#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bjp s ILE 2 N 0.00 1.50 -0.10 0.52 1.01 -1.26 -1.96 121.20 120.91 1bjp s ILE 2 Ca 0.00 -0.72 0.04 0.00 0.00 0.00 0.00 60.65 59.97 1bjp s ILE 2 Cb 0.00 -1.31 0.00 0.00 0.01 0.00 0.00 42.46 41.17 1bjp s ILE 2 CO 0.00 0.43 -0.22 0.00 0.00 0.00 0.00 174.94 175.15 1bjp s ALA 3 N 0.30 2.07 -0.16 9.38 0.00 0.12 -4.99 121.76 128.49 1bjp s ALA 3 Ca -0.11 -0.92 -0.01 0.00 0.00 0.00 0.00 51.96 50.92 1bjp s ALA 3 Cb -0.14 -0.82 -0.01 0.00 0.00 0.00 0.00 23.12 22.15 1bjp s ALA 3 CO 0.04 0.21 -0.12 -1.14 0.00 0.00 0.00 175.76 174.75 1bjp s GLN 4 N 0.47 3.32 -0.15 0.00 0.74 -1.26 0.05 119.66 122.83 1bjp s GLN 4 Ca -0.16 -0.70 0.02 0.00 0.05 0.00 0.00 55.36 54.57 1bjp s GLN 4 Cb -0.17 -2.71 0.01 0.00 1.10 0.00 0.00 33.01 31.24 1bjp s GLN 4 CO 0.06 0.05 -0.21 0.42 -0.55 0.00 0.00 175.29 175.06 1bjp s ILE 5 N 0.77 2.08 -0.25 -2.34 1.01 0.17 -4.97 121.20 117.66 1bjp s ILE 5 Ca -0.05 -0.96 -0.14 0.00 0.00 0.00 0.00 60.65 59.50 1bjp s ILE 5 Cb -0.15 -1.84 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 1bjp s ILE 5 CO 0.01 0.55 0.32 -1.00 0.00 0.00 0.00 174.94 174.82 1bjp s HIS 6 N 0.93 3.28 0.09 3.97 3.76 -1.26 0.45 115.29 126.51 1bjp s HIS 6 Ca -0.04 0.39 0.02 0.00 -0.15 0.00 0.00 55.06 55.28 1bjp s HIS 6 Cb -0.15 -2.49 -0.04 0.00 1.11 0.00 0.00 32.58 31.01 1bjp s HIS 6 CO -0.05 -0.12 -0.07 0.96 -0.85 0.00 0.00 174.74 174.61 1bjp s ILE 7 N 1.70 0.69 0.52 0.60 -4.36 -0.67 -4.97 121.20 114.70 1bjp s ILE 7 Ca 0.14 -1.74 -0.20 0.00 -0.26 0.00 0.00 60.65 58.59 1bjp s ILE 7 Cb -0.15 -1.44 -0.07 0.00 1.25 0.00 0.00 42.46 42.05 1bjp s ILE 7 CO 0.09 -0.74 1.09 -0.76 0.24 0.00 0.00 174.94 174.86 1bjp s LEU 8 N -2.69 3.80 0.80 0.37 1.43 -1.26 -0.21 118.68 120.91 1bjp s LEU 8 Ca 0.07 2.07 -0.11 0.00 -1.03 0.00 0.00 54.13 55.13 1bjp s LEU 8 Cb 0.01 -4.57 0.08 0.00 0.03 0.00 0.00 46.19 41.75 1bjp s LEU 8 CO -0.03 -1.03 1.12 -1.83 0.23 0.00 0.00 176.35 174.81 1bjp s GLU 9 N -3.25 1.88 0.00 1.70 -1.05 0.46 -4.40 118.70 114.05 1bjp s GLU 9 Ca 0.70 1.38 0.00 0.00 -0.15 0.00 0.00 54.97 56.90 1bjp s GLU 9 Cb -0.21 -1.84 0.00 0.00 -0.44 0.00 0.00 34.13 31.64 1bjp s GLU 9 CO 0.24 -1.96 0.00 0.41 0.95 0.00 0.00 175.26 174.90 1bjp n GLY 10 N -0.51 2.25 3.66 -3.83 0.00 -1.26 -4.96 105.19 100.54 1bjp n GLY 10 Ca 0.11 -0.49 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 1bjp n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bjp n ARG 11 N 0.00 -0.41 -2.23 1.61 3.00 -1.26 -5.02 116.66 112.35 1bjp n ARG 11 Ca 0.00 -0.05 -0.26 0.00 -0.01 0.00 0.00 57.85 57.53 1bjp n ARG 11 Cb 0.00 -2.36 0.06 0.00 0.00 0.00 0.00 32.46 30.16 1bjp n ARG 11 