#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v32 n SER 2 N 0.00 -5.42 -3.21 1.61 7.64 -1.26 -5.06 113.62 107.92 1v32 n SER 2 Ca 0.00 1.24 0.01 0.00 1.01 0.00 0.00 58.87 61.12 1v32 n SER 2 Cb 0.00 -4.07 -0.01 0.00 -1.01 0.00 0.00 64.21 59.12 1v32 n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1v32 s SER 3 N -0.45 -1.41 0.00 6.43 0.01 -1.26 -5.12 113.70 111.90 1v32 s SER 3 Ca -0.07 -0.67 0.00 0.00 1.31 0.00 0.00 55.95 56.52 1v32 s SER 3 Cb 0.00 1.91 0.00 0.00 0.21 0.00 0.00 66.02 68.14 1v32 s SER 3 CO 0.18 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.24 1v32 n GLY 4 N 4.57 4.01 3.15 3.44 0.00 -1.26 -5.14 105.19 113.95 1v32 n GLY 4 Ca 0.10 -1.33 0.05 0.00 0.00 0.00 0.00 46.02 44.84 1v32 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1v32 s SER 5 N 0.00 -0.73 0.00 1.61 1.04 -1.26 -5.17 113.70 109.19 1v32 s SER 5 Ca 0.00 0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.85 1v32 s SER 5 Cb 0.00 1.60 0.00 0.00 0.10 0.00 0.00 66.02 67.72 1v32 s SER 5 CO 0.00 -0.14 0.00 -1.20 0.98 0.00 0.00 173.24 172.88 1v32 n SER 6 N 5.44 0.00 -3.60 7.02 7.64 -1.26 -5.17 113.62 123.69 1v32 n SER 6 Ca -0.04 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.82 1v32 n SER 6 Cb 0.53 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.67 1v32 n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1v32 s GLY 7 N 0.00 -0.05 0.02 0.23 0.00 -1.26 -5.17 107.32 101.09 1v32 s GLY 7 Ca 0.00 3.11 0.02 0.00 0.00 0.00 0.00 44.72 47.85 1v32 s GLY 7 CO 0.00 2.71 -0.07 1.25 0.00 0.00 0.00 173.10 176.99 1v32 s LYS 8 N 1.56 0.50 -0.40 2.90 2.36 -1.26 -5.11 119.74 120.28 1v32 s LYS 8 Ca -0.08 -0.52 -0.29 0.00 -2.55 0.00 0.00 55.97 52.53 1v32 s LYS 8 Cb -0.04 -0.36 0.02 0.00 -1.05 0.00 0.00 37.83 36.40 1v32 s LYS 8 CO -0.15 0.08 1.09 1.03 1.55 0.00 0.00 175.35 178.94 1v32 s ARG 9 N -0.96 3.87 0.33 4.03 0.52 -1.26 -5.00 118.95 120.48 1v32 s ARG 9 Ca -0.05 0.76 0.03 0.00 -0.52 0.00 0.00 55.73 55.95 1v32 s ARG 9 Cb -0.07 -3.83 -0.05 0.00 0.52 0.00 0.00 34.95 31.52 1v32 s ARG 9 CO 0.00 -1.15 0.09 0.12 0.02 0.00 0.00 175.30 174.39 1v32 s PHE 10 N 4.02 1.82 0.51 -0.53 5.36 -1.26 -5.12 117.98 122.78 1v32 s PHE 10 Ca 0.46 -1.11 -0.19 0.00 -0.96 0.00 0.00 56.93 55.13 1v32 s PHE 10 Cb -0.10 -1.16 -0.12 0.00 -0.34 0.00 0.00 43.02 41.31 1v32 s PHE 10 CO 0.24 -0.16 0.33 0.39 -1.46 0.00 0.00 175.22 174.55 1v32 n GLU 11 N -0.70 0.36 -0.67 10.12 4.71 -1.26 -4.63 120.64 128.57 1v32 n GLU 11 Ca -0.03 0.14 0.09 0.00 -0.01 0.00 0.00 57.16 57.35 1v32 n GLU 11 Cb 0.66 -1.44 -0.02 0.00 -1.01 0.00 0.00 31.44 29.63 1v32 n GLU 11 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1v32 n PHE 12 N -1.44 -2.69 -3.49 -0.32 3.01 -1.26 -4.62 117.46 106.65 1v32 n PHE 12 Ca 0.11 0.84 -0.27 0.00 1.01 0.00 0.00 57.45 59.14 1v32 n PHE 12 Cb 0.45 -1.44 -0.10 0.00 -0.01 0.00 0.00 39.48 38.39 1v32 n PHE 12 CO 0.00 0.00 0.00 1.55 1.01 0.00 0.00 176.76 179.32 1v32 n VAL 13 N -2.75 0.26 0.00 -4.37 3.14 -1.06 -4.94 118.33 108.62 1v32 n VAL 13 Ca 0.00 -4.24 0.00 0.00 -2.96 0.00 0.00 64.34 57.14 1v32 n VAL 13 Cb 0.31 -1.94 0.00 0.00 -1.06 0.00 0.00 33.84 31.15 1v32 n VAL 13 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1v32 n GLY 14 N 1.95 0.78 0.05 7.55 0.00 -1.26 -4.41 105.19 109.85 1v32 n GLY 14 Ca 0.25 -1.11 -0.03 0.00 0.00 0.00 0.00 46.02 45.13 1v32 n GLY 14 