 8 Cb -0.12 -3.56 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 2k28 s VAL 8 CO -0.05 -0.02 0.01 -0.08 0.00 0.00 0.00 175.10 174.96 2k28 h GLU 9 N 8.29 0.00 -2.52 2.72 4.57 -1.31 -3.47 114.58 122.87 2k28 h GLU 9 Ca -0.39 0.00 0.14 0.00 -1.18 0.00 0.00 59.36 57.93 2k28 h GLU 9 Cb 1.18 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.72 2k28 h GLU 9 CO 0.92 0.06 0.48 0.45 -1.18 0.00 0.00 179.01 179.74 2k28 s SER 10 N -5.63 -0.10 -0.35 1.04 0.15 -1.26 -5.00 113.70 102.55 2k28 s SER 10 Ca -0.04 -0.59 -0.20 0.00 0.70 0.00 0.00 55.95 55.82 2k28 s SER 10 Cb 0.00 0.55 0.00 0.00 -1.71 0.00 0.00 66.02 64.86 2k28 s SER 10 CO 0.08 -1.05 0.63 -0.63 1.20 0.00 0.00 173.24 173.47 2k28 s ILE 11 N -2.86 4.90 -0.16 6.45 1.01 -1.26 -2.88 121.20 126.40 2k28 s ILE 11 Ca 0.16 0.59 -0.21 0.00 0.00 0.00 0.00 60.65 61.18 2k28 s ILE 11 Cb -0.02 -4.07 -0.23 0.00 0.01 0.00 0.00 42.46 38.14 2k28 s ILE 11 CO 0.05 -0.30 0.46 -0.33 0.00 0.00 0.00 174.94 174.81 2k28 h GLU 12 N 8.45 0.08 -5.39 2.79 4.39 -1.24 -3.45 114.58 120.20 2k28 h GLU 12 Ca -0.26 -0.13 -0.41 0.00 0.34 0.00 0.00 59.36 58.89 2k28 h GLU 12 Cb 1.11 0.05 -0.20 0.00 -0.10 0.00 0.00 28.75 29.61 2k28 h GLU 12 CO 0.83 1.06 -0.77 0.15 -1.16 0.00 0.00 179.01 179.13 2k28 s LYS 13 N -2.37 0.93 -0.08 2.33 1.02 -1.25 -4.97 119.74 115.35 2k28 s LYS 13 Ca -0.24 -1.11 0.03 0.00 0.02 0.00 0.00 55.97 54.67 2k28 s LYS 13 Cb 0.03 -0.86 0.01 0.00 -0.52 0.00 0.00 37.83 36.49 2k28 s LYS 13 CO 0.67 0.18 -0.17 0.21 -0.92 0.00 0.00 175.35 175.32 2k28 s LYS 14 N -2.25 2.22 0.20 1.68 2.36 -1.26 -2.40 119.74 120.29 2k28 s LYS 14 Ca 0.04 -0.59 -0.22 0.00 -2.55 0.00 0.00 55.97 52.65 2k28 s LYS 14 Cb -0.07 -1.77 0.05 0.00 -1.05 0.00 0.00 37.83 34.99 2k28 s LYS 14 CO 0.02 0.07 0.63 -0.98 1.55 0.00 0.00 175.35 176.65 2k28 s ARG 15 N 0.59 1.46 -0.04 4.03 1.04 -1.21 -5.08 118.95 119.73 2k28 s ARG 15 Ca -0.15 -0.68 0.04 0.00 -1.04 0.00 0.00 55.73 53.89 2k28 s ARG 15 Cb -0.16 0.59 -0.00 0.00 -2.04 0.00 0.00 34.95 33.33 2k28 s ARG 15 CO 0.05 -0.65 -0.14 0.42 -0.04 0.00 0.00 175.30 174.94 2k28 s ILE 16 N -3.82 1.18 -0.16 4.99 1.01 -1.26 -2.23 121.20 120.91 2k28 s ILE 16 Ca 0.05 -0.57 -0.08 0.00 0.00 0.00 0.00 60.65 60.04 2k28 s ILE 16 Cb -0.03 -1.03 0.06 0.00 0.01 0.00 0.00 42.46 41.48 2k28 s ILE 16 CO -0.05 0.35 0.38 -0.60 0.00 0.00 0.00 174.94 175.02 2k28 s ARG 17 N 