#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k57 s ALA 2 N 0.00 3.63 -0.24 -5.12 0.00 -1.26 -4.97 121.76 113.79 2k57 s ALA 2 Ca 0.00 1.32 -0.22 0.00 0.00 0.00 0.00 51.96 53.07 2k57 s ALA 2 Cb 0.00 -3.81 -0.02 0.00 0.00 0.00 0.00 23.12 19.29 2k57 s ALA 2 CO 0.00 -1.46 0.69 -1.12 0.00 0.00 0.00 175.76 173.87 2k57 s SER 3 N 3.89 6.67 -0.03 0.00 0.01 -1.25 -4.81 113.70 118.18 2k57 s SER 3 Ca 0.85 0.83 -0.30 0.00 1.31 0.00 0.00 55.95 58.64 2k57 s SER 3 Cb -0.43 -2.37 -0.07 0.00 0.21 0.00 0.00 66.02 63.37 2k57 s SER 3 CO 0.39 -0.40 1.81 -2.16 0.41 0.00 0.00 173.24 173.28 2k57 s PRO 4 N 2.53 4.12 -0.13 12.44 0.04 -1.22 -3.30 135.00 149.47 2k57 s PRO 4 Ca 0.29 2.35 0.01 0.00 0.04 0.00 0.00 61.00 63.69 2k57 s PRO 4 Cb -0.15 -4.08 -0.00 0.00 0.04 0.00 0.00 34.50 30.30 2k57 s PRO 4 CO 0.08 -0.95 -0.17 0.99 0.04 0.00 0.00 177.00 176.99 2k57 s THR 5 N 4.40 2.60 -0.19 1.26 2.01 0.13 -0.08 115.64 125.77 2k57 s THR 5 Ca 0.81 -0.81 -0.11 0.00 0.31 0.00 0.00 61.69 61.88 2k57 s THR 5 Cb -0.37 -2.07 -0.05 0.00 0.01 0.00 0.00 72.50 70.02 2k57 s THR 5 CO 0.35 0.53 0.18 0.54 -0.69 0.00 0.00 174.62 175.53 2k57 s VAL 6 N 0.53 5.37 -0.25 3.82 0.11 0.12 -0.34 120.40 129.76 2k57 s VAL 6 Ca -0.11 0.30 -0.06 0.00 -2.93 0.00 0.00 61.98 59.19 2k57 s VAL 6 Cb -0.16 -3.52 -0.01 0.00 -1.53 0.00 0.00 36.38 31.16 2k57 s VAL 6 CO 0.04 0.41 0.02 -0.63 -3.33 0.00 0.00 175.10 171.61 2k57 s ILE 7 N 0.49 3.78 -0.12 7.04 1.01 -0.19 -2.45 121.20 130.76 2k57 s ILE 7 Ca 0.11 -0.47 -0.26 0.00 0.00 0.00 0.00 60.65 60.03 2k57 s ILE 7 Cb -0.12 -2.80 -0.02 0.00 0.01 0.00 0.00 42.46 39.53 2k57 s ILE 7 CO 0.00 0.30 0.83 -0.89 0.00 0.00 0.00 174.94 175.19 2k57 s THR 8 N 1.52 4.91 0.69 2.92 2.01 -0.78 -1.16 115.64 125.75 2k57 s THR 8 Ca 0.05 1.67 -0.01 0.00 0.31 0.00 0.00 61.69 63.72 2k57 s THR 8 Cb -0.15 -4.15 0.11 0.00 0.01 0.00 0.00 72.50 68.31 2k57 s THR 8 CO 0.00 0.09 0.96 -0.76 -0.69 0.00 0.00 174.62 174.22 2k57 s LEU 9 N 1.70 3.02 0.16 4.42 1.43 0.62 -0.03 118.68 130.00 2k57 s LEU 9 Ca 0.41 -0.28 -0.12 0.00 -1.03 0.00 0.00 54.13 53.10 2k57 s LEU 9 Cb -0.17 -2.16 0.04 0.00 0.03 0.00 0.00 46.19 43.92 2k57 s LEU 9 CO 0.16 -1.73 1.66 -1.13 0.23 0.00 0.00 176.35 175.54 2k57 h ASN 10 N -0.43 0.82 0.86 2.29 -0.73 0.39 -2.71 115.58 116.07 2k57 h ASN 10 Ca -0.38 -0.24 -0.04 0.00 1.87 0.00 0.00 56.30 57.51 2k57 h ASN 10 Cb 1.27 -0.22 -0.01 0.00 0.27 0.00 0.00 38.32 39.64 