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1v32 n TRP 15 N 0.00 0.00 -4.48 1.61 4.27 -1.26 -5.02 117.44 112.56 1v32 n TRP 15 Ca 0.00 0.00 -0.28 0.00 -3.89 0.00 0.00 57.50 53.33 1v32 n TRP 15 Cb 0.00 -0.54 -0.09 0.00 -1.36 0.00 0.00 31.31 29.32 1v32 n TRP 15 CO 0.00 0.00 0.00 0.20 -2.29 0.00 0.00 177.69 175.60 1v32 s GLY 16 N -4.29 2.52 0.64 -1.67 0.00 -1.26 -0.82 107.32 102.44 1v32 s GLY 16 Ca -0.06 -1.97 -0.13 0.00 0.00 0.00 0.00 44.72 42.56 1v32 s GLY 16 CO 0.52 -2.06 1.05 -0.45 0.00 0.00 0.00 173.10 172.16 1v32 s SER 17 N -3.80 5.67 0.18 1.64 0.15 0.25 -2.55 113.70 115.24 1v32 s SER 17 Ca 0.33 1.68 -0.16 0.00 0.70 0.00 0.00 55.95 58.50 1v32 s SER 17 Cb 0.07 -2.51 0.14 0.00 -1.71 0.00 0.00 66.02 62.01 1v32 s SER 17 CO 0.17 -1.24 1.65 -0.09 1.20 0.00 0.00 173.24 174.94 1v32 h ARG 18 N -0.13 0.00 -0.83 5.44 2.43 -1.90 0.58 114.38 119.97 1v32 h ARG 18 Ca -0.45 -0.00 0.13 0.00 -0.81 0.00 0.00 59.98 58.85 1v32 h ARG 18 Cb 1.21 -0.00 -0.14 0.00 -0.42 0.00 0.00 29.97 30.62 1v32 h ARG 18 CO 0.58 0.00 -0.39 1.96 -1.51 0.00 0.00 179.97 180.61 1v32 h GLN 19 N 0.00 -0.07 0.22 0.20 4.20 -1.90 1.48 115.11 119.24 1v32 h GLN 19 Ca 0.23 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.93 1v32 h GLN 19 Cb 0.35 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1v32 h GLN 19 CO -0.49 -0.05 -0.11 1.25 -0.67 0.00 0.00 178.83 178.77 1v32 h LEU 20 N -0.07 -0.25 0.00 1.46 5.85 -1.56 -2.49 115.31 118.24 1v32 h LEU 20 Ca 0.28 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1v32 h LEU 20 Cb 0.57 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.66 1v32 h LEU 20 CO -0.86 0.19 0.00 -0.38 -0.34 0.00 0.00 178.44 177.05 1v32 n ILE 21 N -5.02 0.00 -0.37 4.05 2.08 0.19 -0.39 119.36 119.90 1v32 n ILE 21 Ca -0.09 1.48 -0.10 0.00 0.56 0.00 0.00 62.75 64.60 1v32 n ILE 21 Cb 0.26 -2.13 -0.09 0.00 -0.75 0.00 0.00 39.64 36.93 1v32 n ILE 21 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 1v32 n GLU 22 N -2.59 -0.39 -0.34 0.38 2.13 0.50 0.16 120.64 120.48 1v32 n GLU 22 Ca 0.00 1.40 0.23 0.00 0.66 0.00 0.00 57.16 59.44 1v32 n GLU 22 Cb 0.00 -2.05 0.46 0.00 0.27 0.00 0.00 31.44 30.12 1v32 n GLU 22 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 1v32 h PHE 23 N 0.00 0.92 -0.00 4.31 3.57 -0.92 1.48 116.94 126.30 1v32 h PHE 23 Ca 0.14 0.04 -0.18 0.00 3.53 0.00 0.00 57.97 61.50 1v32 h PHE 23 Cb 0.36 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 1v32 h PHE 23 CO -0.97 -0.10 -0.82 -0.07 -2.23 0.00 0.00 178.31 174.12 1v32 h LEU 24 N 0.39 0.18 -0.75 0.59 3.38 0.45 -2.17 115.31 117.38 1v32 h LEU 24 Ca 0.71 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 58.43 1v32 h LEU 24 Cb 1.59 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.27 1v32 h LEU 24 CO -0.55 0.92 -0.22 0.45 0.09 0.00 0.00 178.44 179.14 1v32 h HIS 25 N 0.08 0.81 0.34 1.13 3.86 0.85 1.20 115.15 123.42 1v32 h HIS 25 Ca -0.03 -0.18 -0.02 0.00 -1.16 0.00 0.00 60.37 58.99 1v32 h HIS 25 Cb 1.43 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 29.71 1v32 h HIS 25 CO 0.02 0.87 -0.16 0.77 0.86 0.00 0.00 177.93 180.29 1v32 h SER 26 N 0.63 -0.38 -1.87 2.45 0.02 0.01 -3.06 113.55 111.35 1v32 h SER 26 Ca 0.09 0.01 0.55 0.00 -0.84 0.00 0.00 61.79 61.60 1v32 h SER 26 Cb 0.71 0.10 -0.08 0.00 0.14 0.00 0.00 62.40 63.26 1v32 h SER 26 CO 0.05 -0.12 1.34 -0.07 -1.14 0.00 0.00 176.83 176.89 1v32 