#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 2.63 -3.15 1.61 3.41 -1.26 -4.96 113.62 111.90 1v32 n SER 2 Ca 0.00 1.14 0.05 0.00 -0.26 0.00 0.00 58.87 59.81 1v32 n SER 2 Cb 0.00 -1.41 -0.01 0.00 -0.26 0.00 0.00 64.21 62.53 1v32 n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1v32 s SER 3 N 0.24 -0.54 0.00 4.04 1.04 -1.26 -5.09 113.70 112.13 1v32 s SER 3 Ca 0.68 0.27 0.00 0.00 0.48 0.00 0.00 55.95 57.38 1v32 s SER 3 Cb -0.66 1.42 0.00 0.00 0.10 0.00 0.00 66.02 66.88 1v32 s SER 3 CO 0.50 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 175.23 1v32 n GLY 4 N 5.40 -1.80 0.40 7.32 0.00 -1.26 -4.21 105.19 111.03 1v32 n GLY 4 Ca -0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.88 1v32 n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1v32 h SER 5 N 0.00 -1.88 -4.64 1.61 0.87 -2.04 -3.47 113.55 104.00 1v32 h SER 5 Ca 0.00 0.27 0.00 0.00 -1.23 0.00 0.00 61.79 60.83 1v32 h SER 5 Cb 0.00 0.81 0.00 0.00 -0.44 0.00 0.00 62.40 62.77 1v32 h SER 5 CO 0.00 -0.27 -0.98 -1.54 -0.53 0.00 0.00 176.83 173.50 1v32 n SER 6 N -5.09 -9.41 0.00 6.23 3.41 -1.26 -5.01 113.62 102.49 1v32 n SER 6 Ca -0.00 1.72 0.00 0.00 -0.26 0.00 0.00 58.87 60.33 1v32 n SER 6 Cb 0.27 -5.22 0.00 0.00 -0.26 0.00 0.00 64.21 59.00 1v32 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v32 n GLY 7 N 1.91 0.70 3.49 5.00 0.00 -1.26 -5.17 105.19 109.86 1v32 n GLY 7 Ca 0.00 -0.67 -0.17 0.00 0.00 0.00 0.00 46.02 45.19 1v32 n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v32 s LYS 8 N -0.24 0.97 0.19 1.61 0.00 -1.26 -5.14 119.74 115.88 1v32 s LYS 8 Ca 0.00 0.29 -0.30 0.00 0.00 0.00 0.00 55.97 55.96 1v32 s LYS 8 Cb 0.00 0.46 -0.08 0.00 0.00 0.00 0.00 37.83 38.20 1v32 s LYS 8 CO 0.00 -0.28 1.25 1.03 0.00 0.00 0.00 175.35 177.35 1v32 s ARG 9 N -1.01 4.44 0.40 1.78 0.52 -1.26 -5.03 118.95 118.80 1v32 s ARG 9 Ca -0.10 1.97 0.04 0.00 -0.52 0.00 0.00 55.73 57.12 1v32 s ARG 9 Cb -0.01 -3.22 -0.05 0.00 0.52 0.00 0.00 34.95 32.19 1v32 s ARG 9 CO 0.08 -0.17 0.04 0.12 0.02 0.00 0.00 175.30 175.39 1v32 s PHE 10 N 0.02 2.08 0.22 -0.53 5.36 -1.26 -5.10 117.98 118.77 1v32 s PHE 10 Ca 0.55 -0.93 -0.32 0.00 -0.96 0.00 0.00 56.93 55.27 1v32 s PHE 10 Cb -0.35 -1.48 -0.14 0.00 -0.34 0.00 0.00 43.02 40.72 1v32 s PHE 10 CO 0.38 0.14 1.44 0.39 -1.46 0.00 0.00 175.22 176.11 1v32 n GLU 11 N -0.93 2.03 -1.08 10.12 1.02 -1.26 -4.85 120.64 125.69 1v32 n GLU 11 Ca -0.07 0.73 -0.34 0.00 -0.02 0.00 0.00 57.16 57.45 1v32 n GLU 11 Cb 0.67 -2.41 0.01 0.00 -0.02 0.00 0.00 31.44 29.69 1v32 n GLU 11 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1v32 n PHE 12 N 2.26 -2.88 -3.29 -0.32 3.01 -1.26 -4.86 117.46 110.13 1v32 n PHE 12 Ca 0.13 0.35 -0.44 0.00 1.01 0.00 0.00 57.45 58.49 1v32 n PHE 12 Cb 0.30 -1.48 -0.07 0.00 -0.01 0.00 0.00 39.48 38.23 1v32 n PHE 12 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1v32 s VAL 13 N -1.79 5.08 0.00 -4.37 0.11 -1.22 -4.83 120.40 113.39 1v32 s VAL 13 Ca 0.49 -0.84 0.00 0.00 -2.93 0.00 0.00 61.98 58.70 1v32 s VAL 13 Cb -0.40 -4.21 0.00 0.00 -1.53 0.00 0.00 36.38 30.24 1v32 s VAL 13 CO 0.61 -0.69 0.00 0.61 -3.33 0.00 0.00 175.10 172.30 1v32 n GLY 14 N 5.19 1.90 0.98 6.54 0.00 -1.26 -3.74 105.19 114.81 1v32 n GLY 14 Ca -0.10 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 -3.64 1.61 4.27 -1.26 -5.05 117.44 113.37 1v32 n TRP 15 Ca 0.00 0.00 -0.29 0.00 -3.89 0.00 0.00 57.50 53.32 1v32 n TRP 15 Cb 0.00 0.12 -0.04 0.00 -1.36 0.00 0.00 31.31 30.04 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 -4.64 1.97 0.69 -1.67 0.00 -1.25 -1.93 107.32 100.50 1v32 s GLY 16 Ca 0.00 -0.69 -0.17 0.00 0.00 0.00 0.00 44.72 43.86 1v32 s GLY 16 CO 0.00 -0.63 1.19 -1.26 0.00 0.00 0.00 173.10 172.41 1v32 n SER 17 N -0.41 1.50 -0.31 1.64 2.88 -1.06 -3.38 113.62 114.48 1v32 n SER 17 Ca -0.03 0.75 0.14 0.00 -1.33 0.00 0.00 58.87 58.40 1v32 n SER 17 Cb 0.53 -1.51 0.33 0.00 -0.75 0.00 0.00 64.21 62.81 1v32 n SER 17 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 1v32 h ARG 18 N 0.12 0.39 0.12 -1.46 2.43 -1.93 0.43 114.38 114.47 1v32 h ARG 18 Ca -0.49 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 1v32 h ARG 18 Cb 1.33 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.77 1v32 h ARG 18 CO 0.50 0.26 -0.32 1.96 -1.51 0.00 0.00 179.97 180.86 1v32 h GLN 19 N 0.40 -0.48 -0.69 0.20 4.20 -1.89 1.40 115.11 118.26 1v32 h GLN 19 Ca 0.58 0.03 0.05 0.00 0.06 0.00 0.00 58.65 59.37 1v32 h GLN 19 Cb 1.13 0.11 -0.05 0.00 0.30 0.00 0.00 27.48 28.96 1v32 h GLN 19 CO -0.54 -0.32 0.40 1.25 -0.67 0.00 0.00 178.83 178.96 1v32 h LEU 20 N -0.50 0.62 0.47 1.46 5.85 -1.58 -0.47 115.31 121.17 1v32 h LEU 20 Ca -0.01 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1v32 h LEU 20 Cb 0.48 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1v32 h LEU 20 CO -0.15 0.41 -0.50 0.40 -0.34 0.00 0.00 178.44 178.26 1v32 h ILE 21 N 0.75 0.00 -0.47 4.05 1.08 0.43 -0.55 117.51 122.80 1v32 h ILE 21 Ca 0.30 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.86 1v32 h ILE 21 Cb 0.14 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 33.79 1v32 h ILE 21 CO -0.16 0.00 -0.30 -0.33 -0.69 0.00 0.00 178.15 176.68 1v32 h GLU 22 N -0.97 -0.19 -0.77 2.37 5.08 0.23 0.97 114.58 121.30 1v32 h GLU 22 Ca -0.06 0.01 0.18 0.00 -1.00 0.00 0.00 59.36 58.49 1v32 h GLU 22 Cb 0.85 0.04 -0.12 0.00 0.50 0.00 0.00 28.75 30.02 1v32 h GLU 22 CO -0.07 -0.12 0.17 0.35 -1.00 0.00 0.00 179.01 178.34 1v32 h PHE 23 N -0.19 0.26 -0.25 4.33 3.57 -0.73 0.73 116.94 124.66 1v32 h PHE 23 Ca 0.20 0.05 -0.19 0.00 3.53 0.00 0.00 57.97 61.56 1v32 h PHE 23 Cb 0.52 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.27 1v32 h PHE 23 CO -0.55 -0.12 -0.59 -0.07 -2.23 0.00 0.00 178.31 174.75 1v32 h LEU 24 N 0.24 0.91 -1.19 0.59 3.38 0.78 -1.50 115.31 118.52 1v32 h LEU 24 Ca 0.44 -0.50 0.02 0.00 0.09 0.00 0.00 57.88 57.93 1v32 h LEU 24 Cb 0.79 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 1v32 h LEU 24 CO -0.55 1.29 0.55 0.45 0.09 0.00 0.00 178.44 180.27 1v32 h HIS 25 N 0.60 1.02 0.39 1.13 3.86 0.41 0.98 115.15 123.54 1v32 h HIS 25 Ca 0.00 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.22 1v32 h HIS 25 Cb 1.19 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 29.32 1v32 h HIS 25 CO 0.07 0.62 -0.19 0.77 0.86 0.00 0.00 177.93 180.06 1v32 h SER 26 N 1.08 -0.44 -1.29 2.45 0.02 0.44 -3.06 113.55 112.75 1v32 h SER 26 Ca 0.32 0.02 0.37 0.00 -0.84 0.00 0.00 61.79 61.66 1v32 h SER 26 Cb -0.04 0.11 -0.05 0.00 0.14 0.00 0.00 62.40 62.56 1v32 h SER 26 CO -0.08 -0.12 1.05 -0.07 -1.14 0.00 0.00 176.83 176.46 1v32 