#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v32 s SER 2 N 0.00 -1.10 -0.35 1.61 0.01 -1.26 -5.11 113.70 107.51 1v32 s SER 2 Ca 0.00 -0.05 0.02 0.00 1.31 0.00 0.00 55.95 57.22 1v32 s SER 2 Cb 0.00 1.78 0.11 0.00 0.21 0.00 0.00 66.02 68.12 1v32 s SER 2 CO 0.00 -0.30 0.10 -0.94 0.41 0.00 0.00 173.24 172.51 1v32 s SER 3 N 2.66 4.34 0.00 2.44 1.04 -1.26 -5.03 113.70 117.89 1v32 s SER 3 Ca 0.10 -2.05 0.00 0.00 0.48 0.00 0.00 55.95 54.48 1v32 s SER 3 Cb -0.10 -1.27 0.00 0.00 0.10 0.00 0.00 66.02 64.75 1v32 s SER 3 CO -0.25 -0.37 0.00 0.61 0.98 0.00 0.00 173.24 174.20 1v32 n GLY 4 N 4.35 4.01 1.23 7.32 0.00 -1.26 -5.14 105.19 115.69 1v32 n GLY 4 Ca 0.02 -1.38 0.14 0.00 0.00 0.00 0.00 46.02 44.81 1v32 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v32 n SER 5 N 0.00 -6.68 -3.16 1.61 7.64 -1.26 -5.01 113.62 106.76 1v32 n SER 5 Ca 0.00 0.78 0.04 0.00 1.01 0.00 0.00 58.87 60.70 1v32 n SER 5 Cb 0.00 -3.95 -0.04 0.00 -1.01 0.00 0.00 64.21 59.21 1v32 n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1v32 s SER 6 N -6.21 -0.02 0.34 6.43 0.15 -1.26 -5.15 113.70 107.98 1v32 s SER 6 Ca 0.00 0.03 0.09 0.00 0.70 0.00 0.00 55.95 56.77 1v32 s SER 6 Cb 0.00 1.02 -0.06 0.00 -1.71 0.00 0.00 66.02 65.27 1v32 s SER 6 CO 0.00 -0.00 -0.04 -0.83 1.20 0.00 0.00 173.24 173.56 1v32 s GLY 7 N 2.15 2.10 1.09 9.45 0.00 -1.26 -5.13 107.32 115.72 1v32 s GLY 7 Ca -0.01 -2.00 -0.12 0.00 0.00 0.00 0.00 44.72 42.59 1v32 s GLY 7 CO -0.15 -1.95 1.06 0.54 0.00 0.00 0.00 173.10 172.60 1v32 s LYS 8 N -3.66 -0.33 -0.13 2.90 3.01 -1.26 -5.02 119.74 115.24 1v32 s LYS 8 Ca 0.33 1.01 0.02 0.00 -1.01 0.00 0.00 55.97 56.33 1v32 s LYS 8 Cb 0.00 -1.61 0.00 0.00 -1.01 0.00 0.00 37.83 35.22 1v32 s LYS 8 CO 0.18 -3.38 -0.20 -0.98 0.51 0.00 0.00 175.35 171.48 1v32 s ARG 9 N -4.54 3.12 0.39 1.68 3.03 -1.26 -5.12 118.95 116.25 1v32 s ARG 9 Ca 0.68 -0.81 0.04 0.00 2.03 0.00 0.00 55.73 57.66 1v32 s ARG 9 Cb -0.24 -2.48 -0.04 0.00 -1.03 0.00 0.00 34.95 31.16 1v32 s ARG 9 CO 0.62 0.06 0.08 0.12 -1.13 0.00 0.00 175.30 175.05 1v32 s PHE 10 N 0.67 1.89 0.23 5.89 5.36 -1.26 -5.10 117.98 125.65 1v32 s PHE 10 Ca -0.10 -1.10 -0.30 0.00 -0.96 0.00 0.00 56.93 54.47 1v32 s PHE 10 Cb -0.16 -1.29 -0.15 0.00 -0.34 0.00 0.00 43.02 41.08 1v32 s PHE 10 CO 0.02 -0.09 1.09 -0.85 -1.46 0.00 0.00 175.22 173.94 1v32 n GLU 11 N -0.88 1.27 -1.12 10.12 0.28 -1.26 -4.62 120.64 124.44 1v32 n GLU 11 Ca -0.06 0.45 0.15 0.00 -0.16 0.00 0.00 57.16 57.54 1v32 n GLU 11 Cb 0.66 -1.89 -0.04 0.00 1.43 0.00 0.00 31.44 31.61 1v32 n GLU 11 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1v32 n PHE 12 N 