2k57 h ASN 10 CO 0.43 0.85 -0.20 -2.24 -0.37 0.00 0.00 177.43 175.90 2k57 h ASP 11 N 0.76 0.00 0.00 1.15 2.03 -1.95 -3.47 116.42 114.94 2k57 h ASP 11 Ca 0.17 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.47 2k57 h ASP 11 Cb 0.36 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.86 2k57 h ASP 11 CO 0.00 0.20 0.00 0.61 -1.03 0.00 0.00 179.24 179.02 2k57 n GLY 12 N 0.04 2.03 3.75 7.15 0.00 -1.02 -5.11 105.19 112.03 2k57 n GLY 12 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2k57 n GLY 12 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2k57 s ARG 13 N 0.00 4.24 -0.11 1.61 3.52 -1.26 -4.57 118.95 122.39 2k57 s ARG 13 Ca 0.00 2.36 -0.01 0.00 -0.13 0.00 0.00 55.73 57.96 2k57 s ARG 13 Cb 0.00 -3.08 -0.03 0.00 -1.56 0.00 0.00 34.95 30.29 2k57 s ARG 13 CO 0.00 -0.44 -0.08 -1.21 -0.81 0.00 0.00 175.30 172.77 2k57 s GLU 14 N -0.71 3.14 -0.17 5.12 2.02 -1.26 -0.27 118.70 126.56 2k57 s GLU 14 Ca 0.58 -0.57 -0.00 0.00 0.02 0.00 0.00 54.97 55.00 2k57 s GLU 14 Cb -0.43 -2.68 0.00 0.00 0.10 0.00 0.00 34.13 31.12 2k57 s GLU 14 CO 0.47 0.45 -0.15 0.42 0.02 0.00 0.00 175.26 176.47 2k57 s ILE 15 N -0.23 2.58 -0.32 -1.63 1.01 -0.31 -4.93 121.20 117.38 2k57 s ILE 15 Ca 0.03 -0.78 -0.24 0.00 0.00 0.00 0.00 60.65 59.65 2k57 s ILE 15 Cb -0.13 -2.10 0.00 0.00 0.01 0.00 0.00 42.46 40.24 2k57 s ILE 15 CO 0.03 0.51 0.82 -1.10 0.00 0.00 0.00 174.94 175.20 2k57 s GLN 16 N 1.06 3.95 -0.02 2.79 -0.21 -1.26 -1.02 119.66 124.94 2k57 s GLN 16 Ca -0.01 0.61 0.02 0.00 0.02 0.00 0.00 55.36 56.00 2k57 s GLN 16 Cb -0.14 -3.74 -0.03 0.00 1.00 0.00 0.00 33.01 30.09 2k57 s GLN 16 CO -0.04 -0.73 -0.06 0.00 -2.12 0.00 0.00 175.29 172.34 2k57 s ALA 17 N 3.06 3.05 -0.93 6.09 0.00 0.54 -3.12 121.76 130.44 2k57 s ALA 17 Ca 0.34 -0.96 0.27 0.00 0.00 0.00 0.00 51.96 51.61 2k57 s ALA 17 Cb -0.14 -1.20 0.98 0.00 0.00 0.00 0.00 23.12 22.76 2k57 s ALA 17 CO 0.13 0.60 1.77 1.33 0.00 0.00 0.00 175.76 179.60 2k57 n VAL 18 N 1.76 0.13 -4.29 0.00 0.24 0.75 0.22 118.33 117.14 2k57 n VAL 18 Ca -0.16 -0.07 -0.18 0.00 -2.04 0.00 0.00 64.34 61.89 2k57 n VAL 18 Cb 0.53 -0.36 -0.10 0.00 -1.47 0.00 0.00 33.84 32.43 2k57 n VAL 18 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2k57 s ASP 19 N -3.34 2.21 0.32 -1.34 -1.08 -1.21 -3.46 116.67 108.77 2k57 s ASP 19 Ca 0.12 -0.93 -0.27 0.00 -0.52 0.00 0.00 52.55 50.96 2k57 s ASP 19 Cb 0.17 -0.09 -0.10 0.00 -1.46 0.00 