#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k28 s SER 2 N 0.00 0.57 0.25 1.61 0.15 -1.26 -5.00 113.70 110.02 2k28 s SER 2 Ca 0.00 0.38 0.25 0.00 0.70 0.00 0.00 55.95 57.28 2k28 s SER 2 Cb 0.00 0.66 0.66 0.00 -1.71 0.00 0.00 66.02 65.63 2k28 s SER 2 CO 0.00 -0.26 1.69 1.05 1.20 0.00 0.00 173.24 176.92 2k28 h GLU 3 N 8.29 0.00 -5.86 5.44 -0.00 -2.10 -3.41 114.58 116.94 2k28 h GLU 3 Ca -0.15 0.00 -0.46 0.00 -0.00 0.00 0.00 59.36 58.75 2k28 h GLU 3 Cb 1.13 0.00 -0.07 0.00 -0.00 0.00 0.00 28.75 29.80 2k28 h GLU 3 CO 0.18 0.00 1.22 -1.01 -0.00 0.00 0.00 179.01 179.40 2k28 s HIS 4 N -3.13 2.21 -0.32 2.06 3.76 -1.26 -4.98 115.29 113.63 2k28 s HIS 4 Ca 0.09 -0.20 -0.24 0.00 -0.15 0.00 0.00 55.06 54.57 2k28 s HIS 4 Cb 0.11 -4.37 0.00 0.00 1.11 0.00 0.00 32.58 29.43 2k28 s HIS 4 CO 0.63 -1.77 0.83 0.08 -0.85 0.00 0.00 174.74 173.65 2k28 s VAL 5 N 7.59 4.74 -0.32 -0.90 1.01 -1.26 -5.03 120.40 126.23 2k28 s VAL 5 Ca 0.59 1.19 0.03 0.00 0.00 0.00 0.00 61.98 63.79 2k28 s VAL 5 Cb -0.02 -4.20 0.09 0.00 0.00 0.00 0.00 36.38 32.26 2k28 s VAL 5 CO -0.02 -0.32 0.03 -0.36 0.00 0.00 0.00 175.10 174.44 2k28 s PHE 6 N 3.08 3.36 -0.16 5.22 0.08 -1.26 -4.89 117.98 123.40 2k28 s PHE 6 Ca 0.34 -2.69 -0.08 0.00 0.12 0.00 0.00 56.93 54.61 2k28 s PHE 6 Cb -0.14 -2.58 0.06 0.00 -0.57 0.00 0.00 43.02 39.79 2k28 s PHE 6 CO 0.14 -0.92 0.38 0.00 -0.10 0.00 0.00 175.22 174.71 2k28 s ALA 7 N 1.05 -0.96 0.39 5.36 0.00 -1.26 -5.11 121.76 121.22 2k28 s ALA 7 Ca 0.08 1.41 -0.19 0.00 0.00 0.00 0.00 51.96 53.25 2k28 s ALA 7 Cb -0.19 -0.97 -0.10 0.00 0.00 0.00 0.00 23.12 21.86 2k28 s ALA 7 CO -0.10 -0.38 0.88 0.08 0.00 0.00 0.00 175.76 176.24 2k28 s VAL 8 N 1.69 4.47 0.00 0.00 1.01 -1.26 -0.62 120.40 125.69 2k28 s VAL 8 Ca -0.07 1.34 0.00 0.00 0.00 0.00 0.00 61.98 63.25 2k28 s VAL 8 Cb -0.10 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.65 2k28 s VAL 8 CO -0.12 -0.24 0.00 1.21 0.00 0.00 0.00 175.10 175.95 2k28 n GLU 9 N -0.45 0.00 -3.29 2.72 4.07 0.63 -4.61 120.64 119.71 2k28 n GLU 9 Ca 0.05 0.41 0.02 0.00 -0.06 0.00 0.00 57.16 57.58 2k28 n GLU 9 Cb 0.53 -0.90 0.01 0.00 -0.06 0.00 0.00 31.44 31.02 2k28 n GLU 9 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 2k28 n SER 10 N -1.93 -0.74 -4.66 4.31 2.88 -1.26 -4.81 113.62 107.42 2k28 n SER 10 Ca 0.00 -1.10 -0.43 0.00 -1.33 0.00 0.00 58.87 56.01 2k28 n SER 10 Cb 0.00 1.14 -0.02 0.00 -0.75 0.00 0.00 64.21 64.57 2k28 n SER 10 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2k28 s ILE 11 N -2.04 4.70 -0.18 2.46 1.01 -1.21 -2.24 121.20 123.71 2k28 s ILE 11 Ca 0.21 1.93 -0.18 0.00 0.00 0.00 0.00 60.65 62.61 2k28 s ILE 11 Cb -0.00 -4.28 -0.21 0.00 0.01 0.00 0.00 42.46 37.97 2k28 s ILE 11 CO -0.01 -0.17 0.28 -0.33 0.00 0.00 0.00 174.94 174.71 2k28 h GLU 12 N 7.52 0.08 -4.39 2.79 5.08 -1.52 -3.35 114.58 120.80 2k28 h GLU 12 Ca -0.20 -0.14 -0.18 0.00 -1.00 0.00 0.00 59.36 57.84 2k28 h GLU 12 Cb 1.07 0.05 -0.15 0.00 0.50 0.00 0.00 28.75 30.22 2k28 h GLU 12 CO 0.96 1.07 -0.60 0.15 -1.00 0.00 0.00 179.01 179.59 2k28 s LYS 13 N -2.42 1.01 0.18 2.33 1.02 -1.26 -4.92 119.74 115.69 2k28 s LYS 13 Ca -0.27 -1.44 -0.09 0.00 0.02 0.00 0.00 55.97 54.19 2k28 s LYS 13 Cb 0.06 0.26 -0.01 0.00 -0.52 0.00 0.00 37.83 37.62 2k28 s LYS 13 CO 0.65 -0.31 0.32 -1.59 -0.92 0.00 0.00 175.35 173.50 2k28 s LYS 14 N -4.06 1.25 -0.13 1.68 0.00 -1.26 -1.69 119.74 115.53 2k28 s LYS 14 Ca 0.26 -1.21 -0.30 0.00 0.00 0.00 0.00 55.97 54.72 2k28 s LYS 14 Cb 0.07 0.39 0.11 0.00 0.00 0.00 0.00 37.83 38.41 2k28 s LYS 14 CO 0.04 -0.47 0.92 -0.98 0.00 0.00 0.00 175.35 174.86 2k28 s ARG 15 N -3.99 0.71 -0.05 1.78 3.03 -1.14 -5.03 118.95 114.25 2k28 s ARG 15 Ca 0.20 0.13 0.05 0.00 2.03 0.00 0.00 55.73 58.14 2k28 s ARG 15 Cb 0.03 0.33 -0.02 0.00 -1.03 0.00 0.00 34.95 34.26 2k28 s ARG 15 CO 0.03 -0.23 -0.18 0.42 -1.13 0.00 0.00 175.30 174.21 2k28 s ILE 16 N -1.28 2.71 -0.24 4.99 1.01 -1.26 -2.78 121.20 124.36 2k28 s ILE 16 Ca -0.03 -0.85 -0.11 0.00 0.00 0.00 0.00 60.65 59.66 2k28 s ILE 16 Cb -0.00 -2.04 0.09 0.00 0.01 0.00 0.00 42.46 40.52 2k28 s ILE 16 CO 0.02 0.58 0.55 -0.60 0.00 0.00 0.00 174.94 175.49 2k28 s ARG 17 N -0.55 0.52 -1.47 2.79 3.00 -0.15 -4.90 118.95 118.18 2k28 s ARG 17 Ca 0.08 1.11 0.00 0.00 -1.00 0.00 0.00 55.73 55.91 2k28 s ARG 17 Cb -0.11 0.27 0.00 0.00 0.00 0.00 0.00 34.95 35.11 2k28 s ARG 17 CO 0.01 -0.18 0.00 1.63 0.00 0.00 0.00 175.30 176.76 2k28 n LYS 18 N 4.73 -1.21 -1.11 5.12 4.76 -1.26 -2.05 118.16 127.14 2k28 n LYS 18 Ca -0.17 0.87 -0.04 0.00 -2.87 