0.93 -3.26 -3.44 -1.84 3.01 -1.26 -4.62 117.46 106.97 1v32 n PHE 12 Ca 0.13 1.39 -0.26 0.00 1.01 0.00 0.00 57.45 59.71 1v32 n PHE 12 Cb 0.28 -2.54 -0.09 0.00 -0.01 0.00 0.00 39.48 37.13 1v32 n PHE 12 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1v32 n VAL 13 N -3.59 0.78 0.00 -4.37 0.31 -0.95 -4.83 118.33 105.68 1v32 n VAL 13 Ca 0.01 -4.53 0.00 0.00 -0.01 0.00 0.00 64.34 59.81 1v32 n VAL 13 Cb 0.51 -2.01 0.00 0.00 -0.91 0.00 0.00 33.84 31.43 1v32 n VAL 13 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1v32 n GLY 14 N 1.53 0.92 0.89 2.92 0.00 -1.26 -4.31 105.19 105.87 1v32 n GLY 14 Ca 0.25 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 -3.29 1.61 4.27 -1.26 -5.08 117.44 113.69 1v32 n TRP 15 Ca 0.00 0.00 -0.24 0.00 -3.89 0.00 0.00 57.50 53.37 1v32 n TRP 15 Cb 0.00 0.11 -0.01 0.00 -1.36 0.00 0.00 31.31 30.05 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 -4.56 1.36 0.53 -1.67 0.00 -1.26 -2.48 107.32 99.24 1v32 s GLY 16 Ca 0.00 -0.88 -0.21 0.00 0.00 0.00 0.00 44.72 43.63 1v32 s GLY 16 CO 0.00 -0.80 1.20 -0.45 0.00 0.00 0.00 173.10 173.05 1v32 s SER 17 N -4.05 5.67 0.29 1.64 0.15 -1.10 -2.23 113.70 114.07 1v32 s SER 17 Ca 0.41 2.37 -0.01 0.00 0.70 0.00 0.00 55.95 59.43 1v32 s SER 17 Cb -0.10 -2.60 0.66 0.00 -1.71 0.00 0.00 66.02 62.27 1v32 s SER 17 CO 0.37 -1.27 1.60 -0.09 1.20 0.00 0.00 173.24 175.05 1v32 h ARG 18 N 1.46 0.07 -0.01 5.44 2.43 -1.89 0.30 114.38 122.18 1v32 h ARG 18 Ca -0.50 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 58.67 1v32 h ARG 18 Cb 1.27 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.79 1v32 h ARG 18 CO 0.58 0.04 -0.17 1.96 -1.51 0.00 0.00 179.97 180.87 1v32 h GLN 19 N 0.07 -0.19 -0.68 0.20 4.20 -1.90 1.49 115.11 118.29 1v32 h GLN 19 Ca 0.54 0.01 0.12 0.00 0.06 0.00 0.00 58.65 59.39 1v32 h GLN 19 Cb 1.07 0.04 -0.09 0.00 0.30 0.00 0.00 27.48 28.81 1v32 h GLN 19 CO -0.81 -0.13 0.22 1.25 -0.67 0.00 0.00 178.83 178.69 1v32 h LEU 20 N -0.20 0.16 0.30 1.46 5.85 -1.47 -0.21 115.31 121.19 1v32 h LEU 20 Ca 0.01 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1v32 h LEU 20 Cb 0.22 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1v32 h LEU 20 CO -0.12 0.07 -0.31 0.40 -0.34 0.00 0.00 178.44 178.14 1v32 h ILE 21 N 0.36 0.00 -0.83 4.05 1.08 0.43 0.20 117.51 122.80 1v32 h ILE 21 Ca 0.36 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.97 1v32 h ILE 21 Cb 0.54 0.00 -0.15 0.00 -3.07 0.00 0.00 36.82 34.14 1v32 h ILE 21 CO -0.40 0.00 -0.33 -0.33 -0.69 0.00 0.00 178.15 176.40 1v32 h GLU 22 N -0.61 -0.05 -0.53 2.37 4.39 0.27 1.11 114.58 121.53 1v32 h GLU 22 Ca -0.04 