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1bjp s SER 12 N -2.57 4.93 0.35 0.55 1.04 -1.26 -4.95 113.70 111.79 1bjp s SER 12 Ca 0.67 0.48 0.13 0.00 0.48 0.00 0.00 55.95 57.71 1bjp s SER 12 Cb -0.23 -1.18 0.63 0.00 0.10 0.00 0.00 66.02 65.34 1bjp s SER 12 CO 0.58 -1.52 1.76 0.44 0.98 0.00 0.00 173.24 175.48 1bjp h ASP 13 N -0.53 0.00 -0.24 7.02 3.32 -1.99 -2.48 116.42 121.52 1bjp h ASP 13 Ca -0.44 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.58 1bjp h ASP 13 Cb 1.31 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.85 1bjp h ASP 13 CO 0.60 0.44 0.03 -0.33 -1.72 0.00 0.00 179.24 178.26 1bjp h GLU 14 N 0.00 0.40 -0.83 3.56 3.07 -1.99 -0.57 114.58 118.23 1bjp h GLU 14 Ca -0.00 -0.11 -0.03 0.00 -0.50 0.00 0.00 59.36 58.71 1bjp h GLU 14 Cb 0.80 -0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 28.63 1bjp h GLU 14 CO 0.06 0.55 0.41 1.96 -1.40 0.00 0.00 179.01 180.58 1bjp h GLN 15 N 0.20 1.18 -0.34 2.33 4.20 -1.90 -0.94 115.11 119.84 1bjp h GLN 15 Ca 0.07 -0.16 -0.13 0.00 0.06 0.00 0.00 58.65 58.49 1bjp h GLN 15 Cb 0.35 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 1bjp h GLN 15 CO 0.01 0.90 -0.32 0.87 -0.67 0.00 0.00 178.83 179.62 1bjp h LYS 16 N 1.18 0.73 -0.60 1.46 1.57 -1.33 -0.07 116.57 119.50 1bjp h LYS 16 Ca 0.29 -0.34 -0.10 0.00 -1.87 0.00 0.00 60.65 58.63 1bjp h LYS 16 Cb 0.10 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 1bjp h LYS 16 CO -0.04 0.95 -0.03 1.49 -0.57 0.00 0.00 179.45 181.26 1bjp h GLU 17 N 0.62 1.08 -0.41 3.15 4.81 -0.85 -0.23 114.58 122.75 1bjp h GLU 17 Ca 0.07 -0.36 -0.12 0.00 -0.13 0.00 0.00 59.36 58.82 1bjp h GLU 17 Cb 0.84 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.12 1bjp h GLU 17 CO 0.07 1.06 -0.23 1.15 -0.73 0.00 0.00 179.01 180.33 1bjp h THR 18 N 0.98 1.28 -0.06 0.32 2.02 -0.93 -2.01 112.91 114.50 1bjp h THR 18 Ca 0.17 -1.38 0.02 0.00 0.77 0.00 0.00 66.41 65.99 1bjp h THR 18 Cb 0.59 1.29 -0.03 0.00 -1.74 0.00 0.00 68.15 68.26 1bjp h THR 18 CO 0.04 0.47 -0.08 0.25 0.37 0.00 0.00 175.52 176.56 1bjp h LEU 19 N 0.69 -0.25 -1.03 2.58 5.85 -0.67 0.37 115.31 122.85 1bjp h LEU 19 Ca 0.09 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.89 1bjp h LEU 19 Cb 0.80 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.89 1bjp h LEU 19 CO 0.07 -0.11 0.65 0.40 -0.34 0.00 0.00 178.44 179.10 1bjp h ILE 20 N -0.11 1.17 -0.03 4.05 2.04 -0.99 0.18 117.51 123.83 1bjp h ILE 20 Ca 0.05 -0.43 -0.04 0.00 1.00 0.00 0.00 64.86 65.45 1bjp h ILE 20 Cb 0.19 -0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1bjp h ILE 20 CO -0.13 0.23 -0.12 -0.09 0.00 0.00 0.00 178.15 178.04 1bjp h ARG 21 N 1.25 0.13 -0.53 2.37 2.43 -0.58 -2.53 114.38 116.91 1bjp h ARG 21 Ca 0.39 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.45 1bjp h ARG 21 Cb 0.00 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 1bjp h ARG 21 CO -0.12 0.75 0.30 0.93 -1.51 0.00 0.00 179.97 180.33 1bjp h GLU 22 N -0.46 0.74 -0.41 0.20 4.39 -0.14 -1.91 114.58 116.99 1bjp h GLU 22 Ca -0.01 -0.08 -0.13 0.00 0.34 0.00 0.00 59.36 59.48 1bjp h GLU 22 Cb 0.77 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.26 1bjp h GLU 22 CO 0.03 0.56 -0.27 0.28 -1.16 0.00 0.00 179.01 178.45 1bjp h VAL 23 N 0.72 1.27 -0.05 3.13 2.07 -1.06 -1.06 116.25 121.26 1bjp h VAL 23 Ca 0.19 -1.42 0.00 0.00 0.82 0.00 0.00 66.70 66.29 1bjp h VAL 23 Cb 0.03 1.24 -0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1bjp h VAL 23 CO -0.03 0.48 0.03 0.28 0.02 0.00 0.00 177.57 178.35 1bjp h SER 24 N 0.73 0.06 -0.84 0.57 0.02 -1.16 -0.30 113.55 112.63 1bjp h SER 24 Ca 0.09 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1bjp h SER 24 Cb 0.82 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 63.30 1bjp h SER 24 CO 0.07 0.04 0.48 -0.33 -1.14 0.00 0.00 176.83 175.95 1bjp h GLU 25 N 0.07 1.16 -0.52 3.45 4.39 -1.31 -0.77 114.58 121.04 1bjp h GLU 25 Ca 0.02 -0.12 0.00 0.00 0.34 0.00 0.00 59.36 59.60 1bjp h GLU 25 Cb -0.01 -0.23 -0.03 0.00 -0.10 0.00 0.00 28.75 28.38 1bjp h GLU 25 CO -0.00 0.84 0.34 0.00 -1.16 0.00 0.00 179.01 179.03 1bjp h ALA 26 N 1.26 0.66 -0.28 3.43 0.00 -0.64 -0.00 119.26 123.68 1bjp h ALA 26 Ca 0.30 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 1bjp h ALA 26 Cb 0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1bjp h ALA 26 CO -0.05 0.11 0.04 0.82 0.00 0.00 0.00 179.25 180.17 1bjp h ILE 27 N 0.71 1.24 -0.12 0.00 2.04 -0.75 -1.27 117.51 119.35 1bjp h ILE 27 Ca 0.19 -0.82 0.03 0.00 1.00 0.00 0.00 64.86 65.26 1bjp h ILE 27 Cb -0.07 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 1bjp h ILE 27 CO -0.04 0.26 -0.04 -1.28 0.00 0.00 0.00 178.15 177.05 1bjp h SER 28 N 0.28 -0.14 -0.13 1.72 0.87 -0.93 -0.32 113.55 114.90 1bjp h SER 28 Ca 0.08 0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.67 1bjp h SER 28 Cb 0.35 0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.40 1bjp h SER 28 CO 0.01 -0.05 0.01 0.03 -0.53 0.00 0.00 176.83 176.29 1bjp h ARG 29 N -0.02 0.22 -0.53 2.24 3.08 -1.01 0.74 114.38 119.10 1bjp h ARG 29 Ca 0.06 -0.06 0.05 0.00 0.07 0.00 0.00 59.98 60.10 1bjp h ARG 29 Cb 0.11 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.09 1bjp h ARG 29 CO -0.13 0.43 0.26 0.77 -1.07 0.00 0.00 179.97 180.23 1bjp h SER 30 N -0.02 0.36 0.11 7.04 0.02 -1.11 -2.96 113.55 116.98 1bjp h