0.13 0.35 -1.33 2.79 6.06 -0.60 -4.88 118.95 121.46 2k28 s ARG 17 Ca -0.04 0.78 -0.01 0.00 -2.50 0.00 0.00 55.73 53.96 2k28 s ARG 17 Cb -0.11 0.00 0.00 0.00 0.06 0.00 0.00 34.95 34.91 2k28 s ARG 17 CO 0.02 -0.17 0.13 1.63 -2.50 0.00 0.00 175.30 174.41 2k28 n LYS 18 N 4.43 -2.01 -1.28 5.12 4.76 -1.26 -1.61 118.16 126.30 2k28 n LYS 18 Ca -0.21 0.76 -0.10 0.00 -2.87 0.00 0.00 58.31 55.89 2k28 n LYS 18 Cb 0.54 -5.17 -0.04 0.00 -1.84 0.00 0.00 35.03 28.52 2k28 n LYS 18 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k28 n GLY 19 N -1.11 1.11 3.20 0.72 0.00 -1.26 -5.00 105.19 102.85 2k28 n GLY 19 Ca -0.16 -0.39 -0.36 0.00 0.00 0.00 0.00 46.02 45.11 2k28 n GLY 19 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k28 s ARG 20 N -2.67 2.44 -0.36 1.61 1.81 -0.64 -5.07 118.95 116.07 2k28 s ARG 20 Ca 0.00 -1.34 -0.27 0.00 -1.72 0.00 0.00 55.73 52.40 2k28 s ARG 20 Cb 0.00 -3.38 0.02 0.00 -0.45 0.00 0.00 34.95 31.14 2k28 s ARG 20 CO 0.00 -0.73 0.98 0.54 -0.68 0.00 0.00 175.30 175.41 2k28 s VAL 21 N 1.30 4.54 -0.00 3.52 0.11 -1.26 -1.56 120.40 127.04 2k28 s VAL 21 Ca -0.01 1.34 0.01 0.00 -2.93 0.00 0.00 61.98 60.39 2k28 s VAL 21 Cb -0.20 -4.37 -0.00 0.00 -1.53 0.00 0.00 36.38 30.27 2k28 s VAL 21 CO -0.00 -0.55 -0.05 -1.83 -3.33 0.00 0.00 175.10 169.34 2k28 s GLU 22 N 3.59 0.40 -0.04 1.54 -1.05 -0.95 -1.10 118.70 121.09 2k28 s GLU 22 Ca 0.41 -0.17 0.03 0.00 -0.15 0.00 0.00 54.97 55.08 2k28 s GLU 22 Cb -0.12 -0.38 -0.03 0.00 -0.44 0.00 0.00 34.13 33.16 2k28 s GLU 22 CO 0.19 0.10 -0.10 0.71 0.95 0.00 0.00 175.26 177.10 2k28 s TYR 23 N -0.09 2.81 -0.45 4.83 2.02 -0.30 -3.35 117.35 122.82 2k28 s TYR 23 Ca 0.02 -0.07 -0.24 0.00 -0.37 0.00 0.00 57.07 56.40 2k28 s TYR 23 Cb -0.02 -1.64 0.03 0.00 -0.40 0.00 0.00 41.96 39.92 2k28 s TYR 23 CO -0.00 0.28 0.86 -1.17 -1.57 0.00 0.00 175.55 173.95 2k28 s LEU 24 N -0.94 4.12 -0.07 -1.29 2.96 -1.01 -0.99 118.68 121.45 2k28 s LEU 24 Ca 0.13 0.02 -0.16 0.00 -0.22 0.00 0.00 54.13 53.90 2k28 s LEU 24 Cb -0.11 -3.09 -0.05 0.00 0.50 0.00 0.00 46.19 43.44 2k28 s LEU 24 CO 0.02 -0.99 0.43 0.68 -1.32 0.00 0.00 176.35 175.18 2k28 s VAL 25 N 3.54 5.13 -0.17 1.68 -7.23 -0.61 -0.62 120.40 122.12 2k28 s VAL 25 Ca 0.34 0.87 -0.25 0.00 -1.81 0.00 0.00 61.98 61.12 2k28 s VAL 25 Cb -0.11 -3.76 -0.01 0.00 0.56 0.00 0.00 36.38 33.06 2k28 s VAL 25 CO 0.25 0.43 0.84 -0.75 -0.31 0.00 0.00 175.10 175.56 2k28 s LYS 26 N -0.08 4.30 -0.34 4.82 2.36 -1.14 -2.85 119.74 126.80 2k28 s LYS 26 Ca 0.24 1.02 -0.23 0.00 -2.55 0.00 0.00 55.97 54.46 2k28 s LYS 26 Cb -0.16 -3.58 0.01 0.00 -1.05 0.00 0.00 37.83 33.05 2k28 s LYS 26 CO 0.11 -0.33 0.77 -1.58 1.55 0.00 0.00 175.35 175.86 2k28 s TRP 27 N 2.17 3.14 0.13 4.03 0.52 -1.26 -0.76 118.94 126.92 2k28 s TRP 27 Ca 0.38 0.61 -0.31 0.00 0.02 0.00 0.00 56.10 56.80 2k28 s TRP 27 Cb -0.17 -3.31 -0.09 0.00 -1.15 0.00 0.00 33.47 28.75 2k28 s TRP 27 CO 0.12 -0.67 1.61 0.50 0.02 0.00 0.00 176.95 178.53 2k28 s ARG 28 N 3.01 4.20 0.00 4.98 3.52 -0.36 -1.78 118.95 132.52 2k28 s ARG 28 Ca 0.31 2.36 0.00 0.00 -0.13 0.00 0.00 55.73 58.27 2k28 s ARG 28 Cb -0.14 -3.32 0.00 0.00 -1.56 0.00 0.00 34.95 29.93 2k28 s ARG 28 CO 0.15 -0.66 0.00 0.41 -0.81 0.00 0.00 175.30 174.39 2k28 n GLY 29 N 3.86 2.81 3.56 8.12 0.00 -1.26 -3.90 105.19 118.38 2k28 n GLY 29 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 2k28 n GLY 29 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2k28 s TRP 30 N -2.52 2.37 0.61 1.61 0.52 -0.73 -5.01 118.94 115.79 2k28 s TRP 30 Ca 0.00 -0.63 -0.11 0.00 0.02 0.00 0.00 56.10 55.38 2k28 s TRP 30 Cb 0.00 -1.53 -0.04 0.00 -1.15 0.00 0.00 33.47 30.75 2k28 s TRP 30 CO 0.00 0.45 1.02 -1.54 0.02 0.00 0.00 176.95 176.90 2k28 s SER 31 N -3.63 6.24 0.00 2.95 1.04 -1.26 -4.74 113.70 114.30 2k28 s SER 31 Ca 0.34 1.41 0.02 0.00 0.48 0.00 0.00 55.95 58.20 2k28 s SER 31 Cb 0.06 -2.47 0.13 0.00 0.10 0.00 0.00 66.02 63.85 2k28 s SER 31 CO 0.17 -0.86 0.65 -0.81 0.98 0.00 0.00 173.24 173.37 2k28 n PRO 32 N -2.71 0.54 0.03 4.02 -0.04 -1.26 -1.47 135.00 134.11 2k28 n PRO 32 Ca 0.06 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.57 2k28 n PRO 32 Cb 0.54 -1.06 -0.09 0.00 -0.04 0.00 0.00 33.50 32.85 2k28 n PRO 32 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2k28 n LYS 33 N -0.56 0.63 -0.04 0.54 -0.00 -1.26 -4.08 118.16 113.40 2k28 n LYS 33 Ca 0.02 0.06 0.01 0.00 -0.00 0.00 0.00 58.31 58.39 2k28 n LYS 33 Cb 0.01 -1.71 0.02 0.00 -0.00 0.00 0.00 35.03 33.35 2k28 n LYS 33 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2k28 n TYR 34 N -2.64 0.09 -1.62 5.58 4.01 -0.54 -4.92 117.16 117.12 2k28 n TYR 34 Ca -0.07 -0.04 -0.39 0.00 -0.16 0.00 0.00 57.90 57.24 2k28 n TYR 34 Cb 0.71 -0.04 0.04 0.00 -0.31 0.00 0.00 39.34 39.74 