0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.77 1v32 h GLU 22 Cb 0.53 0.01 -0.08 0.00 -0.10 0.00 0.00 28.75 29.11 1v32 h GLU 22 CO -0.04 -0.04 0.04 0.35 -1.16 0.00 0.00 179.01 178.16 1v32 h PHE 23 N -0.06 0.04 0.00 4.33 3.57 -0.70 0.60 116.94 124.73 1v32 h PHE 23 Ca 0.32 0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.78 1v32 h PHE 23 Cb 0.59 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.38 1v32 h PHE 23 CO -0.75 -0.09 -0.40 -0.07 -2.23 0.00 0.00 178.31 174.77 1v32 h LEU 24 N 0.16 0.00 0.21 0.59 3.38 0.19 -2.29 115.31 117.54 1v32 h LEU 24 Ca 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 1v32 h LEU 24 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1v32 h LEU 24 CO -0.41 0.40 -0.10 0.45 0.09 0.00 0.00 178.44 178.87 1v32 h HIS 25 N 0.00 -0.26 0.19 1.13 3.86 0.44 1.40 115.15 121.91 1v32 h HIS 25 Ca -0.00 -0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1v32 h HIS 25 Cb 0.72 0.08 -0.02 0.00 1.06 0.00 0.00 27.41 29.26 1v32 h HIS 25 CO 0.00 0.10 -0.32 0.77 0.86 0.00 0.00 177.93 179.33 1v32 h SER 26 N -0.66 -0.93 -1.43 2.45 0.02 0.12 0.95 113.55 114.07 1v32 h SER 26 Ca -0.03 0.09 0.42 0.00 -0.84 0.00 0.00 61.79 61.43 1v32 h SER 26 Cb 0.47 0.33 -0.06 0.00 0.14 0.00 0.00 62.40 63.28 1v32 h SER 26 CO 0.05 -0.38 1.15 -0.07 -1.14 0.00 0.00 176.83 176.44 1v32 h LEU 27 N -0.54 0.00 0.00 5.07 3.38 -1.50 -3.43 115.31 118.29 1v32 h LEU 27 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1v32 h LEU 27 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1v32 h LEU 27 CO -0.11 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.03 1v32 n GLY 28 N -1.80 1.06 3.63 0.83 0.00 0.33 -5.05 105.19 104.18 1v32 n GLY 28 Ca 0.32 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.49 3.94 0.16 1.61 -0.14 0.48 -4.97 119.74 120.33 1v32 s LYS 29 Ca 0.00 1.03 -0.31 0.00 -1.36 0.00 0.00 55.97 55.32 1v32 s LYS 29 Cb 0.00 -3.82 -0.11 0.00 -1.68 0.00 0.00 37.83 32.22 1v32 s LYS 29 CO 0.00 -1.08 1.78 0.34 -0.76 0.00 0.00 175.35 175.63 1v32 s ASP 30 N 2.23 6.40 -0.69 2.83 2.15 -1.26 -4.04 116.67 124.29 1v32 s ASP 30 Ca 0.50 2.82 0.04 0.00 0.43 0.00 0.00 52.55 56.33 1v32 s ASP 30 Cb -0.13 -2.58 0.32 0.00 -0.30 0.00 0.00 42.92 40.23 1v32 s ASP 30 CO 0.21 -0.99 1.09 0.35 -0.17 0.00 0.00 175.17 175.66 1v32 n THR 31 N 4.38 3.57 -0.08 1.71 -2.24 -1.26 -4.72 114.28 115.64 1v32 n THR 31 Ca 0.17 -5.61 -0.16 0.00 -2.27 0.00 0.00 64.05 56.18 1v32 n THR 31 Cb 0.37 -1.57 -0.14 0.00 -2.10 0.00 0.00 70.33 66.89 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 0.03 1.39 -4.18 3.42 2.88 -1.26 -4.93 113.62 110.96 1v32 n SER 32 Ca 