0.00 42.92 41.45 2k57 s ASP 19 CO 0.58 -0.18 0.96 0.42 0.52 0.00 0.00 175.17 177.47 2k57 s THR 20 N -2.68 4.11 0.13 1.71 -4.23 -1.21 -4.22 115.64 109.26 2k57 s THR 20 Ca 0.16 1.80 -0.31 0.00 -1.18 0.00 0.00 61.69 62.17 2k57 s THR 20 Cb -0.02 -4.02 -0.08 0.00 1.34 0.00 0.00 72.50 69.72 2k57 s THR 20 CO 0.04 0.19 1.31 -2.16 -0.54 0.00 0.00 174.62 173.46 2k57 s PRO 21 N -1.93 4.38 -0.17 3.99 0.04 -1.26 -4.78 135.00 135.27 2k57 s PRO 21 Ca 0.49 1.98 -0.07 0.00 0.04 0.00 0.00 61.00 63.44 2k57 s PRO 21 Cb -0.21 -3.26 -0.04 0.00 0.04 0.00 0.00 34.50 31.04 2k57 s PRO 21 CO 0.26 -0.32 0.07 0.21 0.04 0.00 0.00 177.00 177.26 2k57 s LYS 22 N 0.68 3.82 -0.19 4.56 2.20 0.28 -4.90 119.74 126.19 2k57 s LYS 22 Ca 0.60 -0.32 -0.20 0.00 -0.36 0.00 0.00 55.97 55.69 2k57 s LYS 22 Cb -0.35 -3.18 -0.03 0.00 -1.51 0.00 0.00 37.83 32.77 2k57 s LYS 22 CO 0.32 0.38 0.60 -0.47 -0.36 0.00 0.00 175.35 175.83 2k57 s TYR 23 N 0.06 3.38 -0.47 4.03 5.04 -1.26 -0.16 117.35 127.98 2k57 s TYR 23 Ca 0.06 0.90 -0.17 0.00 -2.44 0.00 0.00 57.07 55.42 2k57 s TYR 23 Cb -0.12 -2.76 0.06 0.00 0.35 0.00 0.00 41.96 39.48 2k57 s TYR 23 CO 0.01 -0.14 0.45 0.34 -1.34 0.00 0.00 175.55 174.86 2k57 s ASP 24 N 1.17 6.17 0.52 4.32 2.15 -0.49 -4.94 116.67 125.57 2k57 s ASP 24 Ca 0.28 -1.08 0.30 0.00 0.43 0.00 0.00 52.55 52.48 2k57 s ASP 24 Cb -0.16 -2.22 1.27 0.00 -0.30 0.00 0.00 42.92 41.51 2k57 s ASP 24 CO 0.10 -0.68 1.95 -0.08 -0.17 0.00 0.00 175.17 176.30 2k57 h GLU 25 N 8.80 0.00 -0.16 4.34 4.81 -1.95 0.23 114.58 130.65 2k57 h GLU 25 Ca -0.28 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 58.90 2k57 h GLU 25 Cb 1.11 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.48 2k57 h GLU 25 CO 0.87 0.08 -0.12 0.93 -0.73 0.00 0.00 179.01 180.05 2k57 h GLU 26 N 0.00 0.35 0.00 1.92 4.39 -1.96 -3.35 114.58 115.94 2k57 h GLU 26 Ca -0.00 -0.17 -0.25 0.00 0.34 0.00 0.00 59.36 59.28 2k57 h GLU 26 Cb 0.56 -0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.16 2k57 h GLU 26 CO 0.01 0.71 -2.20 -1.13 -1.16 0.00 0.00 179.01 175.23 2k57 n SER 27 N -4.58 0.27 0.00 1.42 3.41 -1.19 -5.01 113.62 107.94 2k57 n SER 27 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 2k57 n SER 27 Cb 0.34 1.26 0.00 0.00 -0.26 0.00 0.00 64.21 65.55 2k57 n SER 27 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2k57 n GLY 28 N 1.67 0.77 3.92 5.00 0.00 0.79 -4.98 105.19 112.37 2k57 n GLY 28 Ca -0.23 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.52 2k57 n GLY 28 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2k57 s PHE 29 N -2.14 3.48 -0.18 1.61 0.08 -1.22 -0.30 117.98 119.31 2k57 s PHE 29 Ca 0.00 0.40 -0.09 0.00 0.12 0.00 0.00 56.93 57.36 2k57 s PHE 29 Cb 0.00 -1.90 -0.05 0.00 -0.57 0.00 0.00 43.02 40.50 2k57 s PHE 29 CO 0.00 0.31 0.10 0.71 -0.10 0.00 0.00 175.22 176.25 2k57 s TYR 30 N -1.96 3.36 -0.29 0.36 1.51 -0.13 -1.39 117.35 118.82 2k57 s TYR 30 Ca 0.40 0.25 -0.12 0.00 -1.01 0.00 0.00 57.07 56.59 2k57 s TYR 30 Cb -0.11 -2.10 -0.04 0.00 -0.11 0.00 0.00 41.96 39.60 2k57 s TYR 30 CO 0.30 0.28 0.25 -1.21 -1.11 0.00 0.00 175.55 174.06 2k57 s GLU 31 N 0.22 3.87 -0.03 -0.62 2.02 0.78 -3.12 118.70 121.81 2k57 s GLU 31 Ca 0.07 -0.30 -0.05 0.00 0.02 0.00 0.00 54.97 54.71 2k57 s GLU 31 Cb -0.12 -3.69 0.01 0.00 0.10 0.00 0.00 34.13 30.43 2k57 s GLU 31 CO -0.01 -0.27 0.12 -0.59 0.02 0.00 0.00 175.26 174.53 2k57 s PHE 32 N 1.84 -0.08 -0.42 1.61 -0.71 -1.07 -0.55 117.98 118.60 2k57 s PHE 32 Ca 0.09 0.20 -0.19 0.00 -1.04 0.00 0.00 56.93 55.99 2k57 s PHE 32 Cb -0.16 0.02 0.02 0.00 -1.21 0.00 0.00 43.02 41.68 2k57 s PHE 32 CO 0.11 -0.11 0.54 0.21 -1.34 0.00 0.00 175.22 174.62 2k57 s LYS 33 N -0.29 3.25 1.21 1.99 2.20 -1.26 -1.93 119.74 124.91 2k57 s LYS 33 Ca -0.04 -0.50 -0.16 0.00 -0.36 0.00 0.00 55.97 54.91 2k57 s LYS 33 Cb -0.03 -3.94 0.29 0.00 -1.51 0.00 0.00 37.83 32.65 2k57 s LYS 33 CO 0.00 -0.89 1.03 -0.65 -0.36 0.00 0.00 175.35 174.48 2k57 s GLN 34 N 2.48 -1.28 0.24 4.03 -0.21 0.32 -0.18 119.66 125.06 2k57 s GLN 34 Ca 0.18 0.40 -0.05 0.00 0.02 0.00 0.00 55.36 55.91 2k57 s GLN 34 Cb -0.15 -1.55 0.47 0.00 1.00 0.00 0.00 33.01 32.77 2k57 s GLN 34 CO 0.16 -3.85 1.68 -0.07 -2.12 0.00 0.00 175.29 171.09 2k57 h LEU 35 N -2.70 0.01 -0.53 2.90 3.38 -1.86 0.46 115.31 116.97 2k57 h LEU 35 Ca -0.53 0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2k57 h LEU 35 Cb 1.33 0.20 0.00 0.00 0.09 0.00 0.00 40.66 42.28 2k57 h LEU 35 CO 0.44 -0.04 0.00 0.47 0.09 0.00 0.00 178.44 179.40 2k57 n ASP 36 N -5.16 0.55 -0.02 -0.43 9.92 -1.26 -4.79 116.55 115.36 2k57 n ASP 36 Ca 0.14 -2.00 -0.00 0.00 -0.53 0.00 0.00 54.79 52.39 2k57 n ASP 36 Cb 0.46 -0.26 -0.00 0.00 -0.64 0.00 0.00 41.12 40.68 2k57 n ASP 36 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2k57 n GLY 37 N 0.26 0.44 3.57 0.44 0.00 0.15 -4.99 105.19 105.06 