h LEU 27 N -0.91 0.00 0.00 5.07 3.38 -1.16 -3.43 115.31 118.25 1v32 h LEU 27 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1v32 h LEU 27 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1v32 h LEU 27 CO 0.09 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.23 1v32 n GLY 28 N -1.77 1.39 3.69 0.83 0.00 -0.24 -5.07 105.19 104.01 1v32 n GLY 28 Ca 0.28 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.29 4.39 -0.81 1.61 -0.14 0.32 -4.96 119.74 119.86 1v32 s LYS 29 Ca 0.00 1.18 -0.25 0.00 -1.36 0.00 0.00 55.97 55.54 1v32 s LYS 29 Cb 0.00 -3.53 -0.02 0.00 -1.68 0.00 0.00 37.83 32.60 1v32 s LYS 29 CO 0.00 -0.24 1.78 0.34 -0.76 0.00 0.00 175.35 176.46 1v32 s ASP 30 N 1.07 5.48 -1.08 2.83 2.15 -1.26 -4.19 116.67 121.68 1v32 s ASP 30 Ca 0.43 -0.45 -0.16 0.00 0.43 0.00 0.00 52.55 52.81 1v32 s ASP 30 Cb -0.18 -2.55 -0.08 0.00 -0.30 0.00 0.00 42.92 39.82 1v32 s ASP 30 CO 0.17 -2.36 2.14 0.35 -0.17 0.00 0.00 175.17 175.30 1v32 n THR 31 N 7.37 2.64 -0.11 1.71 -2.24 -1.26 -4.28 114.28 118.10 1v32 n THR 31 Ca 0.29 -2.08 -0.21 0.00 -2.27 0.00 0.00 64.05 59.78 1v32 n THR 31 Cb 0.49 -2.40 -0.07 0.00 -2.10 0.00 0.00 70.33 66.25 1v32 n THR 31 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1v32 n SER 32 N 6.15 1.75 -4.51 3.42 2.88 -1.26 -4.98 113.62 117.07 1v32 n SER 32 Ca 0.52 0.30 -0.33 0.00 -1.33 0.00 0.00 58.87 58.03 1v32 n SER 32 Cb 0.34 -0.71 -0.12 0.00 -0.75 0.00 0.00 64.21 62.96 1v32 n SER 32 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1v32 s GLU 33 N -2.54 3.00 -0.73 -1.46 2.02 -1.26 -5.01 118.70 112.72 1v32 s GLU 33 Ca -0.32 -0.59 -0.32 0.00 0.02 0.00 0.00 54.97 53.75 1v32 s GLU 33 Cb 0.11 -2.62 -0.19 0.00 0.10 0.00 0.00 34.13 31.52 1v32 s GLU 33 CO 0.42 0.49 2.24 -0.12 0.02 0.00 0.00 175.26 178.31 1v32 n MET 34 N 2.73 0.00 -2.39 1.61 0.00 -1.26 -4.79 117.12 113.03 1v32 n MET 34 Ca -0.18 0.00 -0.43 0.00 -0.00 0.00 0.00 57.70 57.09 1v32 n MET 34 Cb 0.53 -1.35 -0.02 0.00 0.00 0.00 0.00 33.22 32.37 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 7.07 4.08 0.62 1.12 1.01 -1.26 -4.96 121.20 128.88 1v32 s ILE 35 Ca 1.17 1.21 -0.17 0.00 0.00 0.00 0.00 60.65 62.86 1v32 s ILE 35 Cb -1.22 -4.12 -0.09 0.00 0.01 0.00 0.00 42.46 37.05 1v32 s ILE 35 CO 0.50 -0.48 0.32 -1.20 0.00 0.00 0.00 174.94 174.08 1v32 n SER 36 N 7.78 -1.89 0.32 3.58 7.64 -1.26 -4.70 113.62 125.09 1v32 n SER 36 Ca 0.15 0.65 -0.17 0.00 1.01 0.00 0.00 58.87 60.52 1v32 n SER 36 Cb 0.47 -1.09 -0.09 0.00 -1.01 0.00 0.00 64.21 62.48 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 -0.03 -0.94 -1.02 1.43 2.43 -2.00 -2.05 114.38 112.20 1v32 h ARG 37 Ca -0.44 0.06 0.42 0.00 -0.81 0.00 0.00 59.98 59.21 1v32 h ARG 37 Cb 1.39 0.21 -0.18 0.00 -0.42 0.00 0.00 29.97 30.98 1v32 h ARG 37 CO 0.44 -0.63 0.56 -0.92 -1.51 0.00 0.00 179.97 177.91 1v32 h TYR 38 N -0.98 0.82 0.65 2.20 5.03 -1.97 0.73 116.97 123.45 1v32 h TYR 38 Ca -0.08 0.04 -0.03 0.00 2.58 0.00 0.00 58.73 61.24 1v32 h TYR 38 Cb 0.81 -0.19 0.01 0.00 1.55 0.00 0.00 36.73 38.91 1v32 h TYR 38 CO -0.15 -0.45 -0.31 -0.44 -1.32 0.00 0.00 178.16 175.48 1v32 h ASP 39 N 0.02 -0.74 -0.20 -2.11 3.32 -1.72 1.41 116.42 116.40 1v32 h ASP 39 Ca 0.84 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.94 1v32 h ASP 39 Cb 2.25 0.19 -0.03 0.00 