h LEU 27 N -0.77 0.02 0.00 5.07 3.38 -1.45 -3.42 115.31 118.14 1v32 h LEU 27 Ca -0.05 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1v32 h LEU 27 Cb 0.35 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1v32 h LEU 27 CO 0.08 -0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.19 1v32 n GLY 28 N -1.88 1.50 3.72 0.83 0.00 -0.99 -5.09 105.19 103.28 1v32 n GLY 28 Ca 0.43 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.04 1v32 n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v32 s LYS 29 N -0.09 4.52 -1.03 1.61 -0.14 0.41 -4.98 119.74 120.04 1v32 s LYS 29 Ca 0.00 1.16 -0.20 0.00 -1.36 0.00 0.00 55.97 55.57 1v32 s LYS 29 Cb 0.00 -3.43 0.09 0.00 -1.68 0.00 0.00 37.83 32.82 1v32 s LYS 29 CO 0.00 0.09 1.36 0.34 -0.76 0.00 0.00 175.35 176.38 1v32 s ASP 30 N 0.60 6.63 -0.83 2.83 -1.08 -1.26 -4.10 116.67 119.45 1v32 s ASP 30 Ca 0.43 -1.90 -0.05 0.00 -0.52 0.00 0.00 52.55 50.51 1v32 s ASP 30 Cb -0.20 -2.49 -0.05 0.00 -1.46 0.00 0.00 42.92 38.72 1v32 s ASP 30 CO 0.24 -1.25 2.01 0.35 0.52 0.00 0.00 175.17 177.04 1v32 n THR 31 N 6.13 2.21 -0.07 1.71 -2.24 -1.26 -4.30 114.28 116.45 1v32 n THR 31 Ca 0.31 -1.32 -0.08 0.00 -2.27 0.00 0.00 64.05 60.69 1v32 n THR 31 Cb 0.49 -2.08 -0.05 0.00 -2.10 0.00 0.00 70.33 66.60 1v32 n THR 31 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1v32 h SER 32 N 6.48 0.00 -3.77 3.42 0.02 -2.03 -3.48 113.55 114.20 1v32 h SER 32 Ca 0.45 -0.22 -0.68 0.00 -0.84 0.00 0.00 61.79 60.50 1v32 h SER 32 Cb 0.15 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 62.50 1v32 h SER 32 CO 1.41 0.87 -0.77 -1.83 -1.14 0.00 0.00 176.83 175.37 1v32 s GLU 33 N -2.08 2.17 -0.90 3.45 -1.05 -1.26 -5.00 118.70 114.02 1v32 s GLU 33 Ca -0.14 -0.95 -0.20 0.00 -0.15 0.00 0.00 54.97 53.52 1v32 s GLU 33 Cb 0.02 -2.28 -0.24 0.00 -0.44 0.00 0.00 34.13 31.19 1v32 s GLU 33 CO 0.29 0.54 2.25 -0.12 0.95 0.00 0.00 175.26 179.17 1v32 n MET 34 N 1.29 0.00 -2.15 -4.83 0.00 -1.26 -4.77 117.12 105.39 1v32 n MET 34 Ca -0.15 0.00 -0.42 0.00 -0.00 0.00 0.00 57.70 57.12 1v32 n MET 34 Cb 0.52 -1.18 -0.03 0.00 0.00 0.00 0.00 33.22 32.54 1v32 n MET 34 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 1v32 s ILE 35 N 4.94 3.82 0.44 1.12 1.01 -1.26 -4.94 121.20 126.34 1v32 s ILE 35 Ca 1.22 1.00 -0.22 0.00 0.00 0.00 0.00 60.65 62.64 1v32 s ILE 35 Cb -0.99 -3.64 -0.11 0.00 0.01 0.00 0.00 42.46 37.72 1v32 s ILE 35 CO 0.47 -0.09 0.75 -1.20 0.00 0.00 0.00 174.94 174.87 1v32 n SER 36 N 6.92 0.01 -0.31 3.58 7.64 -1.26 -4.75 113.62 125.45 1v32 n SER 36 Ca 0.16 0.94 0.05 0.00 1.01 0.00 0.00 58.87 61.02 1v32 n SER 36 Cb 0.43 -1.22 0.20 0.00 -1.01 0.00 0.00 64.21 62.61 1v32 n SER 36 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1v32 h ARG 37 N 1.00 0.77 -0.90 1.43 2.43 -1.94 -0.37 114.38 116.80 1v32 h ARG 37 Ca -0.43 -0.05 0.06 0.00 -0.81 0.00 0.00 59.98 58.75 1v32 h ARG 37 Cb 1.37 -0.17 -0.06 0.00 -0.42 0.00 0.00 29.97 30.69 1v32 h ARG 37 CO 0.53 0.51 0.57 -0.92 -1.51 0.00 0.00 179.97 179.15 1v32 h TYR 38 N 0.80 1.06 0.49 2.20 5.03 -1.97 0.14 116.97 124.72 1v32 h TYR 38 Ca 0.43 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.75 1v32 h TYR 38 Cb 0.46 -0.35 -0.01 0.00 1.55 0.00 0.00 36.73 38.38 1v32 h TYR 38 CO -0.06 0.56 -0.39 -0.44 -1.32 0.00 0.00 178.16 176.51 1v32 h ASP 39 N 1.05 -1.04 0.23 -2.11 5.19 -1.40 0.81 116.42 119.15 1v32 h ASP 39 Ca 0.39 0.07 0.01 0.00 -0.62 0.00 0.00 57.03 56.88 1v32 h ASP 39 Cb 0.14 0.33 -0.04 0.00 0.18 0.00 0.00 39.33 39.94 1v32 h ASP 39 CO -0.16 -0.55 -0.52 0.58 -3.12 0.00 0.00 179.24 175.46 1v32 h VAL 40 N -0.86 0.01 -0.30 -1.35 2.07 -1.22 0.20 116.25 114.80 1v32 h VAL 40 Ca -0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.49 1v32 h VAL 40 Cb 0.72 0.