0.00 0.00 58.31 56.10 2k28 n LYS 18 Cb 0.54 -5.18 -0.02 0.00 -1.84 0.00 0.00 35.03 28.54 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 -1.02 0.62 3.45 0.72 0.00 -1.26 -5.02 105.19 102.68 2k28 n GLY 19 Ca -0.18 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.67 2.29 -0.02 1.61 0.52 -0.87 -5.14 118.95 115.68 2k28 s ARG 20 Ca 0.00 -0.83 0.06 0.00 -0.52 0.00 0.00 55.73 54.43 2k28 s ARG 20 Cb 0.00 -2.26 -0.01 0.00 0.52 0.00 0.00 34.95 33.19 2k28 s ARG 20 CO 0.00 0.58 -0.19 0.54 0.02 0.00 0.00 175.30 176.26 2k28 s VAL 21 N -0.79 1.52 0.09 3.52 0.11 -1.26 -0.97 120.40 122.61 2k28 s VAL 21 Ca 0.13 -0.80 0.04 0.00 -2.93 0.00 0.00 61.98 58.41 2k28 s VAL 21 Cb -0.10 -1.27 -0.03 0.00 -1.53 0.00 0.00 36.38 33.44 2k28 s VAL 21 CO 0.02 0.43 -0.11 -1.83 -3.33 0.00 0.00 175.10 170.28 2k28 s GLU 22 N -0.31 0.85 -0.01 1.54 1.03 -1.12 -2.65 118.70 118.03 2k28 s GLU 22 Ca 0.04 -1.11 0.05 0.00 0.03 0.00 0.00 54.97 53.98 2k28 s GLU 22 Cb -0.09 -0.62 -0.01 0.00 -0.80 0.00 0.00 34.13 32.61 2k28 s GLU 22 CO 0.00 0.11 -0.15 0.71 -1.33 0.00 0.00 175.26 174.60 2k28 s TYR 23 N -2.11 1.32 -0.56 4.83 2.02 -0.42 -2.91 117.35 119.53 2k28 s TYR 23 Ca 0.04 -0.26 -0.24 0.00 -0.37 0.00 0.00 57.07 56.24 2k28 s TYR 23 Cb -0.05 -0.85 0.04 0.00 -0.40 0.00 0.00 41.96 40.70 2k28 s TYR 23 CO 0.01 -0.02 0.96 -1.17 -1.57 0.00 0.00 175.55 173.76 2k28 s LEU 24 N -0.39 4.08 -0.31 -1.29 2.96 -0.68 -1.42 118.68 121.63 2k28 s LEU 24 Ca 0.06 -0.35 -0.20 0.00 -0.22 0.00 0.00 54.13 53.42 2k28 s LEU 24 Cb -0.06 -2.83 -0.01 0.00 0.50 0.00 0.00 46.19 43.79 2k28 s LEU 24 CO -0.00 -1.25 0.62 0.68 -1.32 0.00 0.00 176.35 175.08 2k28 s VAL 25 N 4.00 4.94 -0.33 1.68 -7.23 -0.58 -1.28 120.40 121.61 2k28 s VAL 25 Ca 0.31 0.84 -0.29 0.00 -1.81 0.00 0.00 61.98 61.03 2k28 s VAL 25 Cb -0.12 -3.99 0.00 0.00 0.56 0.00 0.00 36.38 32.82 2k28 s VAL 25 CO 0.19 -0.14 1.35 -0.75 -0.31 0.00 0.00 175.10 175.45 2k28 s LYS 26 N 2.59 3.81 -0.44 4.82 2.47 -0.95 -2.14 119.74 129.90 2k28 s LYS 26 Ca 0.25 1.18 -0.29 0.00 -1.56 0.00 0.00 55.97 55.55 2k28 s LYS 26 Cb -0.15 -3.93 0.01 0.00 -1.46 0.00 0.00 37.83 32.30 2k28 s LYS 26 CO 0.12 -1.26 1.40 -1.58 0.16 0.00 0.00 175.35 174.18 2k28 s TRP 27 N 4.74 2.41 -0.21 4.03 0.52 -1.26 -0.26 118.94 128.90 