SER 30 Ca 0.04 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1bjp h SER 30 Cb 0.33 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1bjp h SER 30 CO 0.00 0.25 -0.79 0.18 -1.14 0.00 0.00 176.83 175.33 1bjp n LEU 31 N -4.89 1.06 -3.28 5.07 4.77 -0.14 -4.99 117.00 114.59 1bjp n LEU 31 Ca 0.05 -0.43 -0.16 0.00 -0.03 0.00 0.00 56.01 55.45 1bjp n LEU 31 Cb 0.15 -0.05 0.08 0.00 -2.33 0.00 0.00 43.42 41.27 1bjp n LEU 31 CO 0.28 0.24 0.07 -0.67 -1.33 0.00 0.00 177.39 175.98 1bjp n ASP 32 N -1.24 -4.43 -4.40 -1.43 -0.08 0.14 -5.02 116.55 100.11 1bjp n ASP 32 Ca 0.05 -0.65 -0.28 0.00 -1.51 0.00 0.00 54.79 52.41 1bjp n ASP 32 Cb 0.35 -5.05 -0.12 0.00 2.34 0.00 0.00 41.12 38.64 1bjp n ASP 32 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1bjp s ALA 33 N -3.37 2.40 0.12 -1.67 0.00 -0.54 -5.04 121.76 113.66 1bjp s ALA 33 Ca 0.24 -1.52 -0.31 0.00 0.00 0.00 0.00 51.96 50.36 1bjp s ALA 33 Cb -0.03 -0.35 -0.10 0.00 0.00 0.00 0.00 23.12 22.64 1bjp s ALA 33 CO 0.72 0.48 1.70 -1.25 0.00 0.00 0.00 175.76 177.41 1bjp s PRO 34 N -2.30 4.17 0.56 0.00 0.04 -1.26 -4.62 135.00 131.59 1bjp s PRO 34 Ca 0.16 2.45 0.31 0.00 0.04 0.00 0.00 61.00 63.96 1bjp s PRO 34 Cb -0.09 -3.46 1.47 0.00 0.04 0.00 0.00 34.50 32.46 1bjp s PRO 34 CO 0.07 -0.75 1.87 1.25 0.04 0.00 0.00 177.00 179.49 1bjp h LEU 35 N 8.06 0.00 -0.59 -3.56 5.85 -1.93 -0.44 115.31 122.70 1bjp h LEU 35 Ca -0.44 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.28 1bjp h LEU 35 Cb 1.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1bjp h LEU 35 CO 0.94 0.00 0.00 0.35 -0.34 0.00 0.00 178.44 179.39 1bjp n THR 36 N -4.06 0.81 1.20 1.05 -2.24 -1.26 -2.59 114.28 107.18 1bjp n THR 36 Ca 0.16 0.18 0.13 0.00 -2.27 0.00 0.00 64.05 62.24 1bjp n THR 36 Cb 0.89 -1.09 0.29 0.00 -2.10 0.00 0.00 70.33 68.32 1bjp n THR 36 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1bjp n SER 37 N -2.19 1.34 -4.66 3.42 3.41 -0.17 -4.91 113.62 109.85 1bjp n SER 37 Ca 0.03 -1.11 -0.41 0.00 -0.26 0.00 0.00 58.87 57.12 1bjp n SER 37 Cb 0.25 0.21 -0.05 0.00 -0.26 0.00 0.00 64.21 64.35 1bjp n SER 37 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1bjp s VAL 38 N -2.45 4.95 -0.09 -3.33 1.01 -1.07 -3.88 120.40 115.53 1bjp s VAL 38 Ca 0.24 1.40 0.02 0.00 0.00 0.00 0.00 61.98 63.63 1bjp s VAL 38 Cb 0.19 -4.04 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 1bjp s VAL 38 CO 0.52 0.06 -0.13 -0.13 0.00 0.00 0.00 175.10 175.41 1bjp s ARG 39 N 2.08 2.98 -0.08 2.72 0.52 -0.83 -5.04 118.95 121.30 1bjp s ARG 39 Ca 0.33 -0.69 0.02 0.00 -0.52 0.00 0.00 55.73 54.88 1bjp s ARG 39 Cb -0.16 -2.52 0.01 0.00 0.52 0.00 0.00 34.95 32.80 1bjp s ARG 