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.44 1v32 h VAL 40 CO 0.01 0.00 -0.45 0.77 0.02 0.00 0.00 177.57 177.91 1v32 h SER 41 N -0.82 -1.50 -0.76 0.57 4.64 -0.65 0.44 113.55 115.46 1v32 h SER 41 Ca -0.02 0.19 0.16 0.00 -0.47 0.00 0.00 61.79 61.65 1v32 h SER 41 Cb 0.79 0.61 -0.14 0.00 -0.31 0.00 0.00 62.40 63.35 1v32 h SER 41 CO -0.22 -0.34 -0.15 -0.78 -0.87 0.00 0.00 176.83 174.47 1v32 h ASP 42 N -0.34 -0.63 -0.87 4.97 1.82 0.97 1.10 116.42 123.44 1v32 h ASP 42 Ca 0.05 0.22 0.06 0.00 -0.39 0.00 0.00 57.03 56.98 1v32 h ASP 42 Cb 0.49 0.44 -0.06 0.00 0.68 0.00 0.00 39.33 40.89 1v32 h ASP 42 CO -0.47 -0.24 0.56 0.74 -1.61 0.00 0.00 179.24 178.23 1v32 h THR 43 N 0.02 1.06 -0.03 2.25 2.02 0.17 0.33 112.91 118.73 1v32 h THR 43 Ca 0.38 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 67.22 1v32 h THR 43 Cb 0.60 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.01 1v32 h THR 43 CO -0.76 0.18 -0.00 0.40 0.37 0.00 0.00 175.52 175.71 1v32 h ILE 44 N 0.97 1.28 -1.00 3.11 2.04 0.53 0.36 117.51 124.81 1v32 h ILE 44 Ca 0.37 -0.85 0.13 0.00 1.00 0.00 0.00 64.86 65.52 1v32 h ILE 44 Cb 0.20 1.80 -0.09 0.00 -0.74 0.00 0.00 36.82 38.00 1v32 h ILE 44 CO -0.13 0.23 0.63 0.00 0.00 0.00 0.00 178.15 178.87 1v32 h ALA 45 N 0.66 1.57 0.12 1.87 0.00 0.57 0.80 119.26 124.85 1v32 h ALA 45 Ca 0.01 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1v32 h ALA 45 Cb 0.37 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1v32 h ALA 45 CO 0.00 0.16 -0.06 -0.22 0.00 0.00 0.00 179.25 179.13 1v32 h LYS 46 N 0.94 -0.16 -0.48 0.00 3.64 -0.73 -3.00 116.57 116.78 1v32 h LYS 46 Ca 0.51 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.98 1v32 h LYS 46 Cb 0.57 0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.36 1v32 h LYS 46 CO -0.28 0.28 0.10 -0.92 -2.27 0.00 0.00 179.45 176.36 1v32 h TYR 47 N -0.69 0.16 -0.42 1.91 3.20 0.62 0.75 116.97 122.50 1v32 h TYR 47 Ca -0.02 0.03 0.08 0.00 3.14 0.00 0.00 58.73 61.96 1v32 h TYR 47 Cb 0.52 0.00 -0.09 0.00 1.54 0.00 0.00 36.73 38.70 1v32 h TYR 47 CO 0.08 0.00 -0.39 0.82 -1.64 0.00 0.00 178.16 177.03 1v32 h ILE 48 N 0.23 0.15 -0.51 1.81 2.04 0.55 0.17 117.51 121.96 1v32 h ILE 48 Ca 0.24 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.99 1v32 h ILE 48 Cb 0.31 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 1v32 h ILE 48 CO -0.31 0.00 -0.10 -1.28 0.00 0.00 0.00 178.15 176.46 1v32 h SER 49 N -0.29 0.93 -0.18 1.72 0.87 -1.23 1.22 113.55 116.58 1v32 h SER 49 Ca 0.16 -0.29 0.03 0.00 -1.23 0.00 0.00 61.79 60.46 1v32 h SER 49 Cb 0.57 -0.25 -0.06 0.00 -0.44 0.00 0.00 62.40 62.22 1v32 h SER 49 CO -0.57 1.04 -0.49 0.50 -0.53 0.00 0.00 176.83 176.78 1v32 h LYS 50 N 0.84 -0.46 0.05 2.24 1.63 0.28 -3.15 116.57 118.00 1v32 h LYS 50 Ca 0.14 0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.97 1v32 h LYS 50 Cb 0.63 0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.36 1v32 h LYS 50 CO 0.04 -0.31 -0.03 0.93 -3.45 0.00 0.00 179.45 176.64 1v32 h