0.22 0.00 0.00 39.33 41.96 1v32 h ASP 39 CO -0.74 -0.50 -0.01 0.58 -1.72 0.00 0.00 179.24 176.84 1v32 h VAL 40 N -0.93 0.85 -0.08 -1.35 2.07 0.73 0.51 116.25 118.06 1v32 h VAL 40 Ca -0.09 -0.02 0.01 0.00 0.82 0.00 0.00 66.70 67.43 1v32 h VAL 40 Cb 0.69 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1v32 h VAL 40 CO 0.15 0.01 -0.00 0.28 0.02 0.00 0.00 177.57 178.03 1v32 h SER 41 N 0.05 -0.03 -0.58 0.57 0.02 -0.03 0.36 113.55 113.91 1v32 h SER 41 Ca 0.09 0.02 0.06 0.00 -0.84 0.00 0.00 61.79 61.12 1v32 h SER 41 Cb 0.12 0.03 -0.05 0.00 0.14 0.00 0.00 62.40 62.64 1v32 h SER 41 CO -0.17 -0.00 0.30 -0.78 -1.14 0.00 0.00 176.83 175.04 1v32 h ASP 42 N 0.03 0.42 -0.48 3.07 1.82 0.24 0.19 116.42 121.70 1v32 h ASP 42 Ca 0.04 0.04 -0.04 0.00 -0.39 0.00 0.00 57.03 56.67 1v32 h ASP 42 Cb 0.04 -0.04 -0.03 0.00 0.68 0.00 0.00 39.33 39.99 1v32 h ASP 42 CO -0.06 0.28 0.16 0.74 -1.61 0.00 0.00 179.24 178.74 1v32 h THR 43 N 0.56 1.22 0.11 2.25 2.02 0.61 -0.40 112.91 119.27 1v32 h THR 43 Ca 0.26 -0.75 -0.01 0.00 0.77 0.00 0.00 66.41 66.69 1v32 h THR 43 Cb 0.19 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 1v32 h THR 43 CO -0.19 0.28 -0.05 0.40 0.37 0.00 0.00 175.52 176.33 1v32 h ILE 44 N 0.78 1.02 -0.94 3.11 2.04 0.12 0.76 117.51 124.41 1v32 h ILE 44 Ca 0.18 -0.51 0.08 0.00 1.00 0.00 0.00 64.86 65.61 1v32 h ILE 44 Cb 0.25 1.35 -0.07 0.00 -0.74 0.00 0.00 36.82 37.60 1v32 h ILE 44 CO -0.01 0.12 0.59 0.00 0.00 0.00 0.00 178.15 178.85 1v32 h ALA 45 N 0.48 1.34 -0.02 1.87 0.00 -0.44 0.78 119.26 123.27 1v32 h ALA 45 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1v32 h ALA 45 Cb 0.31 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1v32 h ALA 45 CO 0.02 0.29 -0.01 -0.22 0.00 0.00 0.00 179.25 179.34 1v32 h LYS 46 N 1.02 0.04 -0.54 0.00 3.64 -0.80 -2.97 116.57 116.96 1v32 h LYS 46 Ca 0.43 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.83 1v32 h LYS 46 Cb 0.28 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.06 1v32 h LYS 46 CO -0.21 0.44 0.30 -0.92 -2.27 0.00 0.00 179.45 176.79 1v32 h TYR 47 N -0.35 0.56 -0.67 1.91 3.20 0.14 1.21 116.97 122.97 1v32 h TYR 47 Ca 0.00 0.02 0.14 0.00 3.14 0.00 0.00 58.73 62.04 1v32 h TYR 47 Cb 0.42 -0.17 -0.12 0.00 1.54 0.00 0.00 36.73 38.41 1v32 h TYR 47 CO 0.07 0.29 -0.02 0.82 -1.64 0.00 0.00 178.16 177.68 1v32 h ILE 48 N 0.59 0.42 0.11 1.81 2.04 0.58 -0.37 117.51 122.69 1v32 h ILE 48 Ca 0.23 -0.03 -0.27 0.00 1.00 0.00 0.00 64.86 65.79 1v32 h ILE 48 Cb 0.10 0.31 0.03 0.00 -0.74 0.00 0.00 36.82 36.52 1v32 h ILE 48 CO -0.14 0.02 -1.11 -1.28 0.00 0.00 0.00 178.15 175.64 1v32 h SER 49 N 0.10 0.78 -0.32 1.72 0.87 -1.21 1.48 113.55 116.97 1v32 h SER 49 Ca 0.35 -0.84 0.03 0.00 -1.23 0.00 0.00 61.79 60.10 1v32 h SER 49 Cb 0.59 -0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 62.26 1v32 h SER 49 CO -0.59 1.54 -0.22 0.50 -0.53 0.00 0.00 176.83 177.53 1v32 h LYS 50 N 0.13 -0.03 0.09 2.24 3.64 0.30 -2.77 116.57 120.16 1v32 h LYS 50 Ca -0.17 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1v32 h LYS 50 Cb 1.81 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.64 1v32 h LYS 50 CO 0.21 -0.02 -0.04 0.93 -2.27 0.00 0.00 179.45 178.26 1v32 h GLU 51 N -0.03 -0.11 0.00 1.90 4.39 -1.27 -3.49 114.58 115.96 1v32 h GLU 51 Ca 0.05 