#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 1.08 -3.89 1.61 2.88 -1.26 -5.12 113.62 108.93 2k28 n SER 2 Ca 0.00 -0.13 -0.09 0.00 -1.33 0.00 0.00 58.87 57.31 2k28 n SER 2 Cb 0.00 0.48 -0.07 0.00 -0.75 0.00 0.00 64.21 63.87 2k28 n SER 2 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 2k28 s GLU 3 N -0.70 1.06 -0.43 -1.46 -1.05 -1.26 -5.11 118.70 109.74 2k28 s GLU 3 Ca 0.00 -1.05 0.05 0.00 -0.15 0.00 0.00 54.97 53.82 2k28 s GLU 3 Cb 0.00 0.38 0.18 0.00 -0.44 0.00 0.00 34.13 34.25 2k28 s GLU 3 CO 0.00 -0.38 0.45 0.72 0.95 0.00 0.00 175.26 177.00 2k28 n HIS 4 N -0.17 -1.60 -3.05 4.83 8.25 -1.26 -5.13 115.22 117.08 2k28 n HIS 4 Ca -0.11 -2.86 -0.41 0.00 -0.26 0.00 0.00 57.72 54.09 2k28 n HIS 4 Cb 0.63 0.53 -0.06 0.00 1.12 0.00 0.00 29.99 32.21 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 0.17 4.95 -0.50 1.59 -7.23 -1.26 -5.03 120.40 113.09 2k28 s VAL 5 Ca 0.32 1.25 -0.14 0.00 -1.81 0.00 0.00 61.98 61.61 2k28 s VAL 5 Cb 0.04 -3.98 0.11 0.00 0.56 0.00 0.00 36.38 33.11 2k28 s VAL 5 CO -0.16 0.02 0.42 -0.36 -0.31 0.00 0.00 175.10 174.71 2k28 s PHE 6 N 2.49 3.30 -0.03 2.82 0.40 -1.26 -4.85 117.98 120.85 2k28 s PHE 6 Ca 0.29 -1.38 0.01 0.00 -0.60 0.00 0.00 56.93 55.24 2k28 s PHE 6 Cb -0.15 -3.53 0.02 0.00 0.51 0.00 0.00 43.02 39.86 2k28 s PHE 6 CO 0.09 -0.96 -0.02 0.00 0.70 0.00 0.00 175.22 175.03 2k28 s ALA 7 N 1.53 0.43 -0.02 5.36 0.00 -1.26 -5.08 121.76 122.73 2k28 s ALA 7 Ca 0.04 0.06 -0.30 0.00 0.00 0.00 0.00 51.96 51.76 2k28 s ALA 7 Cb -0.27 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.49 2k28 s ALA 7 CO 0.03 -0.03 1.16 0.08 0.00 0.00 0.00 175.76 177.00 2k28 s VAL 8 N 0.84 4.28 -0.16 0.00 1.01 -1.26 -1.90 120.40 123.21 2k28 s VAL 8 Ca -0.09 1.62 -0.23 0.00 0.00 0.00 0.00 61.98 63.28 2k28 s VAL 8 Cb -0.13 -4.04 -0.23 0.00 0.00 0.00 0.00 36.38 31.98 2k28 s VAL 8 CO -0.01 0.05 0.49 -0.08 0.00 0.00 0.00 175.10 175.56 2k28 h GLU 9 N 7.16 0.06 -2.20 2.72 4.57 -1.07 -3.47 114.58 122.36 2k28 h GLU 9 Ca -0.37 -0.10 0.19 0.00 -1.18 0.00 0.00 59.36 57.90 2k28 h GLU 9 Cb 1.18 0.04 -0.10 0.00 -0.16 0.00 0.00 28.75 29.71 2k28 h GLU 9 CO 0.84 1.05 0.54 0.45 -1.18 0.00 0.00 179.01 180.71 2k28 s SER 10 N -6.67 -0.18 -0.34 1.04 0.15 -1.25 -4.96 113.70 101.49 2k28 s SER 10 Ca -0.23 -0.32 -0.11 0.00 0.70 0.00 0.00 55.95 55.99 2k28 s SER 10 Cb 0.02 0.43 -0.01 0.00 -1.71 0.00 0.00 66.02 64.76 2k28 s SER 10 CO 0.67 -0.78 0.20 -0.63 1.20 0.00 0.00 173.24 173.90 2k28 s ILE 11 N -3.14 4.90 -0.08 6.45 1.01 -1.26 -1.34 121.20 127.74 2k28 s ILE 11 Ca 0.12 -0.41 -0.06 0.00 0.00 0.00 0.00 60.65 60.30 2k28 s ILE 11 Cb -0.00 -3.55 -0.27 0.00 0.01 0.00 0.00 42.46 