GLU 51 N -0.48 -0.07 0.00 1.90 4.39 -0.75 -3.49 114.58 116.08 1v32 h GLU 51 Ca 0.04 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.74 1v32 h GLU 51 Cb 0.59 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1v32 h GLU 51 CO -0.43 0.45 0.00 0.41 -1.16 0.00 0.00 179.01 178.28 1v32 n GLY 52 N 1.33 0.86 0.22 -3.84 0.00 0.39 -5.03 105.19 99.12 1v32 n GLY 52 Ca -0.06 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.07 1v32 n GLY 52 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1v32 h LEU 53 N 0.00 0.00 -9.25 0.99 4.07 -0.78 -3.46 115.31 106.89 1v32 h LEU 53 Ca 0.00 0.00 -0.51 0.00 0.08 0.00 0.00 57.88 57.45 1v32 h LEU 53 Cb 0.00 0.00 0.24 0.00 1.08 0.00 0.00 40.66 41.98 1v32 h LEU 53 CO 0.00 0.15 -1.86 0.18 -1.08 0.00 0.00 178.44 175.84 1v32 n LEU 54 N -3.20 -3.36 -4.45 1.67 4.77 -1.26 0.19 117.00 111.36 1v32 n LEU 54 Ca 0.02 0.07 -0.33 0.00 -0.03 0.00 0.00 56.01 55.74 1v32 n LEU 54 Cb 0.49 -0.77 -0.13 0.00 -2.33 0.00 0.00 43.42 40.68 1v32 n LEU 54 CO 0.33 -3.81 -0.42 -0.62 -1.33 0.00 0.00 177.39 171.55 1v32 s ASP 55 N -1.31 4.28 0.00 -1.43 2.15 -1.20 -4.28 116.67 114.88 1v32 s ASP 55 Ca 0.44 -0.22 0.23 0.00 0.43 0.00 0.00 52.55 53.43 1v32 s ASP 55 Cb -0.06 -1.45 1.16 0.00 -0.30 0.00 0.00 42.92 42.26 1v32 s ASP 55 CO 0.71 0.23 1.74 -0.81 -0.17 0.00 0.00 175.17 176.87 1v32 n PRO 56 N 3.12 0.34 -0.00 4.34 -0.04 -1.26 -1.80 135.00 139.69 1v32 n PRO 56 Ca -0.18 0.07 0.08 0.00 -0.04 0.00 0.00 63.50 63.43 1v32 n PRO 56 Cb 0.53 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.37 1v32 n PRO 56 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1v32 n SER 57 N -1.28 0.90 -2.80 3.54 2.88 -1.26 -4.87 113.62 110.74 1v32 n SER 57 Ca 0.11 -0.52 0.03 0.00 -1.33 0.00 0.00 58.87 57.16 1v32 n SER 57 Cb 0.18 1.33 0.01 0.00 -0.75 0.00 0.00 64.21 64.98 1v32 n SER 57 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1v32 s ASN 58 N -3.17 -0.21 0.39 -3.46 2.47 -0.93 -5.01 114.94 105.02 1v32 s ASN 58 Ca 0.01 -0.08 0.18 0.00 0.42 0.00 0.00 52.86 53.39 1v32 s ASN 58 Cb 0.12 0.42 1.08 0.00 -1.45 0.00 0.00 41.25 41.42 1v32 s ASN 58 CO 0.70 -0.03 1.76 0.11 -3.72 0.00 0.00 177.10 175.93 1v32 h LYS 59 N 5.60 0.40 -0.92 0.43 1.57 -1.69 0.97 116.57 122.93 1v32 h LYS 59 Ca -0.06 -0.02 0.27 0.00 -1.87 0.00 0.00 60.65 58.97 1v32 h LYS 59 Cb 1.23 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 33.41 1v32 h LYS 59 CO -0.10 0.26 0.83 0.87 -0.57 0.00 0.00 179.45 180.75 1v32 h LYS 60 N 0.41 0.00 -6.71 3.15 6.56 -1.95 -3.40 116.57 114.63 1v32 h LYS 60 Ca 0.60 0.00 -0.43 0.00 -1.06 0.00 0.00 60.65 59.76 1v32 h LYS 60 Cb 1.49 0.00 0.04 0.00 -0.57 0.00 0.00 32.23 33.19 1v32 h LYS 60 CO -0.32 0.00 -0.10 0.15 -2.06 0.00 0.00 179.45 177.12 1v32 s LYS 61 N -4.70 2.66 -0.17 3.15 1.02 0.33 -2.97 119.74 119.06 1v32 s LYS 61 Ca -0.04 -0.89 -0.04 0.00 0.02 0.00 0.00 55.97 55.02 1v32 s LYS 61 Cb 0.18 -2.57 0.08 0.00 -0.52 0.00 0.00 37.83 35.00 1v32 s LYS 61 CO 0.64 -0.55 0.20 0.08 -0.92 0.00 0.00 175.35 174.80 1v32 s VAL 62 N -2.63 -0.30 -0.06 3.17 1.01 0.15 -3.23 120.40 118.50 1v32 s VAL 62 Ca 0.56 0.02 -0.30 0.00 0.00 0.00 0.00 61.98 62.26 1v32 s VAL 62 Cb -0.10 -0.56 -0.02 0.00 0.00 0.00 0.00 36.38 35.69 1v32 s VAL 62 CO 0.37 -0.10 1.03 0.68 0.00 0.00 0.00 175.10 177.08 1v32 s VAL 63 N 2.32 4.70 0.34 2.92 -7.23 0.50 -0.26 120.40 123.68 1v32 s VAL 63 Ca 0.05 