2k57 n GLY 37 Ca 0.00 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 2k57 n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k57 s LYS 38 N -0.48 3.44 -0.07 1.61 1.02 -1.23 -4.72 119.74 119.31 2k57 s LYS 38 Ca 0.00 0.09 -0.30 0.00 0.02 0.00 0.00 55.97 55.78 2k57 s LYS 38 Cb 0.00 -4.05 -0.03 0.00 -0.52 0.00 0.00 37.83 33.23 2k57 s LYS 38 CO 0.00 -1.73 1.28 -1.14 -0.92 0.00 0.00 175.35 172.84 2k57 s GLN 39 N 4.93 4.30 0.11 1.68 0.74 -1.26 -0.52 119.66 129.63 2k57 s GLN 39 Ca 0.40 1.76 0.02 0.00 0.05 0.00 0.00 55.36 57.59 2k57 s GLN 39 Cb -0.08 -3.63 -0.04 0.00 1.10 0.00 0.00 33.01 30.36 2k57 s GLN 39 CO 0.23 -0.55 -0.07 -0.08 -0.55 0.00 0.00 175.29 174.27 2k57 s THR 40 N 2.62 0.77 0.01 -0.34 -1.32 -0.81 -4.97 115.64 111.59 2k57 s THR 40 Ca 0.58 -1.96 0.03 0.00 -1.21 0.00 0.00 61.69 59.13 2k57 s THR 40 Cb -0.26 -1.73 -0.01 0.00 -1.51 0.00 0.00 72.50 68.99 2k57 s THR 40 CO 0.22 -0.84 -0.08 -0.13 -2.21 0.00 0.00 174.62 171.58 2k57 s ARG 41 N -3.82 0.63 0.03 7.08 0.52 -1.26 -2.60 118.95 119.53 2k57 s ARG 41 Ca 0.13 -0.39 -0.02 0.00 -0.52 0.00 0.00 55.73 54.93 2k57 s ARG 41 Cb 0.05 -0.58 -0.02 0.00 0.52 0.00 0.00 34.95 34.92 2k57 s ARG 41 CO -0.04 0.15 0.01 -1.50 0.02 0.00 0.00 175.30 173.95 2k57 s ILE 42 N -0.41 0.13 0.70 1.52 2.07 -1.18 -4.91 121.20 119.11 2k57 s ILE 42 Ca 0.01 -1.10 -0.15 0.00 -1.41 0.00 0.00 60.65 58.00 2k57 s ILE 42 Cb -0.04 -0.65 0.02 0.00 0.13 0.00 0.00 42.46 41.92 2k57 s ILE 42 CO -0.00 -0.60 1.19 0.21 -1.91 0.00 0.00 174.94 173.82 2k57 s ASN 43 N -1.87 4.48 0.29 4.50 2.47 -1.26 -0.95 114.94 122.60 2k57 s ASN 43 Ca -0.09 2.29 0.23 0.00 0.42 0.00 0.00 52.86 55.72 2k57 s ASN 43 Cb -0.04 -2.58 1.07 0.00 -1.45 0.00 0.00 41.25 38.25 2k57 s ASN 43 CO -0.03 -2.07 1.71 2.29 -3.72 0.00 0.00 177.10 175.28 2k57 n LYS 44 N -2.53 0.18 0.02 0.43 2.85 0.59 -1.73 118.16 117.97 2k57 n LYS 44 Ca 0.13 0.51 0.13 0.00 -1.05 0.00 0.00 58.31 58.03 2k57 n LYS 44 Cb 0.50 -1.92 0.39 0.00 -0.65 0.00 0.00 35.03 33.35 2k57 n LYS 44 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 2k57 n ASP 45 N -2.28 0.37 0.01 -5.58 5.75 -1.26 -3.86 116.55 109.70 2k57 n ASP 45 Ca 0.01 0.15 -0.04 0.00 -0.01 0.00 0.00 54.79 54.90 2k57 n ASP 45 Cb 0.16 -0.12 -0.11 0.00 -1.03 0.00 0.00 41.12 40.02 2k57 n ASP 45 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k57 n GLN 46 N -1.65 0.63 -2.11 0.11 1.13 -0.71 -4.76 117.38 110.02 2k57 n