2k28 n TYR 34 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2k28 n ASN 35 N -0.22 0.99 -4.18 7.72 0.23 -1.26 -4.74 115.26 113.80 2k28 n ASN 35 Ca 0.02 0.87 -0.19 0.00 -0.53 0.00 0.00 54.58 54.75 2k28 n ASN 35 Cb 0.13 -1.39 -0.12 0.00 -2.08 0.00 0.00 39.78 36.32 2k28 n ASN 35 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 2k28 s THR 36 N -1.45 1.20 -0.60 5.53 -4.23 -1.13 -4.97 115.64 109.99 2k28 s THR 36 Ca 0.72 -1.30 -0.27 0.00 -1.18 0.00 0.00 61.69 59.66 2k28 s THR 36 Cb -0.45 -1.13 0.03 0.00 1.34 0.00 0.00 72.50 72.29 2k28 s THR 36 CO 0.50 -0.17 1.13 0.26 -0.54 0.00 0.00 174.62 175.80 2k28 s TRP 37 N -1.21 2.61 -0.24 3.99 0.52 -1.26 -1.57 118.94 121.77 2k28 s TRP 37 Ca -0.00 0.20 -0.08 0.00 0.02 0.00 0.00 56.10 56.24 2k28 s TRP 37 Cb -0.10 -4.41 -0.04 0.00 -1.15 0.00 0.00 33.47 27.77 2k28 s TRP 37 CO 0.02 -1.60 0.10 -1.21 0.02 0.00 0.00 176.95 174.29 2k28 s GLU 38 N 4.78 3.81 1.08 4.98 0.41 -0.17 -4.88 118.70 128.71 2k28 s GLU 38 Ca 0.38 -0.40 -0.13 0.00 -0.41 0.00 0.00 54.97 54.41 2k28 s GLU 38 Cb -0.09 -3.40 0.20 0.00 -1.78 0.00 0.00 34.13 29.05 2k28 s GLU 38 CO 0.22 -0.09 0.82 -0.35 -0.49 0.00 0.00 175.26 175.36 2k28 n PRO 39 N 4.68 -1.60 -0.23 0.39 -0.04 -1.26 -1.15 135.00 135.80 2k28 n PRO 39 Ca -0.16 -0.43 -0.00 0.00 -0.04 0.00 0.00 63.50 62.87 2k28 n PRO 39 Cb 0.52 -2.11 0.22 0.00 -0.04 0.00 0.00 33.50 32.08 2k28 n PRO 39 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2k28 h GLU 40 N -2.28 1.01 -0.79 0.54 4.81 -1.47 -1.55 114.58 114.86 2k28 h GLU 40 Ca -0.54 -0.08 0.01 0.00 -0.13 0.00 0.00 59.36 58.62 2k28 h GLU 40 Cb 1.32 -0.22 -0.04 0.00 0.63 0.00 0.00 28.75 30.44 2k28 h GLU 40 CO 0.44 0.71 0.52 1.05 -0.73 0.00 0.00 179.01 180.99 2k28 h GLU 41 N 1.03 1.04 -0.51 1.92 4.11 -1.92 -2.93 114.58 117.33 2k28 h GLU 41 Ca 0.27 -0.06 -0.11 0.00 0.07 0.00 0.00 59.36 59.53 2k28 h GLU 41 Cb -0.05 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 28.95 2k28 h GLU 41 CO -0.05 0.69 -0.10 -0.97 0.07 0.00 0.00 179.01 178.65 2k28 h ASN 42 N 1.07 0.97 -0.66 3.06 -0.73 -1.63 -3.33 115.58 114.32 2k28 h ASN 42 Ca 0.29 -0.35 -0.70 0.00 1.87 0.00 0.00 56.30 57.41 2k28 h ASN 42 Cb -0.12 -0.26 -0.07 0.00 0.27 0.00 0.00 38.32 38.13 2k28 h ASN 42 CO -0.06 1.10 2.46 -0.38 -0.37 0.00 0.00 177.43 180.18 2k28 n ILE 43 N -4.20 3.82 0.67 2.57 2.08 -0.95 -4.64 119.36 118.70 2k28 