1.96 -0.27 0.00 -1.81 0.00 0.00 61.98 61.91 1v32 s VAL 63 Cb -0.15 -4.26 -0.09 0.00 0.56 0.00 0.00 36.38 32.44 1v32 s VAL 63 CO -0.10 0.06 1.12 0.00 -0.31 0.00 0.00 175.10 175.87 1v32 n ASP 65 N 0.61 1.87 0.18 0.00 2.03 -1.26 -4.87 116.55 115.11 1v32 n ASP 65 Ca 0.02 0.32 0.00 0.00 0.52 0.00 0.00 54.79 55.64 1v32 n ASP 65 Cb 0.46 -0.74 0.00 0.00 -0.72 0.00 0.00 41.12 40.12 1v32 n ASP 65 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1v32 n LYS 66 N -4.30 0.00 -0.31 -0.67 4.81 -1.26 -4.86 118.16 111.57 1v32 n LYS 66 Ca -0.29 0.00 0.07 0.00 -0.87 0.00 0.00 58.31 57.22 1v32 n LYS 66 Cb 0.65 0.00 0.23 0.00 0.02 0.00 0.00 35.03 35.93 1v32 n LYS 66 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1v32 h ARG 67 N 0.00 0.67 -0.42 1.64 3.08 -1.97 0.76 114.38 118.13 1v32 h ARG 67 Ca 0.00 -0.04 -0.15 0.00 0.07 0.00 0.00 59.98 59.86 1v32 h ARG 67 Cb 0.00 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 1v32 h ARG 67 CO 0.00 0.44 -0.32 -0.07 -1.07 0.00 0.00 179.97 178.95 1v32 h LEU 68 N 0.69 1.01 0.38 3.04 3.38 -1.94 -1.59 115.31 120.27 1v32 h LEU 68 Ca 0.48 -0.44 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1v32 h LEU 68 Cb 0.65 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1v32 h LEU 68 CO -0.35 1.24 -0.18 0.58 0.09 0.00 0.00 178.44 179.82 1v32 h VAL 69 N 0.79 0.64 0.00 1.22 2.07 -1.05 1.49 116.25 121.41 1v32 h VAL 69 Ca 0.08 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1v32 h VAL 69 Cb 0.92 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1v32 h VAL 69 CO 0.09 0.04 0.00 -0.07 0.02 0.00 0.00 177.57 177.65 1v32 h LEU 70 N -0.62 0.00 0.00 2.57 3.38 0.41 1.08 115.31 122.14 1v32 h LEU 70 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1v32 h LEU 70 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1v32 h LEU 70 CO 0.08 0.00 -0.24 -0.11 0.09 0.00 0.00 178.44 178.27 1v32 n LEU 71 N -2.44 0.79 -0.08 1.67 7.94 -0.47 -4.77 117.00 119.65 1v32 n LEU 71 Ca -0.02 0.40 -0.10 0.00 -1.11 0.00 0.00 56.01 55.18 1v32 n LEU 71 Cb 0.05 -0.66 -0.05 0.00 0.53 0.00 0.00 43.42 43.29 1v32 n LEU 71 CO 0.12 -0.48 -0.25 -0.26 -1.11 0.00 0.00 177.39 175.41 1v32 h PHE 72 N -0.43 0.00 0.00 1.96 0.04 0.22 -3.45 116.94 115.28 1v32 h PHE 72 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1v32 h PHE 72 Cb 0.24 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.39 1v32 h PHE 72 CO -0.10 0.55 0.00 0.41 -0.60 0.00 0.00 178.31 178.57 1v32 n GLY 73 N 1.59 1.36 3.69 -1.45 0.00 0.37 -5.00 105.19 105.75 1v32 n GLY 73 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 1v32 n GLY 73 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1v32 s THR 74 N -2.00 3.71 -0.07 2.61 -4.23 -1.26 -4.99 115.64 109.42 1v32 s THR 74 Ca 0.00 -1.70 0.14 0.00 -1.18 0.00 0.00 61.69 58.95 1v32 s THR 74 Cb 0.00 -2.96 -0.21 0.00 1.34 0.00 0.00 72.50 70.67 1v32 s THR 74 CO 0.00 -0.31 0.67 -1.14 -0.54 0.00 0.00 174.62 173.30 1v32 n ARG 75 N -0.78 0.63 -4.04 3.99 3.00 -1.26 -4.36 116.66 113.84 1v32 n ARG 75 Ca -0.07 0.26 -0.13 0.00 -0.00 0.00 0.00 57.85 57.91 1v32 n ARG 75 Cb 0.58 -1.78 -0.12 0.00 0.00 0.00 0.00 32.46 31.13 1v32 n ARG 75 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1v32 s THR 76 N -2.68 0.34 0.00 5.15 -4.23 -1.26 0.17 115.64 113.14 1v32 s THR 76 Ca -0.04 -0.70 0.00 0.00 -1.18 0.00 0.00 61.69 59.77 1v32 s THR 76 Cb 0.08 -0.39 0.00 