38.64 2k28 s ILE 11 CO 0.00 -0.02 0.53 -0.33 0.00 0.00 0.00 174.94 175.12 2k28 h GLU 12 N 8.43 0.28 -3.60 2.79 4.39 -1.75 -3.42 114.58 121.69 2k28 h GLU 12 Ca -0.31 -0.48 -0.07 0.00 0.34 0.00 0.00 59.36 58.85 2k28 h GLU 12 Cb 1.14 0.18 -0.13 0.00 -0.10 0.00 0.00 28.75 29.84 2k28 h GLU 12 CO 0.64 1.17 -0.22 0.15 -1.16 0.00 0.00 179.01 179.59 2k28 s LYS 13 N -2.57 0.97 0.27 2.33 1.02 -1.26 -5.02 119.74 115.47 2k28 s LYS 13 Ca -0.18 -0.84 -0.17 0.00 0.02 0.00 0.00 55.97 54.81 2k28 s LYS 13 Cb 0.06 0.41 0.01 0.00 -0.52 0.00 0.00 37.83 37.79 2k28 s LYS 13 CO 0.81 -0.35 0.60 -1.59 -0.92 0.00 0.00 175.35 173.90 2k28 s LYS 14 N -3.84 1.69 -0.16 1.68 0.00 -1.26 -1.13 119.74 116.72 2k28 s LYS 14 Ca 0.04 -1.14 -0.26 0.00 0.00 0.00 0.00 55.97 54.61 2k28 s LYS 14 Cb 0.03 0.54 0.07 0.00 0.00 0.00 0.00 37.83 38.47 2k28 s LYS 14 CO -0.11 -0.74 0.66 -0.98 0.00 0.00 0.00 175.35 174.18 2k28 s ARG 15 N -3.91 0.90 -0.24 1.78 3.03 -0.99 -5.00 118.95 114.52 2k28 s ARG 15 Ca 0.17 0.61 -0.07 0.00 2.03 0.00 0.00 55.73 58.46 2k28 s ARG 15 Cb -0.03 0.43 -0.03 0.00 -1.03 0.00 0.00 34.95 34.28 2k28 s ARG 15 CO 0.08 -0.20 0.07 0.42 -1.13 0.00 0.00 175.30 174.55 2k28 s ILE 16 N -0.36 4.40 -0.10 4.99 1.01 -1.26 -1.39 121.20 128.49 2k28 s ILE 16 Ca -0.05 -0.15 -0.17 0.00 0.00 0.00 0.00 60.65 60.28 2k28 s ILE 16 Cb -0.03 -3.04 0.04 0.00 0.01 0.00 0.00 42.46 39.44 2k28 s ILE 16 CO 0.05 0.36 0.44 -0.60 0.00 0.00 0.00 174.94 175.18 2k28 s ARG 17 N 1.39 0.64 -1.55 2.79 3.52 -0.49 -4.88 118.95 120.37 2k28 s ARG 17 Ca 0.05 0.31 0.00 0.00 -0.13 0.00 0.00 55.73 55.97 2k28 s ARG 17 Cb -0.15 0.30 0.00 0.00 -1.56 0.00 0.00 34.95 33.54 2k28 s ARG 17 CO 0.04 -0.14 0.00 1.17 -0.81 0.00 0.00 175.30 175.56 2k28 n LYS 18 N 2.08 -1.21 -1.57 5.12 4.81 -1.26 -1.87 118.16 124.26 2k28 n LYS 18 Ca -0.17 0.93 -0.14 0.00 -0.87 0.00 0.00 58.31 58.06 2k28 n LYS 18 Cb 0.57 -5.23 -0.05 0.00 0.02 0.00 0.00 35.03 30.34 2k28 n LYS 18 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2k28 n GLY 19 N -1.00 1.16 3.01 3.14 0.00 -1.26 -5.02 105.19 105.22 2k28 n GLY 19 Ca -0.18 -0.35 -0.21 0.00 0.00 0.00 0.00 46.02 45.28 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 -3.47 1.09 -0.13 1.61 1.81 -0.78 -5.14 118.95 113.94 2k28 s ARG 20 Ca 0.00 -0.33 -0.08 0.00 -1.72 0.00 0.00 55.73 53.60 2k28 s ARG 20 Cb 0.00 -1.00 -0.04 0.00 -0.45 0.00 0.00 34.95 33.46 2k28 s ARG 20 CO 0.00 0.11 0.15 0.54 -0.68 0.00 0.00 175.30 175.41 2k28 s VAL 21 N 0.26 5.48 0.06 3.52 0.11 -1.26 -1.40 120.40 127.17 2k28 s VAL 21 Ca -0.05 0.22 0.08 0.00 -2.93 0.00 0.00 61.98 59.31 2k28 s VAL 21 Cb -0.10 -3.42 -0.03 0.00 -1.53 0.00 0.00 36.38 31.30 2k28 