n ILE 43 Ca 0.01 -3.79 0.12 0.00 0.56 0.00 0.00 62.75 59.64 2k28 n ILE 43 Cb 0.39 -2.44 0.16 0.00 -0.75 0.00 0.00 39.64 37.00 2k28 n ILE 43 CO 0.00 0.00 0.00 -0.11 0.56 0.00 0.00 176.55 177.00 2k28 n LEU 44 N 7.38 0.63 -4.68 1.39 -0.00 -1.25 -4.85 117.00 115.61 2k28 n LEU 44 Ca 0.49 0.12 -0.42 0.00 -0.00 0.00 0.00 56.01 56.20 2k28 n LEU 44 Cb 0.43 -0.18 -0.03 0.00 -0.00 0.00 0.00 43.42 43.65 2k28 n LEU 44 CO 0.81 0.01 1.12 -0.62 -0.00 0.00 0.00 177.39 178.71 2k28 s ASP 45 N -3.88 6.86 0.39 1.96 2.15 -1.26 -4.94 116.67 117.94 2k28 s ASP 45 Ca 0.07 2.07 0.16 0.00 0.43 0.00 0.00 52.55 55.27 2k28 s ASP 45 Cb 0.15 -2.56 0.80 0.00 -0.30 0.00 0.00 42.92 41.01 2k28 s ASP 45 CO 0.73 -0.73 1.83 1.55 -0.17 0.00 0.00 175.17 178.39 2k28 h PRO 46 N 7.96 0.00 -0.14 4.34 0.13 -1.98 -2.54 132.00 139.77 2k28 h PRO 46 Ca -0.37 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.56 2k28 h PRO 46 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2k28 h PRO 46 CO 0.91 0.35 -0.72 0.00 -0.23 0.00 0.00 178.00 178.31 2k28 h ARG 47 N 0.00 0.65 -0.54 0.86 2.47 -2.00 -1.37 114.38 114.45 2k28 h ARG 47 Ca -0.00 -0.51 -0.11 0.00 -1.26 0.00 0.00 59.98 58.10 2k28 h ARG 47 Cb 0.68 0.10 -0.02 0.00 -1.65 0.00 0.00 29.97 29.08 2k28 h ARG 47 CO 0.05 1.13 -0.10 -0.07 0.56 0.00 0.00 179.97 181.53 2k28 h LEU 48 N 0.45 1.02 -2.04 3.04 3.38 -1.93 -2.91 115.31 116.34 2k28 h LEU 48 Ca -0.03 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.58 2k28 h LEU 48 Cb 1.32 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.79 2k28 h LEU 48 CO 0.14 1.13 -0.08 -0.07 0.09 0.00 0.00 178.44 179.65 2k28 h LEU 49 N 0.91 0.00 -0.47 1.67 3.38 -1.21 -1.88 115.31 117.71 2k28 h LEU 49 Ca 0.14 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.07 2k28 h LEU 49 Cb 0.67 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 2k28 h LEU 49 CO 0.05 0.08 0.11 0.40 0.09 0.00 0.00 178.44 179.17 2k28 h ILE 50 N 0.00 1.24 -0.24 1.22 2.04 -1.04 -2.23 117.51 118.50 2k28 h ILE 50 Ca -0.00 -0.83 -0.02 0.00 1.00 0.00 0.00 64.86 65.00 2k28 h ILE 50 Cb 0.29 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 2k28 h ILE 50 CO 0.01 0.30 0.04 0.00 0.00 0.00 0.00 178.15 178.50 2k28 h ALA 51 N 0.98 1.63 -0.32 1.87 0.00 -1.37 -1.97 119.26 120.08 2k28 h ALA 51 Ca 0.15 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2k28 h ALA 51 Cb 0.33 