0.00 1.34 0.00 0.00 72.50 73.53 1v32 s THR 76 CO 0.82 -0.24 0.00 2.30 -0.54 0.00 0.00 174.62 176.96 1v32 n ILE 77 N 2.06 0.00 -3.94 2.99 -5.35 0.64 -4.91 119.36 110.84 1v32 n ILE 77 Ca -0.19 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 62.01 1v32 n ILE 77 Cb 0.56 0.00 -0.17 0.00 -1.74 0.00 0.00 39.64 38.30 1v32 n ILE 77 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1v32 s PHE 78 N -3.48 1.78 0.49 4.28 0.40 -1.26 0.29 117.98 120.48 1v32 s PHE 78 Ca 0.00 -0.98 0.40 0.00 -0.60 0.00 0.00 56.93 55.75 1v32 s PHE 78 Cb 0.00 -1.38 1.60 0.00 0.51 0.00 0.00 43.02 43.75 1v32 s PHE 78 CO 0.00 -0.59 1.58 -0.09 0.70 0.00 0.00 175.22 176.82 1v32 h ARG 79 N 8.12 0.00 0.03 0.44 2.43 -1.79 1.38 114.38 124.99 1v32 h ARG 79 Ca -0.32 -0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 58.73 1v32 h ARG 79 Cb 1.13 -0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.69 1v32 h ARG 79 CO 0.45 0.00 -0.50 0.52 -1.51 0.00 0.00 179.97 178.93 1v32 h MET 80 N 0.00 0.29 -0.05 0.20 2.86 -1.94 -3.16 114.93 113.13 1v32 h MET 80 Ca 0.91 -0.35 0.01 0.00 -2.06 0.00 0.00 59.70 58.21 1v32 h MET 80 Cb 3.23 0.11 -0.00 0.00 0.06 0.00 0.00 31.60 35.00 1v32 h MET 80 CO -0.28 1.07 0.07 0.87 1.06 0.00 0.00 176.91 179.70 1v32 h LYS 81 N -0.34 0.00 -0.74 1.72 1.79 0.13 -2.81 116.57 116.33 1v32 h LYS 81 Ca -0.07 0.00 0.07 0.00 -2.18 0.00 0.00 60.65 58.47 1v32 h LYS 81 Cb 1.27 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 31.83 1v32 h LYS 81 CO 0.10 0.00 -0.46 0.28 -1.08 0.00 0.00 179.45 178.29 1v32 h VAL 82 N 0.00 0.00 -0.46 0.50 2.07 -0.78 1.51 116.25 119.09 1v32 h VAL 82 Ca 0.02 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.59 1v32 h VAL 82 Cb 0.16 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 29.86 1v32 h VAL 82 CO -0.00 0.00 -0.51 0.22 0.02 0.00 0.00 177.57 177.30 1v32 h TYR 83 N -0.03 -1.58 0.03 1.57 5.03 -1.69 -0.75 116.97 119.55 1v32 h TYR 83 Ca 0.12 0.08 0.03 0.00 2.58 0.00 0.00 58.73 61.54 1v32 h TYR 83 Cb 0.34 0.75 -0.04 0.00 1.55 0.00 0.00 36.73 39.32 1v32 h TYR 83 CO -0.98 -0.43 -0.29 0.22 -1.32 0.00 0.00 178.16 175.37 1v32 h ASP 84 N -0.30 -0.84 -1.86 -2.11 3.58 -1.22 0.16 116.42 113.82 1v32 h ASP 84 Ca 0.08 0.11 0.55 0.00 0.42 0.00 0.00 57.03 58.19 1v32 h ASP 84 Cb 0.51 0.34 -0.08 0.00 1.72 0.00 0.00 39.33 41.81 1v32 h ASP 84 CO -0.59 -0.36 1.33 -0.07 -2.88 0.00 0.00 179.24 176.67 1v32 h LEU 85 N -0.45 0.03 -4.29 2.28 3.38 0.32 0.92 115.31 117.50 1v32 h LEU 85 Ca 0.06 0.02 -0.43 0.00 0.09 0.00 0.00 57.88 57.62 1v32 h LEU 85 Cb 0.52 0.02 -0.16 0.00 0.09 0.00 0.00 40.66 41.13 1v32 h LEU 85 CO -0.23 -0.03 0.29 0.18 0.09 0.00 0.00 178.44 178.74 1v32 n LEU 86 N -4.05 6.30 -0.09 1.67 4.77 0.56 -4.09 117.00 122.07 1v32 n LEU 86 Ca 0.43 -3.82 -0.18 0.00 -0.03 0.00 0.00 56.01 52.41 1v32 n LEU 86 Cb 1.92 -1.23 -0.07 0.00 -2.33 0.00 0.00 43.42 41.71 1v32 n LEU 86 CO 0.41 1.65 -1.10 1.21 -1.33 0.00 0.00 177.39 178.23 1v32 n GLU 87 N 1.02 0.39 -0.00 3.23 4.07 0.32 -4.44 120.64 125.22 1v32 n GLU 87 Ca 0.45 0.15 -0.17 0.00 -0.06 0.00 0.00 57.16 57.53 1v32 n GLU 87 Cb 0.60 -1.18 -0.11 0.00 -0.06 0.00 0.00 31.44 30.70 1v32 n GLU 87 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 1v32 h LYS 88 N -0.50 0.36 -0.35 5.31 1.57 -1.79 -3.05 116.57 118.12 1v32 h LYS 88 Ca -0.44 -0.38 0.10 0.00 -1.87 0.00 0.00 60.65 58.06 1v32 h LYS 88 Cb 1.44 