39 CO 0.11 0.41 -0.14 0.08 0.02 0.00 0.00 175.30 175.78 1bjp s VAL 40 N -0.16 1.28 -0.14 3.52 1.01 -1.26 -0.70 120.40 123.95 1bjp s VAL 40 Ca -0.00 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.43 1bjp s VAL 40 Cb -0.13 -1.17 -0.01 0.00 0.00 0.00 0.00 36.38 35.07 1bjp s VAL 40 CO 0.03 0.39 -0.14 -0.63 0.00 0.00 0.00 175.10 174.75 1bjp s ILE 41 N 0.74 2.85 -0.28 2.22 1.01 0.11 -4.98 121.20 122.86 1bjp s ILE 41 Ca -0.13 -0.72 -0.08 0.00 0.00 0.00 0.00 60.65 59.72 1bjp s ILE 41 Cb -0.16 -2.19 -0.01 0.00 0.01 0.00 0.00 42.46 40.11 1bjp s ILE 41 CO 0.03 0.52 0.10 -0.63 0.00 0.00 0.00 174.94 174.96 1bjp s ILE 42 N 0.55 4.27 -0.25 2.92 1.01 -1.26 0.42 121.20 128.86 1bjp s ILE 42 Ca -0.09 -0.44 -0.06 0.00 0.00 0.00 0.00 60.65 60.06 1bjp s ILE 42 Cb -0.16 -3.12 -0.02 0.00 0.01 0.00 0.00 42.46 39.17 1bjp s ILE 42 CO 0.04 0.17 0.04 -0.89 0.00 0.00 0.00 174.94 174.29 1bjp s THR 43 N 1.57 3.97 0.02 2.92 2.01 0.17 -4.94 115.64 121.36 1bjp s THR 43 Ca 0.05 -0.35 -0.21 0.00 0.31 0.00 0.00 61.69 61.49 1bjp s THR 43 Cb -0.16 -2.87 -0.06 0.00 0.01 0.00 0.00 72.50 69.42 1bjp s THR 43 CO 0.04 0.32 0.60 -1.61 -0.69 0.00 0.00 174.62 173.28 1bjp s GLU 44 N 1.56 4.31 -0.13 4.92 2.02 -1.26 -1.67 118.70 128.44 1bjp s GLU 44 Ca 0.06 0.75 -0.02 0.00 0.02 0.00 0.00 54.97 55.78 1bjp s GLU 44 Cb -0.15 -3.32 -0.03 0.00 0.10 0.00 0.00 34.13 30.73 1bjp s GLU 44 CO 0.01 0.42 -0.05 -1.64 0.02 0.00 0.00 175.26 174.03 1bjp s MET 45 N -0.38 3.37 0.36 1.61 -1.94 0.70 -4.89 119.30 118.14 1bjp s MET 45 Ca 0.31 -0.52 -0.27 0.00 -1.71 0.00 0.00 55.69 53.50 1bjp s MET 45 Cb -0.19 -2.81 -0.09 0.00 2.01 0.00 0.00 34.83 33.75 1bjp s MET 45 CO 0.18 0.39 1.19 0.00 -0.01 0.00 0.00 175.02 176.77 1bjp s ALA 46 N -0.05 3.30 0.59 3.03 0.00 -1.26 -0.40 121.76 126.97 1bjp s ALA 46 Ca 0.01 1.03 0.29 0.00 0.00 0.00 0.00 51.96 53.28 1bjp s ALA 46 Cb -0.13 -3.39 1.54 0.00 0.00 0.00 0.00 23.12 21.13 1bjp s ALA 46 CO 0.03 -0.48 1.96 0.87 0.00 0.00 0.00 175.76 178.14 1bjp h LYS 47 N 3.08 0.00 -0.01 0.00 1.57 -1.93 0.21 116.57 119.49 1bjp h LYS 47 Ca -0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1bjp h LYS 47 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1bjp h LYS 47 CO 0.64 0.00 -0.05 0.41 -0.57 0.00 0.00 179.45 179.88 1bjp n GLY 48 N -1.46 -0.51 0.43 3.86 0.00 -1.26 -2.78 105.19 103.48 1bjp n GLY 48 Ca 0.06 -0.34 0.04 0.00 0.00 0.00 0.00 46.02 45.78 1bjp n GLY 48 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1bjp n HIS 49 N -0.44 0.20 -4.84 1.61 8.25 0.73 -4.93 115.22 115.81 1bjp n HIS 49 Ca 0.19 -0.28 -0.30 0.00 -0.26 0.00 0.00 57.72 57.07 1bjp n HIS 49 Cb 0.28 -0.02 -0.17 0.00 1.12 0.00 0.00 