s VAL 21 CO 0.01 0.59 -0.22 -0.70 -3.33 0.00 0.00 175.10 171.45 2k28 s GLU 22 N -0.78 1.38 -0.06 1.54 2.12 -0.48 -1.72 118.70 120.69 2k28 s GLU 22 Ca 0.14 -1.03 0.03 0.00 0.36 0.00 0.00 54.97 54.47 2k28 s GLU 22 Cb -0.12 -1.56 0.01 0.00 0.26 0.00 0.00 34.13 32.72 2k28 s GLU 22 CO 0.03 0.39 -0.13 0.71 -0.54 0.00 0.00 175.26 175.72 2k28 s TYR 23 N -0.89 1.53 -0.56 5.30 2.02 0.17 -2.34 117.35 122.58 2k28 s TYR 23 Ca 0.08 -0.56 -0.28 0.00 -0.37 0.00 0.00 57.07 55.94 2k28 s TYR 23 Cb -0.09 -1.10 0.03 0.00 -0.40 0.00 0.00 41.96 40.39 2k28 s TYR 23 CO 0.03 -0.27 1.20 -1.17 -1.57 0.00 0.00 175.55 173.76 2k28 s LEU 24 N 0.58 3.47 -0.32 -1.29 2.96 -0.29 -0.97 118.68 122.82 2k28 s LEU 24 Ca -0.14 0.17 -0.24 0.00 -0.22 0.00 0.00 54.13 53.71 2k28 s LEU 24 Cb -0.15 -3.22 0.00 0.00 0.50 0.00 0.00 46.19 43.32 2k28 s LEU 24 CO 0.04 -1.46 0.81 0.68 -1.32 0.00 0.00 176.35 175.10 2k28 s VAL 25 N 4.93 4.75 -0.82 1.68 -7.23 -0.60 -1.92 120.40 121.19 2k28 s VAL 25 Ca 0.44 1.15 -0.25 0.00 -1.81 0.00 0.00 61.98 61.51 2k28 s VAL 25 Cb -0.08 -4.19 0.01 0.00 0.56 0.00 0.00 36.38 32.68 2k28 s VAL 25 CO 0.26 -0.32 1.62 -0.75 -0.31 0.00 0.00 175.10 175.60 2k28 s LYS 26 N 3.06 3.02 -0.14 4.82 2.47 -0.45 -3.56 119.74 128.97 2k28 s LYS 26 Ca 0.33 -0.29 -0.29 0.00 -1.56 0.00 0.00 55.97 54.16 2k28 s LYS 26 Cb -0.14 -4.75 -0.04 0.00 -1.46 0.00 0.00 37.83 31.44 2k28 s LYS 26 CO 0.14 -2.59 1.71 -1.58 0.16 0.00 0.00 175.35 173.20 2k28 s TRP 27 N 7.33 1.90 0.18 4.03 0.52 -1.26 -0.39 118.94 131.25 2k28 s TRP 27 Ca 0.54 0.33 -0.30 0.00 0.02 0.00 0.00 56.10 56.68 2k28 s TRP 27 Cb -0.07 -3.97 -0.08 0.00 -1.15 0.00 0.00 33.47 28.19 2k28 s TRP 27 CO 0.06 -3.61 1.31 -0.98 0.02 0.00 0.00 176.95 173.75 2k28 s ARG 28 N 4.57 4.39 0.00 4.98 1.70 -0.80 -2.21 118.95 131.58 2k28 s ARG 28 Ca 0.76 2.03 0.00 0.00 -0.47 0.00 0.00 55.73 58.05 2k28 s ARG 28 Cb -0.30 -3.21 0.00 0.00 -0.57 0.00 0.00 34.95 30.86 2k28 s ARG 28 CO 0.31 -0.27 0.00 0.41 -1.08 0.00 0.00 175.30 174.67 2k28 n GLY 29 N 2.58 0.78 3.19 3.88 0.00 -1.26 -4.66 105.19 109.70 2k28 n GLY 29 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 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 -3.00 1.68 0.86 1.61 0.52 -0.94 -5.06 118.94 114.60 2k28 s TRP 30 Ca 0.00 -0.32 -0.11 0.00 0.02 0.00 0.00 56.10 55.69 2k28 s TRP 30 Cb 0.00 -1.07 0.11 0.00 -1.15 0.00 0.00 33.47 31.36 2k28 s TRP 30 CO 0.00 -0.02 1.11 -1.12 0.02 0.00 0.00 176.95 176.94 2k28 s SER 31 N -0.50 3.64 0.53 2.95 0.01 -1.26 -4.68 113.70 114.38 2k28 s SER 31 Ca 0.07 1.87 0.31 0.00 1.31 0.00 0.00 55.95 59.51 2k28 s SER 31 Cb -0.07 -2.47 1.45 0.00 0.21 0.00 0.00 66.02 65.14 2k28 s SER 31 CO -0.01 -2.59 1.88 1.55 0.41 0.00 0.00 173.24 174.48 2k28 h PRO 32 N -1.52 0.03 0.00 12.44 0.13 -1.98 -0.73 132.00 140.39 2k28 h PRO 32 Ca -0.45 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2k28 h PRO 32 Cb 1.26 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2k28 h PRO 32 CO 0.49 0.02 0.00 1.57 -0.23 0.00 0.00 178.00 179.85 2k28 h LYS 33 N 0.04 0.00 -0.45 0.86 2.10 -2.02 -3.09 116.57 114.01 2k28 h LYS 33 Ca 0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.09 2k28 h LYS 33 Cb 1.69 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.02 2k28 h LYS 33 CO -0.02 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.09 2k28 n TYR 34 N -2.36 0.58 -3.35 0.07 4.01 -0.28 -4.94 117.16 110.89 2k28 n TYR 34 Ca 0.05 -0.29 -0.38 0.00 -0.16 0.00 0.00 57.90 57.12 2k28 n TYR 34 Cb 0.41 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.38 2k28 n TYR 34 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 2k28 s ASN 35 N -1.36 6.77 0.12 7.72 0.02 -1.17 -4.84 114.94 122.21 2k28 s ASN 35 Ca 0.40 0.92 0.07 0.00 -1.02 0.00 0.00 52.86 53.23 2k28 s ASN 35 Cb 0.22 -2.29 -0.04 0.00 0.02 0.00 0.00 41.25 39.16 2k28 s ASN 35 CO 0.31 0.11 -0.06 0.42 0.02 0.00 0.00 177.10 177.90 2k28 s THR 36 N -0.01 3.57 -0.37 1.60 -4.23 -1.23 -4.91 115.64 110.05 2k28 s THR 36 Ca 0.26 -1.28 -0.23 0.00 -1.18 0.00 0.00 61.69 59.26 2k28 s THR 36 Cb -0.16 -2.71 0.01 0.00 1.34 0.00 0.00 72.50 70.97 2k28 s THR 36 CO 0.12 0.05 0.80 0.26 -0.54 0.00 0.00 174.62 175.31 2k28 s TRP 37 N -1.39 3.10 0.13 3.99 0.52 -1.26 -1.55 118.94 122.48 2k28 s TRP 37 Ca 0.24 0.55 0.10 0.00 0.02 0.00 0.00 56.10 57.01 2k28 s TRP 37 Cb -0.11 -3.45 -0.04 0.00 -1.15 0.00 0.00 33.47 28.72 2k28 s TRP 37 CO 0.16 -0.77 -0.24 -1.21 0.02 0.00 0.00 176.95 174.91 2k28 s GLU 38 N 3.16 1.53 1.00 4.98 0.41 -0.15 -4.89 118.70 124.75 2k28 s GLU 38 Ca 0.32 -1.31 -0.12 0.00 -0.41 0.00 0.00 54.97 53.45 2k28 s GLU 38 Cb -0.13 -1.96 0.19 0.00 -1.78 0.00 0.00 34.13 30.45 2k28 s GLU 38 CO 0.18 0.46 1.08 -1.25 -0.49 0.00 0.00 175.26 175.23 2k28 s PRO 39 N -2.13 0.37 0.18 0.39 0.04 -1.26 -0.66 135.00 131.93 2k28 s PRO 39 Ca 0.16 0.81 -0.13 0.00 0.04 0.00 0.00 61.00 61.88 2k28 s PRO 39 Cb -0.10 -1.71 0.18 0.00 0.04 0.00 0.00 34.50 32.91 2k28 s PRO 39 CO 0.08 -2.85 1.74 1.49 0.04 0.00 0.00 177.00 177.49 2k28 h GLU 40 N -1.99 0.30 0.00 4.56 4.81 -1.71 -2.35 114.58 118.20 2k28 h GLU 40 Ca -0.54 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.67 2k28 h GLU 40 Cb 1.31 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.62 2k28 h GLU 40 CO 0.53 0.20 0.00 1.05 -0.73 0.00 0.00 179.01 180.06 2k28 h GLU 41 N 0.31 0.00 -0.01 1.92 4.11 -1.93 -1.98 114.58 117.01 2k28 h GLU 41 Ca 0.24 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 59.52 2k28 h GLU 41 Cb 0.28 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 2k28 h GLU 41 CO -0.27 0.00 -0.69 -0.97 0.07 0.00 0.00 179.01 177.15 2k28 h ASN 42 N 0.00 0.05 -2.04 3.06 -0.73 -1.78 -3.36 115.58 110.79 2k28 h ASN 42 Ca 0.00 -0.03 -0.63 0.00 1.87 0.00 0.00 56.30 57.51 2k28 h ASN 42 Cb 0.26 -0.02 -0.13 0.00 0.27 0.00 0.00 38.32 38.70 2k28 h ASN 42 CO 0.00 0.72 1.02 -0.63 -0.37 0.00 0.00 177.43 178.17 2k28 s ILE 43 N -3.47 4.27 -0.36 2.57 -1.09 -0.74 -4.82 121.20 117.54 2k28 s ILE 43 Ca -0.01 -0.83 0.07 0.00 -2.23 0.00 0.00 60.65 57.64 2k28 s ILE 43 Cb 0.12 -4.87 0.57 0.00 -1.58 0.00 0.00 42.46 36.70 2k28 s ILE 43 CO 0.78 -1.68 1.65 -0.11 -1.23 0.00 0.00 174.94 174.35 2k28 n LEU 44 N 7.87 5.23 -4.05 2.97 -0.00 -1.26 -4.96 117.00 122.80 2k28 n LEU 44 Ca 0.19 -3.76 -0.28 0.00 -0.00 0.00 0.00 56.01 52.16 2k28 n LEU 44 Cb 0.49 -0.72 -0.17 0.00 -0.00 0.00 0.00 43.42 43.02 2k28 n LEU 44 CO 0.61 1.21 -0.49 -0.62 -0.00 0.00 0.00 177.39 178.10 2k28 s ASP 45 N -2.08 2.29 0.36 1.96 -1.08 -1.26 -5.04 116.67 111.82 2k28 s ASP 45 Ca 0.50 -0.39 0.18 0.00 -0.52 0.00 0.00 52.55 52.32 2k28 s ASP 45 Cb 0.44 -1.02 0.58 0.00 -1.46 0.00 0.00 42.92 41.46 2k28 s ASP 45 CO 0.04 0.02 1.69 1.55 0.52 0.00 0.00 175.17 178.98 2k28 h PRO 46 N 7.32 0.00 -0.03 4.34 0.13 -1.99 -2.55 132.00 139.23 2k28 h PRO 46 Ca -0.30 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.66 2k28 h PRO 46 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 2k28 h PRO 46 CO 0.48 0.39 -0.73 0.00 -0.23 0.00 0.00 178.00 177.92 2k28 h ARG 47 N 0.00 0.19 -0.01 0.86 3.08 -1.99 -0.47 114.38 116.04 2k28 h ARG 47 Ca -0.00 -0.16 -0.15 0.00 0.07 0.00 0.00 59.98 59.73 2k28 h ARG 47 Cb 0.98 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.05 2k28 h ARG 47 CO 0.05 0.84 -0.71 -0.07 -1.07 0.00 0.00 179.97 179.00 2k28 h LEU 48 N 0.12 0.06 -0.98 3.04 3.38 -1.90 -1.91 115.31 117.14 2k28 h LEU 48 Ca -0.02 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.80 2k28 h LEU 48 Cb 1.29 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 2k28 h LEU 48 CO 0.11 0.75 -0.42 -0.07 0.09 0.00 0.00 178.44 178.91 2k28 h LEU 49 N 0.03 0.20 -0.23 1.67 3.38 -1.12 -0.57 115.31 118.66 2k28 h LEU 49 Ca -0.01 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2k28 h LEU 49 Cb 1.26 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2k28 h LEU 49 CO 0.10 0.60 0.04 0.40 0.09 0.00 0.00 178.44 179.66 2k28 h ILE 50 N 0.16 1.23 -0.80 1.22 2.04 -0.94 -1.85 117.51 118.57 2k28 h ILE 50 Ca 0.01 -0.77 0.02 0.00 1.00 0.00 0.00 64.86 65.13 