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1v32 h GLU 51 Cb 0.17 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1v32 h GLU 51 CO -0.32 0.41 0.00 0.41 -1.16 0.00 0.00 179.01 178.35 1v32 n GLY 52 N 0.60 0.82 0.25 -3.84 0.00 -0.17 -5.02 105.19 97.83 1v32 n GLY 52 Ca -0.08 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.09 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 -9.40 0.99 4.07 0.18 -3.46 115.31 107.69 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 0.00 -1.49 0.18 -1.08 0.00 0.00 178.44 176.05 1v32 n LEU 54 N -3.08 -2.77 -4.62 1.67 4.77 -1.22 0.91 117.00 112.67 1v32 n LEU 54 Ca 0.02 0.09 -0.34 0.00 -0.03 0.00 0.00 56.01 55.75 1v32 n LEU 54 Cb 0.40 -0.88 -0.11 0.00 -2.33 0.00 0.00 43.42 40.50 1v32 n LEU 54 CO 0.30 -3.78 -0.34 -0.62 -1.33 0.00 0.00 177.39 171.61 1v32 s ASP 55 N -1.51 4.94 0.21 -1.43 2.15 -1.23 -4.34 116.67 115.45 1v32 s ASP 55 Ca 0.48 0.04 0.07 0.00 0.43 0.00 0.00 52.55 53.57 1v32 s ASP 55 Cb -0.11 -1.39 0.13 0.00 -0.30 0.00 0.00 42.92 41.25 1v32 s ASP 55 CO 0.70 0.34 1.47 1.55 -0.17 0.00 0.00 175.17 179.07 1v32 h PRO 56 N 5.40 0.07 -0.03 4.34 0.13 -1.95 -1.90 132.00 138.07 1v32 h PRO 56 Ca -0.47 -0.06 -0.12 0.00 -0.87 0.00 0.00 66.00 64.47 1v32 h PRO 56 Cb 1.18 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 1v32 h PRO 56 CO 0.55 0.80 -0.56 1.03 -0.23 0.00 0.00 178.00 179.59 1v32 h SER 57 N 0.04 0.09 -0.77 1.44 0.87 -2.00 -3.42 113.55 109.80 1v32 h SER 57 Ca -0.02 -0.05 0.10 0.00 -1.23 0.00 0.00 61.79 60.60 1v32 h SER 57 Cb 1.35 -0.02 -0.20 0.00 -0.44 0.00 0.00 62.40 63.08 1v32 h SER 57 CO 0.11 0.63 -0.24 0.21 -0.53 0.00 0.00 176.83 177.00 1v32 s ASN 58 N -6.87 -1.23 0.53 6.23 2.47 -1.16 -5.01 114.94 109.90 1v32 s ASN 58 Ca -0.02 0.24 0.20 0.00 0.42 0.00 0.00 52.86 53.70 1v32 s ASN 58 Cb 0.13 1.82 1.35 0.00 -1.45 0.00 0.00 41.25 43.09 1v32 s ASN 58 CO 0.77 -0.23 2.09 0.11 -3.72 0.00 0.00 177.10 176.12 1v32 h LYS 59 N 7.81 0.00 -0.13 0.43 1.57 -1.60 0.20 116.57 124.85 1v32 h LYS 59 Ca -0.07 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.75 1v32 h LYS 59 Cb 1.18 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 1v32 h LYS 59 CO 0.09 0.00 0.35 0.87 -0.57 0.00 0.00 179.45 180.18 1v32 h LYS 60 N 0.00 0.00 -6.51 3.15 1.79 -1.95 -3.41 116.57 109.64 1v32 h LYS 60 Ca 0.10 0.00 -0.46 0.00 -2.18 0.00 0.00 60.65 58.11 1v32 h LYS 60 Cb 0.39 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.06 1v32 h LYS 60 CO -0.00 0.00 -0.19 0.15 -1.08 0.00 0.00 179.45 178.33 1v32 s LYS 61 N -4.29 2.55 -0.03 3.15 1.02 0.69 -4.15 119.74 118.68 1v32 s LYS 61 Ca -0.04 -1.47 0.01 0.00 0.02 0.00 0.00 55.97 54.49 1v32 s LYS 61 Cb 0.11 -2.67 0.03 0.00 -0.52 0.00 0.00 37.83 34.77 1v32 s LYS 61 CO 0.38 -0.56 -0.01 0.08 -0.92 0.00 0.00 175.35 174.31 1v32 s VAL 62 N -2.52 0.29 -0.47 3.17 1.01 0.81 -3.55 120.40 119.14 1v32 s VAL 62 Ca 0.57 0.02 -0.12 0.00 0.00 0.00 0.00 61.98 62.46 1v32 s VAL 62 Cb -0.07 -0.36 0.10 0.00 0.00 0.00 0.00 36.38 36.04 1v32 s VAL 62 CO 0.35 0.17 0.36 -0.69 0.00 0.00 0.00 175.10 175.29 1v32 s VAL 63 N 1.00 4.64 0.56 2.92 1.01 0.26 -0.52 120.40 130.27 1v32 s VAL 63 Ca -0.10 -1.44 -0.19 0.00 0.00 0.00 0.00 61.98 60.24 1v32 s VAL 63 Cb -0.14 -3.91 -0.07 0.00 0.00 0.00 0.00 36.38 32.27 1v32 s VAL 63 CO -0.01 -0.66 0.85 0.00 0.00 0.00 0.00 175.10 175.27 1v32 n ASP 65 N -0.20 1.21 0.05 0.00 2.03 -1.26 -4.90 116.55 113.47 1v32 n ASP 65 Ca 0.12 0.20 0.00 0.00 0.52 0.00 0.00 54.79 55.64 1v32 n ASP 65 Cb 0.46 -0.50 0.00 0.00 -0.72 0.00 0.00 41.12 40.36 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 -3.75 0.00 -0.30 -0.67 4.81 -1.26 -4.90 118.16 112.08 1v32 n LYS 66 Ca -0.33 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.21 1v32 n LYS 66 Cb 0.74 0.00 0.24 0.00 0.02 0.00 0.00 35.03 36.03 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 0.09 -0.59 1.64 3.08 -1.97 1.05 114.38 117.68 1v32 h ARG 67 Ca 0.00 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 1v32 h ARG 67 Cb 0.00 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 1v32 h ARG 67 CO 0.00 0.06 0.23 -0.07 -1.07 0.00 0.00 179.97 179.12 1v32 h LEU 68 N 0.09 0.82 0.60 3.04 3.38 -1.94 -0.56 115.31 120.73 1v32 h LEU 68 Ca 0.52 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.29 1v32 h LEU 68 Cb 1.01 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1v32 h LEU 68 CO -0.77 0.76 -0.35 0.58 0.09 0.00 0.00 178.44 178.75 1v32 h VAL 69 N 0.82 0.28 0.00 1.22 2.07 0.68 1.36 116.25 122.68 1v32 h VAL 69 Ca 0.20 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.72 1v32 h VAL 69 Cb 0.20 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 1v32 h VAL 69 CO -0.02 0.00 0.07 -0.07 0.02 0.00 0.00 177.57 177.58 1v32 h LEU 70 N -0.89 0.00 0.00 2.57 3.38 -0.04 1.46 115.31 121.79 1v32 h LEU 70 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1v32 h LEU 70 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1v32 h LEU 70 CO 0.08 0.00 -0.06 0.25 0.09 0.00 0.00 178.44 178.80 1v32 h LEU 71 N 0.00 0.00 0.00 1.67 5.85 0.67 -3.45 115.31 120.05 1v32 h LEU 71 Ca 0.00 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.59 1v32 h LEU 71 Cb 0.15 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1v32 h LEU 71 CO 0.00 0.11 -0.82 -0.26 -0.34 0.00 0.00 178.44 177.13 1v32 h PHE 72 N -0.15 0.00 0.00 1.25 0.04 0.19 -3.45 116.94 114.82 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 0.06 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.21 1v32 h PHE 72 CO -0.03 1.05 0.00 0.41 -0.60 0.00 0.00 178.31 179.14 1v32 n GLY 73 N 1.52 1.32 3.58 -1.45 0.00 0.50 -5.00 105.19 105.66 1v32 n GLY 73 Ca -0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 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 3.41 -0.07 2.61 -4.23 -1.26 -4.98 115.64 109.11 1v32 s THR 74 Ca 0.00 -1.26 -0.26 0.00 -1.18 0.00 0.00 61.69 58.99 1v32 s THR 74 Cb 0.00 -2.60 -0.25 0.00 1.34 0.00 0.00 72.50 71.00 1v32 s THR 74 CO 0.00 0.11 0.97 -0.09 -0.54 0.00 0.00 174.62 175.06 1v32 h ARG 75 N 3.58 0.12 -6.27 3.99 9.65 -1.95 -3.39 114.38 120.11 1v32 h ARG 75 Ca -0.49 -0.14 -0.60 0.00 -1.10 0.00 0.00 59.98 57.65 1v32 h ARG 75 Cb 1.17 0.04 -0.24 0.00 -1.39 0.00 0.00 29.97 29.55 1v32 h ARG 75 CO 0.53 0.93 -0.84 0.95 2.80 0.00 0.00 179.97 184.33 1v32 s THR 76 N -2.91 1.79 0.33 0.20 -4.23 -1.26 0.15 115.64 109.70 1v32 s THR 76 Ca -0.17 -1.39 -0.06 0.00 -1.18 0.00 0.00 61.69 58.90 1v32 s THR 76 Cb -0.00 -1.58 0.01 0.00 1.34 0.00 0.00 72.50 72.26 1v32 s THR 76 CO 0.73 0.12 0.50 0.27 -0.54 0.00 0.00 174.62 175.70 1v32 s ILE 77 N -0.95 0.00 -0.26 2.99 -4.36 