29.99 31.20 1bjp n HIS 49 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1bjp s PHE 50 N -0.88 2.22 0.03 4.41 5.36 -1.19 -4.92 117.98 123.01 1bjp s PHE 50 Ca 0.15 -0.96 0.07 0.00 -0.96 0.00 0.00 56.93 55.22 1bjp s PHE 50 Cb 0.08 -1.53 -0.02 0.00 -0.34 0.00 0.00 43.02 41.21 1bjp s PHE 50 CO 0.12 -0.43 -0.20 0.20 -1.46 0.00 0.00 175.22 173.44 1bjp s GLY 51 N 0.62 1.08 -0.08 13.12 0.00 -1.26 0.08 107.32 120.88 1bjp s GLY 51 Ca -0.13 -1.01 0.01 0.00 0.00 0.00 0.00 44.72 43.59 1bjp s GLY 51 CO 0.04 -0.92 -0.11 -0.42 0.00 0.00 0.00 173.10 171.69 1bjp s ILE 52 N -0.73 1.09 -1.81 0.90 1.09 -0.46 -4.73 121.20 116.56 1bjp s ILE 52 Ca 0.07 -0.41 0.00 0.00 -1.10 0.00 0.00 60.65 59.21 1bjp s ILE 52 Cb -0.09 -1.03 0.00 0.00 -1.06 0.00 0.00 42.46 40.29 1bjp s ILE 52 CO 0.01 0.35 0.00 0.61 -0.10 0.00 0.00 174.94 175.82 1bjp n GLY 53 N 4.16 0.37 1.47 6.18 0.00 -1.26 -2.01 105.19 114.10 1bjp n GLY 53 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1bjp n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bjp n GLY 54 N -0.75 1.33 3.67 -0.02 0.00 -1.26 -5.05 105.19 103.11 1bjp n GLY 54 Ca -0.22 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.54 1bjp n GLY 54 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bjp s GLU 55 N -0.51 2.43 0.57 1.61 2.02 -0.85 -5.04 118.70 118.94 1bjp s GLU 55 Ca 0.00 -1.12 -0.19 0.00 0.02 0.00 0.00 54.97 53.68 1bjp s GLU 55 Cb 0.00 -2.36 -0.04 0.00 0.10 0.00 0.00 34.13 31.83 1bjp s GLU 55 CO 0.00 0.45 1.14 -0.51 0.02 0.00 0.00 175.26 176.36 1bjp s LEU 56 N -3.04 3.67 0.47 1.80 1.43 -1.26 -1.35 118.68 120.40 1bjp s LEU 56 Ca 0.28 2.18 0.22 0.00 -1.03 0.00 0.00 54.13 55.78 1bjp s LEU 56 Cb -0.09 -4.58 1.15 0.00 0.03 0.00 0.00 46.19 42.71 1bjp s LEU 56 CO 0.19 -1.36 1.97 0.00 0.23 0.00 0.00 176.35 177.38 1bjp h ALA 57 N 0.94 1.32 -0.60 4.21 0.00 -0.18 0.20 119.26 125.14 1bjp h ALA 57 Ca -0.50 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.22 1bjp h ALA 57 Cb 1.27 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 1bjp h ALA 57 CO 0.56 0.25 0.33 0.66 0.00 0.00 0.00 179.25 181.05 1bjp h SER 58 N 0.00 0.73 0.00 0.00 4.64 -1.78 -3.32 113.55 113.82 1bjp h SER 58 Ca -0.00 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1bjp h SER 58 Cb 0.47 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1bjp h SER 58 CO 0.03 0.59 -0.05 0.11 -0.87 0.00 0.00 176.83 176.63 1bjp h LYS 59 N 0.83 0.00 0.00 4.77 1.57 -1.57 -3.52 116.57 118.65 1bjp h LYS 59 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1bjp h LYS 59 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1bjp h LYS 59 CO -0.04 0.00 0.00 1.55 -0.57 0.00 0.00 179.45 180.39