0.33 0.03 -0.27 0.00 -1.33 0.00 0.00 58.87 57.63 1v32 n SER 32 Cb 0.37 -0.11 -0.16 0.00 -0.75 0.00 0.00 64.21 63.56 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 -2.53 1.86 -0.74 -1.46 2.02 -1.26 -5.05 118.70 111.55 1v32 s GLU 33 Ca -0.23 -0.69 -0.37 0.00 0.02 0.00 0.00 54.97 53.71 1v32 s GLU 33 Cb 0.08 -1.66 -0.20 0.00 0.10 0.00 0.00 34.13 32.45 1v32 s GLU 33 CO 0.72 0.32 2.38 -0.12 0.02 0.00 0.00 175.26 178.58 1v32 n MET 34 N 2.95 0.00 -2.69 1.61 0.00 -1.26 -4.84 117.12 112.89 1v32 n MET 34 Ca -0.17 0.00 -0.40 0.00 -0.00 0.00 0.00 57.70 57.13 1v32 n MET 34 Cb 0.53 -1.48 -0.05 0.00 0.00 0.00 0.00 33.22 32.22 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 7.38 4.03 0.30 1.12 1.01 -1.26 -4.99 121.20 128.78 1v32 s ILE 35 Ca 1.26 1.96 -0.30 0.00 0.00 0.00 0.00 60.65 63.57 1v32 s ILE 35 Cb -1.36 -4.25 -0.11 0.00 0.01 0.00 0.00 42.46 36.75 1v32 s ILE 35 CO 0.57 0.43 1.56 -0.44 0.00 0.00 0.00 174.94 177.06 1v32 s SER 36 N -0.88 6.40 0.57 3.58 0.01 -1.26 -4.84 113.70 117.28 1v32 s SER 36 Ca 0.43 2.93 0.28 0.00 1.31 0.00 0.00 55.95 60.90 1v32 s SER 36 Cb -0.27 -2.64 1.51 0.00 0.21 0.00 0.00 66.02 64.84 1v32 s SER 36 CO 0.33 -0.88 1.98 -0.09 0.41 0.00 0.00 173.24 174.99 1v32 h ARG 37 N 4.63 0.00 -0.54 12.44 2.43 -1.99 0.16 114.38 131.51 1v32 h ARG 37 Ca -0.47 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 58.59 1v32 h ARG 37 Cb 1.22 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.75 1v32 h ARG 37 CO 0.77 0.00 -0.07 -0.92 -1.51 0.00 0.00 179.97 178.24 1v32 h TYR 38 N 0.00 1.11 0.71 2.20 5.03 -1.97 -1.92 116.97 122.12 1v32 h TYR 38 Ca 0.19 -0.22 -0.03 0.00 2.58 0.00 0.00 58.73 61.25 1v32 h TYR 38 Cb 0.96 -0.28 0.01 0.00 1.55 0.00 0.00 36.73 38.96 1v32 h TYR 38 CO 0.00 1.02 -0.34 0.22 -1.32 0.00 0.00 178.16 177.74 1v32 h ASP 39 N 0.87 -0.81 -0.71 -2.11 3.58 -1.04 0.13 116.42 116.33 1v32 h ASP 39 Ca 0.14 0.03 0.11 0.00 0.42 0.00 0.00 57.03 57.73 1v32 h ASP 39 Cb 0.63 0.21 -0.12 0.00 1.72 0.00 0.00 39.33 41.76 1v32 h ASP 39 CO 0.04 -0.54 -0.39 0.58 -2.88 0.00 0.00 179.24 176.05 1v32 h VAL 40 N -1.04 0.09 0.13 2.25 2.07 -1.53 0.52 116.25 118.74 1v32 h VAL 40 Ca -0.10 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.44 1v32 h VAL 40 Cb 0.73 0.09 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 1v32 h VAL 40 CO 0.16 0.00 -0.48 0.77 0.02 0.00 0.00 177.57 178.04 1v32 h SER 41 N -0.14 -1.42 -0.92 0.57 4.64 -1.28 0.41 113.55 115.42 1v32 h SER 41 Ca 0.24 0.15 0.23 0.00 -0.47 0.00 0.00 61.79 61.94 1v32 h SER 41 Cb 0.56 0.53 -0.12 0.00 -0.31 0.00 0.00 62.40 63.05 1v32 h SER 41 CO -0.77 -0.53 0.44 -0.78 -0.87 