0.32 -4.94 121.20 114.01 1v32 s ILE 77 Ca 0.08 -1.51 -0.08 0.00 -0.26 0.00 0.00 60.65 58.88 1v32 s ILE 77 Cb -0.09 -2.59 -0.03 0.00 1.25 0.00 0.00 42.46 41.00 1v32 s ILE 77 CO 0.03 0.00 0.09 -0.36 0.24 0.00 0.00 174.94 174.94 1v32 s PHE 78 N -3.16 3.11 0.55 1.37 0.40 -1.26 -0.14 117.98 118.85 1v32 s PHE 78 Ca 0.28 -0.40 0.47 0.00 -0.60 0.00 0.00 56.93 56.68 1v32 s PHE 78 Cb -0.01 -2.26 1.62 0.00 0.51 0.00 0.00 43.02 42.89 1v32 s PHE 78 CO 0.17 -0.35 1.50 -2.13 0.70 0.00 0.00 175.22 175.11 1v32 n ARG 79 N 4.94 0.00 -0.07 0.44 0.63 -1.26 0.11 116.66 121.46 1v32 n ARG 79 Ca -0.16 1.05 -0.12 0.00 -0.92 0.00 0.00 57.85 57.70 1v32 n ARG 79 Cb 0.51 -2.45 -0.11 0.00 0.45 0.00 0.00 32.46 30.86 1v32 n ARG 79 CO 0.00 0.00 0.00 0.52 -2.51 0.00 0.00 177.63 175.64 1v32 h MET 80 N 0.00 0.00 -0.29 -0.14 2.86 -1.92 -3.26 114.93 112.18 1v32 h MET 80 Ca 0.88 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 58.60 1v32 h MET 80 Cb 3.63 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 35.28 1v32 h MET 80 CO -0.01 0.85 0.54 0.87 1.06 0.00 0.00 176.91 180.22 1v32 h LYS 81 N -1.00 0.00 -0.96 1.72 1.79 0.44 -1.93 116.57 116.63 1v32 h LYS 81 Ca -0.02 0.00 0.09 0.00 -2.18 0.00 0.00 60.65 58.54 1v32 h LYS 81 Cb 0.87 0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 31.40 1v32 h LYS 81 CO -0.01 0.00 -0.56 0.28 -1.08 0.00 0.00 179.45 178.08 1v32 n VAL 82 N -3.23 -0.65 -0.15 0.50 0.31 -0.35 0.19 118.33 114.96 1v32 n VAL 82 Ca 0.05 2.31 -0.05 0.00 -0.01 0.00 0.00 64.34 66.64 1v32 n VAL 82 Cb 0.67 -2.86 0.01 0.00 -0.91 0.00 0.00 33.84 30.75 1v32 n VAL 82 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 1v32 h TYR 83 N 0.00 -0.67 0.20 3.52 3.20 -1.58 -1.04 116.97 120.59 1v32 h TYR 83 Ca 0.16 0.06 -0.01 0.00 3.14 0.00 0.00 58.73 62.07 1v32 h TYR 83 Cb 0.40 0.37 0.00 0.00 1.54 0.00 0.00 36.73 39.04 1v32 h TYR 83 CO -0.98 -0.33 -0.10 -0.44 -1.64 0.00 0.00 178.16 174.67 1v32 h ASP 84 N -0.15 -0.23 -0.95 -2.11 3.32 -0.35 -2.33 116.42 113.62 1v32 h ASP 84 Ca 0.22 0.01 0.27 0.00 0.02 0.00 0.00 57.03 57.54 1v32 h ASP 84 Cb 0.50 0.06 -0.18 0.00 0.22 0.00 0.00 39.33 39.93 1v32 h ASP 84 CO -0.57 -0.16 0.05 0.18 -1.72 0.00 0.00 179.24 177.03 1v32 n LEU 85 N -5.20 -0.08 0.00 1.55 4.77 0.51 -4.11 117.00 114.44 1v32 n LEU 85 Ca -0.09 1.61 0.00 0.00 -0.03 0.00 0.00 56.01 57.50 1v32 n LEU 85 Cb 0.13 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.62 1v32 n LEU 85 CO 0.35 -1.65 0.00 0.18 -1.33 0.00 0.00 177.39 174.94 1v32 n LEU 86 N -5.40 0.00 0.00 2.23 4.77 -0.59 -4.30 117.00 113.71 1v32 n LEU 86 Ca 0.23 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 1v32 n LEU 86 Cb 0.77 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.86 1v32 n LEU 86 CO -0.07 0.00 0.00 1.21 -1.33 0.00 0.00 177.39 177.20 1v32 n GLU 87 N 0.00 0.00 0.03 3.23 2.13 -1.26 -3.71 120.64 121.06 1v32 n GLU 87 Ca 0.00 0.00 0.06 0.00 0.66 0.00 0.00 57.16 57.88 1v32 n GLU 87 Cb 0.00 0.00 0.26 0.00 0.27 0.00 0.00 31.44 31.97 1v32 n GLU 87 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1v32 n LYS 88 N 0.00 0.04 -0.55 5.31 5.02 -1.26 -1.13 118.16 125.59 1v32 n LYS 88 Ca 0.00 0.38 0.03 0.00 -2.02 0.00 0.00 58.31 56.70 1v32 n LYS 88 Cb 0.00 -1.59 0.23 0.00 -0.02 0.00 0.00 35.03 33.66 1v32 n LYS 88 