2k28 s TRP 27 Ca 0.59 0.65 -0.29 0.00 0.02 0.00 0.00 56.10 57.07 2k28 s TRP 27 Cb -0.16 -4.33 -0.02 0.00 -1.15 0.00 0.00 33.47 27.80 2k28 s TRP 27 CO 0.26 -1.93 1.50 0.50 0.02 0.00 0.00 176.95 177.30 2k28 s ARG 28 N 5.00 3.94 0.00 4.98 3.52 0.21 -1.62 118.95 134.98 2k28 s ARG 28 Ca 0.59 1.65 0.00 0.00 -0.13 0.00 0.00 55.73 57.84 2k28 s ARG 28 Cb -0.13 -3.95 0.00 0.00 -1.56 0.00 0.00 34.95 29.31 2k28 s ARG 28 CO 0.32 -1.11 0.00 0.41 -0.81 0.00 0.00 175.30 174.11 2k28 n GLY 29 N 4.35 1.63 3.96 8.12 0.00 -1.26 -4.38 105.19 117.62 2k28 n GLY 29 Ca 0.17 -0.35 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.03 2.95 0.64 1.61 0.52 -0.64 -5.12 118.94 117.86 2k28 s TRP 30 Ca 0.00 0.09 -0.11 0.00 0.02 0.00 0.00 56.10 56.10 2k28 s TRP 30 Cb 0.00 -2.69 -0.03 0.00 -1.15 0.00 0.00 33.47 29.60 2k28 s TRP 30 CO 0.00 -0.80 1.04 -1.12 0.02 0.00 0.00 176.95 176.08 2k28 s SER 31 N -4.39 5.95 0.00 2.95 0.01 -1.26 -4.83 113.70 112.14 2k28 s SER 31 Ca 0.56 1.51 0.06 0.00 1.31 0.00 0.00 55.95 59.38 2k28 s SER 31 Cb -0.10 -2.48 0.35 0.00 0.21 0.00 0.00 66.02 63.99 2k28 s SER 31 CO 0.39 -1.06 0.73 -2.65 0.41 0.00 0.00 173.24 171.07 2k28 n PRO 32 N -2.77 0.28 0.00 12.44 -0.02 -1.26 -1.44 135.00 142.23 2k28 n PRO 32 Ca 0.07 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.66 2k28 n PRO 32 Cb 0.54 -1.32 -0.14 0.00 -0.02 0.00 0.00 33.50 32.55 2k28 n PRO 32 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 2k28 n LYS 33 N -0.82 0.53 -0.31 -0.52 2.85 -1.26 -4.38 118.16 114.24 2k28 n LYS 33 Ca 0.04 -0.14 0.09 0.00 -1.05 0.00 0.00 58.31 57.26 2k28 n LYS 33 Cb 0.02 -1.54 0.26 0.00 -0.65 0.00 0.00 35.03 33.12 2k28 n LYS 33 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2k28 n TYR 34 N -2.14 0.82 -2.42 5.58 4.01 -0.52 -4.92 117.16 117.56 2k28 n TYR 34 Ca -0.02 -0.40 -0.42 0.00 -0.16 0.00 0.00 57.90 56.90 2k28 n TYR 34 Cb 0.52 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.50 2k28 n TYR 34 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2k28 s ASN 35 N -0.99 7.10 -0.07 7.72 4.22 -1.24 -4.64 114.94 127.04 2k28 s ASN 35 Ca 0.39 2.09 0.01 0.00 -2.14 0.00 0.00 52.86 53.21 2k28 s ASN 35 Cb 0.21 -2.59 -0.03 0.00 1.28 0.00 0.00 41.25 40.12 2k28 s ASN 35 CO 0.26 -0.42 -0.07 0.42 -2.04 0.00 