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2k28 h ALA 51 CO 0.00 0.28 0.15 0.35 0.00 0.00 0.00 179.25 180.03 2k28 h PHE 52 N 0.34 0.46 -0.60 0.00 3.57 -1.29 -1.85 116.94 117.57 2k28 h PHE 52 Ca 0.08 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 2k28 h PHE 52 Cb 0.17 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.74 2k28 h PHE 52 CO 0.00 0.42 0.30 1.96 -2.23 0.00 0.00 178.31 178.76 2k28 h GLN 53 N 0.38 0.84 -0.24 1.11 4.20 -0.75 -1.00 115.11 119.65 2k28 h GLN 53 Ca 0.11 -0.10 -0.14 0.00 0.06 0.00 0.00 58.65 58.58 2k28 h GLN 53 Cb 0.13 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 2k28 h GLN 53 CO -0.01 0.64 -0.42 -0.91 -0.67 0.00 0.00 178.83 177.46 2k28 h ASN 54 N 0.84 0.62 -0.15 1.46 4.21 -1.39 -2.59 115.58 118.59 2k28 h ASN 54 Ca 0.21 -0.28 -0.08 0.00 1.21 0.00 0.00 56.30 57.36 2k28 h ASN 54 Cb 0.07 -0.17 -0.02 0.00 -1.12 0.00 0.00 38.32 37.08 2k28 h ASN 54 CO -0.03 0.96 -0.13 -0.09 -1.29 0.00 0.00 177.43 176.85 2k28 h ARG 55 N 0.48 0.52 -0.34 0.81 9.65 -0.38 -2.13 114.38 122.99 2k28 h ARG 55 Ca 0.04 -0.16 -0.11 0.00 -1.10 0.00 0.00 59.98 58.66 2k28 h ARG 55 Cb 0.93 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.45 2k28 h ARG 55 CO 0.08 0.65 -0.20 0.93 2.80 0.00 0.00 179.97 184.23 2k28 h GLU 56 N 0.48 0.73 -0.62 0.20 4.39 -1.14 -3.25 114.58 115.37 2k28 h GLU 56 Ca 0.09 -0.34 0.00 0.00 0.34 0.00 0.00 59.36 59.45 2k28 h GLU 56 Cb 0.52 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 2k28 h GLU 56 CO 0.03 0.95 0.00 -2.13 -1.16 0.00 0.00 179.01 176.70 2k28 n ARG 57 N -4.30 2.89 0.05 2.33 0.63 -0.98 -4.33 116.66 112.96 2k28 n ARG 57 Ca -0.03 -1.88 -0.02 0.00 -0.92 0.00 0.00 57.85 55.00 2k28 n ARG 57 Cb 0.42 -1.72 -0.01 0.00 0.45 0.00 0.00 32.46 31.60 2k28 n ARG 57 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 2k28 h GLN 58 N 2.64 -0.14 -2.08 -0.14 1.08 -1.43 -3.47 115.11 111.58 2k28 h GLN 58 Ca 0.00 0.01 -0.36 0.00 -1.45 0.00 0.00 58.65 56.85 2k28 h GLN 58 Cb 1.10 0.03 -0.09 0.00 -0.05 0.00 0.00 27.48 28.47 2k28 h GLN 58 CO 0.18 -0.09 -0.38 0.39 -0.95 0.00 0.00 178.83 177.98 2k28 n GLU 59 N -2.46 -1.60 0.00 1.46 1.02 -1.26 -5.14 120.64 112.66 2k28 n GLU 59 Ca -0.02 0.96 0.14 0.00 -0.02 0.00 0.00 57.16 58.23 2k28 n GLU 59 Cb 0.06 -5.42 0.62 0.00 -0.02 0.00 0.00 31.44 26.68 2k28 n GLU 59 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31