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1v32 n HIS 89 N -1.66 1.28 -4.17 2.13 8.25 -1.24 -4.87 115.22 114.94 1v32 n HIS 89 Ca 0.02 -0.48 -0.11 0.00 -0.26 0.00 0.00 57.72 56.88 1v32 n HIS 89 Cb 0.12 -0.37 -0.10 0.00 1.12 0.00 0.00 29.99 30.76 1v32 n HIS 89 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1v32 s TYR 90 N -2.04 0.90 0.00 4.41 1.51 -0.29 -2.55 117.35 119.30 1v32 s TYR 90 Ca 0.32 -0.87 0.00 0.00 -1.01 0.00 0.00 57.07 55.52 1v32 s TYR 90 Cb 0.25 -0.52 0.00 0.00 -0.11 0.00 0.00 41.96 41.58 1v32 s TYR 90 CO 0.09 -0.13 0.00 1.17 -1.11 0.00 0.00 175.55 175.58 1v32 n LYS 91 N 0.07 3.76 -1.48 -0.62 0.00 -0.81 -4.89 118.16 114.18 1v32 n LYS 91 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.18 1v32 n LYS 91 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.63 1v32 n LYS 91 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1v32 n GLU 92 N 0.00 0.00 0.00 1.64 2.13 -1.26 -5.04 120.64 118.11 1v32 n GLU 92 Ca 0.00 0.29 0.00 0.00 0.66 0.00 0.00 57.16 58.11 1v32 n GLU 92 Cb 0.00 -1.48 0.00 0.00 0.27 0.00 0.00 31.44 30.23 1v32 n GLU 92 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1v32 n ASN 93 N -1.19 0.00 -4.53 4.31 2.85 -1.26 -5.15 115.26 110.28 1v32 n ASN 93 Ca 0.00 0.00 -0.34 0.00 -0.11 0.00 0.00 54.58 54.13 1v32 n ASN 93 Cb 0.49 0.00 -0.12 0.00 1.24 0.00 0.00 39.78 41.40 1v32 n ASN 93 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1v32 s GLN 94 N -2.00 3.16 -0.02 1.20 -0.21 -1.26 -5.10 119.66 115.42 1v32 s GLN 94 Ca 0.00 -0.55 -0.22 0.00 0.02 0.00 0.00 55.36 54.61 1v32 s GLN 94 Cb 0.00 -2.72 0.04 0.00 1.00 0.00 0.00 33.01 31.34 1v32 s GLN 94 CO 0.00 0.46 0.47 0.34 -2.12 0.00 0.00 175.29 174.45 1v32 s ASP 95 N -0.26 -0.39 -0.20 5.90 -1.08 -1.26 -5.17 116.67 114.20 1v32 s ASP 95 Ca 0.04 0.34 -0.30 0.00 -0.52 0.00 0.00 52.55 52.11 1v32 s ASP 95 Cb -0.13 0.41 0.15 0.00 -1.46 0.00 0.00 42.92 41.90 1v32 s ASP 95 CO 0.02 -0.53 1.12 -0.94 0.52 0.00 0.00 175.17 175.36 1v32 s SER 96 N -1.33 -0.26 0.18 -0.34 1.04 -1.26 -5.16 113.70 106.57 1v32 s SER 96 Ca -0.12 0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.61 1v32 s SER 96 Cb -0.03 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.32 1v32 s SER 96 CO 0.06 -0.24 0.00 0.61 0.98 0.00 0.00 173.24 174.66 1v32 n GLY 97 N 0.71 -1.86 3.76 7.32 0.00 -1.26 -5.00 105.19 108.86 1v32 n GLY 97 Ca -0.07 -1.35 -0.30 0.00 0.00 0.00 0.00 46.02 44.30 1v32 n GLY 97 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v32 s PRO 98 N -1.99 -0.65 -0.30 1.61 0.04 -1.26 -5.19 135.00 127.26 1v32 s PRO 98 Ca 0.00 -0.38 -0.15 0.00 0.04 0.00 0.00 61.00 60.51 1v32 s PRO 98 Cb 0.00 -1.69 0.18 0.00 0.04 0.00 0.00 34.50 33.03 1v32 s PRO 98 CO 0.00 -3.28 1.15 -1.54 0.04 0.00 0.00 177.00 173.38 1v32 s SER 99 N -4.50 -0.12 -0.18 6.66 1.04 -1.26 -5.15 113.70 110.19 1v32 s SER 99 Ca 0.75 0.01 0.01 0.00 0.48 0.00 0.00 55.95 57.20 1v32 s SER 99 Cb -0.05 1.06 0.01 0.00 0.10 0.00 0.00 66.02 67.14 1v32 s SER 99 CO 0.55 -0.02 -0.18 -0.55 0.98 0.00 0.00 173.24 174.02 1v32 s SER 100 N 2.97 3.35 0.00 7.02 0.15 -1.26 -5.31 113.70 120.61 1v32 s SER 100 Ca 0.32 -0.59 0.00 0.00 0.70 0.00 0.00 55.95 56.38 1v32 s SER 100 Cb 0.00 -1.52 0.00 0.00 -1.71 0.00 0.00 66.02 62.79 1v32 s SER 100 CO -0.22 0.02 0.00 0.61 1.20 0.00 0.00 173.24 174.85