0.00 177.10 175.25 2k28 s THR 36 N 0.62 3.64 -0.53 0.54 -4.23 -0.91 -4.91 115.64 109.87 2k28 s THR 36 Ca 0.56 -0.50 -0.27 0.00 -1.18 0.00 0.00 61.69 60.30 2k28 s THR 36 Cb -0.30 -2.49 0.03 0.00 1.34 0.00 0.00 72.50 71.08 2k28 s THR 36 CO 0.32 0.59 1.09 0.26 -0.54 0.00 0.00 174.62 176.34 2k28 s TRP 37 N -0.73 2.75 -0.05 3.99 0.52 -1.26 -1.53 118.94 122.62 2k28 s TRP 37 Ca 0.11 0.41 0.04 0.00 0.02 0.00 0.00 56.10 56.68 2k28 s TRP 37 Cb -0.11 -4.33 0.00 0.00 -1.15 0.00 0.00 33.47 27.88 2k28 s TRP 37 CO 0.01 -1.38 -0.16 -1.21 0.02 0.00 0.00 176.95 174.23 2k28 s GLU 38 N 4.45 1.86 1.11 4.98 2.02 -0.51 -4.88 118.70 127.72 2k28 s GLU 38 Ca 0.41 -0.58 -0.14 0.00 0.02 0.00 0.00 54.97 54.69 2k28 s GLU 38 Cb -0.09 -1.57 0.21 0.00 0.10 0.00 0.00 34.13 32.78 2k28 s GLU 38 CO 0.26 0.18 0.76 -0.35 0.02 0.00 0.00 175.26 176.13 2k28 n PRO 39 N 3.35 -1.79 0.24 0.39 -0.04 -1.26 -1.30 135.00 134.60 2k28 n PRO 39 Ca -0.19 -0.49 0.08 0.00 -0.04 0.00 0.00 63.50 62.86 2k28 n PRO 39 Cb 0.53 -2.07 0.61 0.00 -0.04 0.00 0.00 33.50 32.52 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 -2.34 0.00 0.00 0.54 4.81 -1.88 -0.82 114.58 114.90 2k28 h GLU 40 Ca -0.55 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 58.63 2k28 h GLU 40 Cb 1.32 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.70 2k28 h GLU 40 CO 0.44 0.11 -0.19 1.05 -0.73 0.00 0.00 179.01 179.69 2k28 h GLU 41 N 0.00 0.00 0.00 1.92 4.11 -1.91 -1.59 114.58 117.11 2k28 h GLU 41 Ca -0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.38 2k28 h GLU 41 Cb 0.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2k28 h GLU 41 CO 0.01 0.19 -0.25 -0.91 0.07 0.00 0.00 179.01 178.13 2k28 h ASN 42 N 0.00 0.00 -2.02 3.06 4.21 -1.47 -3.41 115.58 115.95 2k28 h ASN 42 Ca -0.00 0.00 -0.67 0.00 1.21 0.00 0.00 56.30 56.84 2k28 h ASN 42 Cb 0.40 0.00 -0.15 0.00 -1.12 0.00 0.00 38.32 37.45 2k28 h ASN 42 CO 0.03 0.25 1.08 -0.63 -1.29 0.00 0.00 177.43 176.86 2k28 s ILE 43 N -3.14 4.53 -0.48 2.81 -1.09 -0.60 -4.77 121.20 118.46 2k28 s ILE 43 Ca 0.05 -1.45 0.24 0.00 -2.23 0.00 0.00 60.65 57.25 2k28 s ILE 43 Cb 0.07 -4.87 0.09 0.00 -1.58 0.00 0.00 42.46 36.17 2k28 s ILE 43 CO 0.70 -1.64 1.30 -0.07 -1.23 0.00 0.00 174.94 174.00 2k28 h LEU 44 N 11.03 0.00 -8.90 2.97 -0.00 -1.80 -3.47 115.31 115.14 2k28 h LEU 44 Ca 0.19 -0.09 -0.62 0.00 -0.00 0.00 0.00 57.88 57.35 2k28 h LEU 44 Cb 1.01 0.00 -0.13 0.00 -0.00 0.00 0.00 40.66 41.53 2k28 h LEU 44 CO 1.21 0.05 0.01 -0.62 -0.00 0.00 0.00 178.44 179.09 2k28 s ASP 45 N -4.93 6.41 0.38 -0.43 2.15 -1.26 -4.97 116.67 114.02 2k28 s ASP 45 Ca 0.04 0.36 0.28 0.00 0.43 0.00 0.00 52.55 53.66 2k28 s ASP 45 Cb 0.11 -2.29 1.08 0.00 -0.30 0.00 0.00 42.92 41.52 2k28 s ASP 45 CO 0.73 -0.38 1.82 -0.65 -0.17 0.00 0.00 175.17 176.51 2k28 h PRO 46 N 8.18 0.00 0.00 4.34 0.11 -2.00 -3.06 132.00 139.56 2k28 h PRO 46 Ca -0.28 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.69 2k28 h PRO 46 Cb 1.13 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 2k28 h PRO 46 CO 0.75 0.00 -0.64 0.00 -0.21 0.00 0.00 178.00 177.90 2k28 h ARG 47 N 0.00 0.00 -0.58 1.05 -0.00 -1.99 -2.66 114.38 110.20 2k28 h ARG 47 Ca 0.00 0.00 -0.10 0.00 -0.50 0.00 0.00 59.98 59.38 2k28 h ARG 47 Cb 0.49 0.00 -0.02 0.00 0.00 0.00 0.00 29.97 30.44 2k28 h ARG 47 CO 0.00 0.64 -0.02 -0.07 0.00 0.00 0.00 179.97 180.53 2k28 h LEU 48 N 0.00 1.03 -2.26 3.04 3.38 -1.85 -2.94 115.31 115.71 2k28 h LEU 48 Ca -0.01 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 2k28 h LEU 48 Cb 1.19 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.67 2k28 h LEU 48 CO 0.08 1.09 -0.04 -0.07 0.09 0.00 0.00 178.44 179.60 2k28 h LEU 49 N 0.93 0.00 -0.16 1.67 3.38 -1.56 -2.65 115.31 116.92 2k28 h LEU 49 Ca 0.16 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 2k28 h LEU 49 Cb 0.58 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2k28 h LEU 49 CO 0.03 0.04 0.04 0.40 0.09 0.00 0.00 178.44 179.03 2k28 h ILE 50 N 0.00 1.21 0.00 1.22 2.04 -1.31 -2.42 117.51 118.25 2k28 h ILE 50 Ca -0.00 -0.66 -0.06 0.00 1.00 0.00 0.00 64.86 65.14 2k28 h ILE 50 Cb 0.23 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 2k28 h ILE 50 CO 0.00 0.20 -0.28 0.00 0.00 0.00 0.00 178.15 178.07 2k28 h ALA 51 N 0.83 1.10 -0.18 1.87 0.00 -1.59 -1.49 119.26 119.81 2k28 h ALA 51 Ca 0.05 -0.26 0.04 0.00 0.00 0.00 0.00 54.91 54.75 2k28 h ALA 51 Cb 0.27 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 2k28 h ALA 51 CO 0.00 0.35 -0.09 0.35 0.00 0.00 0.00 179.25 179.86 2k28 h PHE 52 N 0.00 -0.22 -0.90 0.00 3.57 -1.43 0.12 116.94 118.09 2k28 h PHE 52 Ca -0.00 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 2k28 h PHE 52 Cb 0.72 0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.54 2k28 h PHE 52 CO 0.00 -0.14 0.49 1.96 -2.23 0.00 0.00 178.31 178.39 2k28 h GLN 53 N -0.08 1.26 -0.12 1.11 4.20 -0.86 -1.03 115.11 119.60 2k28 h GLN 53 Ca 0.10 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.62 2k28 h GLN 53 Cb 0.22 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 2k28 h GLN 53 CO -0.23 0.92 -0.11 -0.91 -0.67 0.00 0.00 178.83 177.84 2k28 h ASN 54 N 1.27 0.17 0.51 1.46 2.35 -1.14 -2.77 115.58 117.43 2k28 h ASN 54 Ca 0.32 -0.03 -0.22 0.00 -0.55 0.00 0.00 56.30 55.82 2k28 h ASN 54 Cb 0.03 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.35 2k28 h ASN 54 CO -0.05 0.31 -0.96 -0.09 -1.65 0.00 0.00 177.43 175.00 2k28 h ARG 55 N 0.18 0.28 0.00 0.81 1.12 -0.05 -3.20 114.38 113.52 2k28 h ARG 55 Ca 0.04 -0.33 -0.02 0.00 -1.11 0.00 0.00 59.98 58.56 2k28 h ARG 55 Cb 0.32 0.10 -0.00 0.00 -0.01 0.00 0.00 29.97 30.38 2k28 h ARG 55 CO 0.02 1.05 -0.09 0.93 -3.11 0.00 0.00 179.97 178.76 2k28 h GLU 56 N 0.15 0.00 -0.50 0.20 4.39 -0.93 -2.24 114.58 115.65 2k28 h GLU 56 Ca -0.07 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.63 2k28 h GLU 56 Cb 1.60 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.25 2k28 h GLU 56 CO 0.15 0.09 0.00 2.89 -1.16 0.00 0.00 179.01 180.99 2k28 n ARG 57 N -3.48 3.37 -4.31 2.33 1.85 -1.18 -4.98 116.66 110.25 2k28 n ARG 57 Ca -0.01 -2.68 -0.16 0.00 -1.00 0.00 0.00 57.85 53.99 2k28 n ARG 57 Cb 0.24 -1.74 -0.10 0.00 -1.05 0.00 0.00 32.46 29.81 2k28 n ARG 57 CO 0.00 0.00 0.00 1.14 -0.01 0.00 0.00 177.63 178.76 2k28 s GLN 58 N -1.85 1.35 -0.05 2.89 -2.07 -0.84 -5.08 119.66 114.00 2k28 s GLN 58 Ca 0.43 -1.71 0.16 0.00 -1.82 0.00 0.00 55.36 52.42 2k28 s GLN 58 Cb 0.28 -0.40 -0.24 0.00 -1.09 0.00 0.00 33.01 31.56 2k28 s GLN 58 CO 0.19 -0.20 0.30 0.39 -1.32 0.00 0.00 175.29 174.65 2k28 n GLU 59 N -0.42 0.72 0.00 9.60 1.02 -1.26 -4.92 120.64 125.37 2k28 n GLU 59 Ca -0.03 -0.12 0.10 0.00 -0.02 0.00 0.00 57.16 57.09 2k28 n GLU 59 Cb 0.65 -1.40 0.08 0.00 -0.02 0.00 0.00 31.44 30.75 2k28 n GLU 59 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35