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.84 1v32 h LYS 88 CO -0.23 1.06 0.58 0.45 -0.57 0.00 0.00 179.45 180.74 1v32 h HIS 89 N -0.18 0.00 -3.22 -1.35 3.86 -1.84 -3.38 115.15 109.04 1v32 h HIS 89 Ca -0.06 0.00 -0.59 0.00 -1.16 0.00 0.00 60.37 58.56 1v32 h HIS 89 Cb 1.24 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 29.63 1v32 h HIS 89 CO 0.15 0.00 -0.19 0.71 0.86 0.00 0.00 177.93 179.46 1v32 s TYR 90 N -4.38 3.58 0.00 2.45 1.51 -1.15 0.84 117.35 120.19 1v32 s TYR 90 Ca -0.03 0.88 0.00 0.00 -1.01 0.00 0.00 57.07 56.91 1v32 s TYR 90 Cb 0.12 -2.43 0.00 0.00 -0.11 0.00 0.00 41.96 39.54 1v32 s TYR 90 CO 0.41 0.34 0.00 1.17 -1.11 0.00 0.00 175.55 176.36 1v32 n LYS 91 N 3.02 3.92 -3.56 -0.62 4.81 0.00 -4.81 118.16 120.91 1v32 n LYS 91 Ca -0.10 0.00 -0.18 0.00 -0.87 0.00 0.00 58.31 57.16 1v32 n LYS 91 Cb 0.52 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.57 1v32 n LYS 91 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1v32 n GLU 92 N 0.00 -1.43 -3.61 1.64 2.13 -1.26 -4.97 120.64 113.14 1v32 n GLU 92 Ca 0.00 0.96 -0.00 0.00 0.66 0.00 0.00 57.16 58.78 1v32 n GLU 92 Cb 0.00 -3.49 -0.01 0.00 0.27 0.00 0.00 31.44 28.21 1v32 n GLU 92 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 1v32 s ASN 93 N -3.03 -0.03 0.29 4.31 3.84 -1.26 -5.18 114.94 113.88 1v32 s ASN 93 Ca 0.03 -0.02 0.10 0.00 0.21 0.00 0.00 52.86 53.18 1v32 s ASN 93 Cb -0.01 0.05 -0.05 0.00 -0.55 0.00 0.00 41.25 40.69 1v32 s ASN 93 CO 0.85 -0.08 -0.02 -1.10 -2.79 0.00 0.00 177.10 173.96 1v32 s GLN 94 N -2.14 2.17 0.39 0.43 -0.21 -1.26 -5.02 119.66 114.02 1v32 s GLN 94 Ca 0.13 -1.54 0.00 0.00 0.02 0.00 0.00 55.36 53.96 1v32 s GLN 94 Cb 0.02 -2.06 0.00 0.00 1.00 0.00 0.00 33.01 31.97 1v32 s GLN 94 CO -0.04 0.30 0.00 -3.47 -2.12 0.00 0.00 175.29 169.96 1v32 n ASP 95 N -0.88 -6.60 0.00 5.90 2.03 -1.26 -5.03 116.55 110.71 1v32 n ASP 95 Ca -0.06 0.91 0.00 0.00 0.52 0.00 0.00 54.79 56.17 1v32 n ASP 95 Cb 0.60 -3.26 0.00 0.00 -0.72 0.00 0.00 41.12 37.73 1v32 n ASP 95 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1v32 n SER 96 N -0.91 0.64 0.00 1.67 3.41 -1.26 -5.09 113.62 112.07 1v32 n SER 96 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1v32 n SER 96 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1v32 n SER 96 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v32 n GLY 97 N 2.16 -2.00 0.18 5.00 0.00 -1.26 -4.86 105.19 104.40 1v32 n GLY 97 Ca 0.00 0.59 -0.14 0.00 0.00 0.00 0.00 46.02 46.47 1v32 n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v32 h PRO 98 N 0.00 0.52 -7.58 1.61 0.13 -2.05 -3.48 132.00 121.14 1v32 h PRO 98 Ca 0.00 -0.50 -0.46 0.00 -0.87 0.00 0.00 66.00 64.17 1v32 h PRO 98 Cb 0.00 0.13 0.11 0.00 0.13 0.00 0.00 31.00 31.36 1v32 h PRO 98 CO 0.00 1.13 0.37 0.45 -0.23 0.00 0.00 178.00 179.72 1v32 s SER 99 N -7.09 4.33 -0.61 1.44 0.15 -1.26 -5.05 113.70 105.62 1v32 s SER 99 Ca -0.07 0.61 0.05 0.00 0.70 0.00 0.00 55.95 57.24 1v32 s SER 99 Cb 0.09 -1.06 0.17 0.00 -1.71 0.00 0.00 66.02 63.51 1v32 s SER 99 CO 0.88 -1.98 0.44 -0.55 1.20 0.00 0.00 173.24 173.22 1v32 s SER 100 N -4.62 3.71 0.00 5.45 0.15 -1.26 -5.10 113.70 112.03 1v32 s SER 100 Ca 0.64 -3.59 0.27 0.00 0.70 0.00 0.00 55.95 53.97 1v32 s SER 100 Cb -0.10 -1.24 0.90 0.00 -1.71 0.00 0.00 66.02 63.87 1v32 s SER 100 CO 0.49 -0.11 1.66 0.61 1.20 0.00 0.00 173.24 177.08