GLN 46 Ca 0.06 0.25 -0.43 0.00 -1.94 0.00 0.00 57.00 54.94 2k57 n GLN 46 Cb 0.36 -1.80 -0.02 0.00 0.11 0.00 0.00 30.24 28.89 2k57 n GLN 46 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2k57 s VAL 47 N -2.78 3.64 -0.08 5.09 0.11 -1.25 0.10 120.40 125.24 2k57 s VAL 47 Ca -0.04 0.68 -0.02 0.00 -2.93 0.00 0.00 61.98 59.67 2k57 s VAL 47 Cb 0.08 -3.79 -0.01 0.00 -1.53 0.00 0.00 36.38 31.14 2k57 s VAL 47 CO 0.82 -0.45 -0.04 -0.09 -3.33 0.00 0.00 175.10 172.01 2k57 h ARG 48 N 11.71 0.00 -3.55 1.54 2.43 -0.67 -3.46 114.38 122.37 2k57 h ARG 48 Ca -0.32 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 58.60 2k57 h ARG 48 Cb 1.15 0.00 -0.30 0.00 -0.42 0.00 0.00 29.97 30.40 2k57 h ARG 48 CO 1.03 0.00 -0.68 0.95 -1.51 0.00 0.00 179.97 179.76 2k57 s THR 49 N -1.55 -0.02 -0.22 0.20 -4.23 -1.10 -5.01 115.64 103.71 2k57 s THR 49 Ca -0.03 0.09 -0.08 0.00 -1.18 0.00 0.00 61.69 60.49 2k57 s THR 49 Cb 0.00 -0.09 -0.04 0.00 1.34 0.00 0.00 72.50 73.72 2k57 s THR 49 CO 0.05 0.04 0.08 -0.69 -0.54 0.00 0.00 174.62 173.55 2k57 s VAL 50 N 0.49 4.61 -0.02 2.29 1.01 -1.26 -1.87 120.40 125.66 2k57 s VAL 50 Ca -0.04 -0.08 -0.04 0.00 0.00 0.00 0.00 61.98 61.82 2k57 s VAL 50 Cb -0.06 -3.12 0.00 0.00 0.00 0.00 0.00 36.38 33.20 2k57 s VAL 50 CO -0.02 0.39 0.08 -0.54 0.00 0.00 0.00 175.10 175.01 2k57 s LYS 51 N 1.06 0.24 0.18 2.72 1.02 -1.03 -5.04 119.74 118.89 2k57 s LYS 51 Ca 0.04 -0.13 -0.20 0.00 0.02 0.00 0.00 55.97 55.70 2k57 s LYS 51 Cb -0.14 0.10 -0.08 0.00 -0.52 0.00 0.00 37.83 37.19 2k57 s LYS 51 CO 0.03 -0.04 0.70 -0.51 -0.92 0.00 0.00 175.35 174.61 2k57 s ASP 52 N -0.57 7.11 0.57 2.83 1.01 -1.26 0.11 116.67 126.47 2k57 s ASP 52 Ca -0.06 1.42 0.36 0.00 0.71 0.00 0.00 52.55 54.97 2k57 s ASP 52 Cb -0.04 -2.42 1.63 0.00 1.01 0.00 0.00 42.92 43.10 2k57 s ASP 52 CO 0.00 0.11 2.07 -0.07 0.21 0.00 0.00 175.17 177.50 2k57 h LEU 53 N 3.79 0.00 -0.04 1.23 3.38 -0.84 -2.03 115.31 120.79 2k57 h LEU 53 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2k57 h LEU 53 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2k57 h LEU 53 CO 0.65 0.00 -0.01 0.18 0.09 0.00 0.00 178.44 179.35 2k57 n LEU 54 N -3.06 0.08 0.00 1.67 4.77 -1.26 -5.10 117.00 114.10 2k57 n LEU 54 Ca -0.00 0.11 0.16 0.00 -0.03 0.00 0.00 56.01 56.24 2k57 n LEU 54 Cb 0.24 -0.14 0.93 0.00 -2.33 0.00 0.00 43.42 42.13 2k57 n LEU 54 CO 0.25 0.01 1.09 -0.62 -1.33 0.00 0.00 177.39 176.80