2k28 h ILE 50 Cb 0.81 1.29 -0.04 0.00 -0.74 0.00 0.00 36.82 38.13 2k28 h ILE 50 CO 0.06 0.24 0.53 0.00 0.00 0.00 0.00 178.15 178.98 2k28 h ALA 51 N 0.84 1.47 0.19 1.87 0.00 -1.18 -0.19 119.26 122.27 2k28 h ALA 51 Ca 0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2k28 h ALA 51 Cb 0.33 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2k28 h ALA 51 CO 0.01 0.47 -0.09 0.35 0.00 0.00 0.00 179.25 179.98 2k28 h PHE 52 N 1.03 -0.24 -0.53 0.00 3.57 -1.03 -1.35 116.94 118.39 2k28 h PHE 52 Ca 0.30 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 2k28 h PHE 52 Cb -0.05 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 2k28 h PHE 52 CO -0.00 -0.09 0.28 1.96 -2.23 0.00 0.00 178.31 178.23 2k28 h GLN 53 N -0.33 0.76 -0.61 1.11 1.08 -0.94 -2.70 115.11 113.47 2k28 h GLN 53 Ca -0.03 -0.10 -0.09 0.00 -1.45 0.00 0.00 58.65 56.98 2k28 h GLN 53 Cb 0.26 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.52 2k28 h GLN 53 CO 0.04 0.60 0.02 -0.91 -0.95 0.00 0.00 178.83 177.63 2k28 h ASN 54 N 0.72 1.04 -0.49 1.46 4.21 -1.03 -0.16 115.58 121.33 2k28 h ASN 54 Ca 0.19 -0.28 -0.00 0.00 1.21 0.00 0.00 56.30 57.41 2k28 h ASN 54 Cb 0.08 -0.28 -0.02 0.00 -1.12 0.00 0.00 38.32 36.98 2k28 h ASN 54 CO -0.03 1.07 0.30 -0.09 -1.29 0.00 0.00 177.43 177.40 2k28 h ARG 55 N 0.98 0.65 0.00 0.81 9.65 -1.10 -2.61 114.38 122.76 2k28 h ARG 55 Ca 0.18 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 59.00 2k28 h ARG 55 Cb 0.53 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.97 2k28 h ARG 55 CO 0.03 0.46 -0.35 1.05 2.80 0.00 0.00 179.97 183.96 2k28 h GLU 56 N 0.65 0.00 -0.31 0.20 4.11 -1.32 -3.29 114.58 114.63 2k28 h GLU 56 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.61 2k28 h GLU 56 Cb -0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 2k28 h GLU 56 CO -0.03 0.00 0.00 -2.13 0.07 0.00 0.00 179.01 176.92 2k28 n ARG 57 N -2.38 2.20 0.24 1.06 0.63 -0.09 -4.24 116.66 114.08 2k28 n ARG 57 Ca 0.04 -1.80 0.17 0.00 -0.92 0.00 0.00 57.85 55.33 2k28 n ARG 57 Cb 0.46 -1.46 0.86 0.00 0.45 0.00 0.00 32.46 32.77 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 3.55 0.00 -5.28 -0.14 1.08 -1.55 -3.37 115.11 109.41 2k28 h GLN 58 Ca 0.00 0.00 -0.65 0.00 -1.45 0.00 0.00 58.65 56.55 2k28 h GLN 58 Cb 0.78 0.00 -0.26 0.00 -0.05 0.00 0.00 27.48 27.95 2k28 h GLN 58 CO 0.00 0.00 -0.75 -2.00 -0.95 0.00 0.00 178.83 175.13 2k28 s GLU 59 N -4.62 3.41 0.00 1.46 2.12 -1.26 -5.17 118.70 114.64 2k28 s GLU 59 Ca -0.05 -0.66 0.29 0.00 0.36 0.00 0.00 54.97 54.91 2k28 s GLU 59 Cb 0.15 -2.71 1.30 0.00 0.26 0.00 0.00 34.13 33.14 2k28 s GLU 59 CO 0.54 0.17 1.89 1.04 -0.54 0.00 0.00 175.26 178.36