0.00 0.00 176.83 174.32 1v32 h ASP 42 N -0.71 0.40 -0.72 4.97 1.82 0.12 0.70 116.42 123.00 1v32 h ASP 42 Ca 0.01 0.15 -0.07 0.00 -0.39 0.00 0.00 57.03 56.73 1v32 h ASP 42 Cb 0.73 0.11 -0.03 0.00 0.68 0.00 0.00 39.33 40.82 1v32 h ASP 42 CO -0.26 0.02 0.17 0.74 -1.61 0.00 0.00 179.24 178.30 1v32 h THR 43 N 0.44 1.26 0.62 2.25 2.02 0.17 -1.17 112.91 118.49 1v32 h THR 43 Ca 0.58 -0.98 -0.03 0.00 0.77 0.00 0.00 66.41 66.75 1v32 h THR 43 Cb 1.10 0.53 0.01 0.00 -1.74 0.00 0.00 68.15 68.04 1v32 h THR 43 CO -0.52 0.38 -0.30 0.40 0.37 0.00 0.00 175.52 175.86 1v32 h ILE 44 N 1.09 0.28 -0.78 3.11 2.04 0.45 0.59 117.51 124.28 1v32 h ILE 44 Ca 0.22 -0.27 0.18 0.00 1.00 0.00 0.00 64.86 65.99 1v32 h ILE 44 Cb 0.38 0.36 -0.12 0.00 -0.74 0.00 0.00 36.82 36.69 1v32 h ILE 44 CO 0.00 0.03 0.14 0.00 0.00 0.00 0.00 178.15 178.33 1v32 h ALA 45 N -0.80 0.98 0.21 1.87 0.00 -0.37 1.10 119.26 122.26 1v32 h ALA 45 Ca -0.08 0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1v32 h ALA 45 Cb 0.68 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1v32 h ALA 45 CO 0.14 -0.39 -0.10 -0.22 0.00 0.00 0.00 179.25 178.67 1v32 h LYS 46 N 0.21 -0.27 -0.53 0.00 3.64 -1.05 -2.54 116.57 116.03 1v32 h LYS 46 Ca 0.45 0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.94 1v32 h LYS 46 Cb 0.81 0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.62 1v32 h LYS 46 CO -0.59 -0.01 0.12 -0.92 -2.27 0.00 0.00 179.45 175.79 1v32 h TYR 47 N -0.52 0.20 -0.16 1.91 3.20 0.23 0.92 116.97 122.75 1v32 h TYR 47 Ca -0.03 0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.92 1v32 h TYR 47 Cb 0.39 -0.01 -0.07 0.00 1.54 0.00 0.00 36.73 38.58 1v32 h TYR 47 CO 0.00 0.00 -0.41 0.82 -1.64 0.00 0.00 178.16 176.94 1v32 h ILE 48 N 0.26 0.16 -0.34 1.81 2.04 0.12 0.31 117.51 121.88 1v32 h ILE 48 Ca 0.27 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.11 1v32 h ILE 48 Cb 0.36 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1v32 h ILE 48 CO -0.34 0.00 0.12 -1.28 0.00 0.00 0.00 178.15 176.65 1v32 h SER 49 N -0.46 0.49 -0.31 1.72 0.87 -0.93 1.74 113.55 116.67 1v32 h SER 49 Ca 0.09 -0.19 0.04 0.00 -1.23 0.00 0.00 61.79 60.50 1v32 h SER 49 Cb 0.61 -0.13 -0.07 0.00 -0.44 0.00 0.00 62.40 62.37 1v32 h SER 49 CO -0.41 0.55 -0.50 0.50 -0.53 0.00 0.00 176.83 176.43 1v32 h LYS 50 N 0.40 -0.39 -0.19 2.24 1.63 0.18 -1.28 116.57 119.17 1v32 h LYS 50 Ca 0.11 0.03 -0.16 0.00 -0.85 0.00 0.00 60.65 59.78 1v32 h LYS 50 Cb 0.22 0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 31.94 1v32 h LYS 50 CO -0.01 -0.26 -0.55 0.93 -3.45 0.00 0.00 179.45 176.11 1v32 h GLU 51 N -0.40 0.56 0.00 1.90 4.39 -0.34 -3.48 114.58 117.21 1v32 h GLU 51 Ca 0.06 -0.36 0.00 0.00 0.34 0.00 0.00 59.36 59.40 1v32 h GLU 51 Cb 0.56 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1v32 h GLU 51 CO -0.50 0.97 0.00 0.41 -1.16 0.00 0.00 179.01 178.73 1v32 n GLY 52 N 0.26 0.99 0.17 -3.84 0.00 0.50 -4.99 105.19 98.28 1v32 n GLY 52 Ca -0.03 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.12 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 -9.44 0.99 4.07 0.10 -3.46 115.31 107.58 1v32 h LEU 53 Ca 0.00 0.00 -0.50 0.00 0.08 0.00 0.00 57.88 57.46 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 -1.46 0.18 -1.08 0.00 0.00 178.44 176.08 1v32 n LEU 54 N -2.56 -2.58 -4.54 1.67 4.77 -1.25 0.14 117.00 112.65 1v32 n LEU 54 Ca 0.03 0.06 -0.34 0.00 -0.03 0.00 0.00 56.01 55.74 1v32 n LEU 54 Cb 0.36 -0.88 -0.12 0.00 -2.33 0.00 0.00 43.42 40.45 1v32 n LEU 54 CO 0.27 -3.56 -0.39 -0.62 -1.33 0.00 0.00 177.39 171.76 1v32 s ASP 55 N -1.56 4.54 0.33 -1.43 2.15 -1.24 -4.33 116.67 115.13 1v32 s ASP 55 Ca 0.49 -0.08 0.17 0.00 0.43 0.00 0.00 52.55 53.56 1v32 s ASP 55 Cb -0.10 -1.24 0.43 0.00 -0.30 0.00 0.00 42.92 41.71 1v32 s ASP 55 CO 0.69 0.32 1.61 1.55 -0.17 0.00 0.00 175.17 179.18 1v32 h PRO 56 N 5.56 0.00 0.00 4.34 0.13 -1.95 -1.44 132.00 138.64 1v32 h PRO 56 Ca -0.44 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.58 1v32 h PRO 56 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1v32 h PRO 56 CO 0.54 0.46 -0.51 1.03 -0.23 0.00 0.00 178.00 179.29 1v32 h SER 57 N 0.00 0.00 -0.51 1.44 0.87 -2.00 -3.43 113.55 109.92 1v32 h SER 57 Ca -0.00 0.00 0.14 0.00 -1.23 0.00 0.00 61.79 60.69 1v32 h SER 57 Cb 1.11 0.00 -0.19 0.00 -0.44 0.00 0.00 62.40 62.87 1v32 h SER 57 CO 0.06 0.51 -0.16 0.21 -0.53 0.00 0.00 176.83 176.93 1v32 s ASN 58 N -6.47 -0.83 0.51 6.23 2.47 -1.12 -5.01 114.94 110.72 1v32 s ASN 58 Ca 0.03 0.02 0.24 0.00 0.42 0.00 0.00 52.86 53.57 1v32 s ASN 58 Cb 0.09 1.46 1.33 0.00 -1.45 0.00 0.00 41.25 42.67 1v32 s ASN 58 CO 0.73 -0.14 1.97 0.11 -3.72 0.00 0.00 177.10 176.05 1v32 h LYS 59 N 7.29 0.09 -0.47 0.43 1.57 -1.54 0.46 116.57 124.40 1v32 h LYS 59 Ca -0.05 -0.01 0.14 0.00 -1.87 0.00 0.00 60.65 58.86 1v32 h LYS 59 Cb 1.19 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.46 1v32 h LYS 59 CO -0.01 0.06 0.46 0.87 -0.57 0.00 0.00 179.45 180.26 1v32 h LYS 60 N 0.09 0.00 -6.91 3.15 1.79 -1.95 -3.41 116.57 109.33 1v32 h LYS 60 Ca 0.29 0.00 -0.46 0.00 -2.18 0.00 0.00 60.65 58.30 1v32 h LYS 60 Cb 1.03 0.00 0.06 0.00 -1.58 0.00 0.00 32.23 31.74 1v32 h LYS 60 CO -0.03 0.00 0.01 0.15 -1.08 0.00 0.00 179.45 178.50 1v32 s LYS 61 N -4.68 2.15 -0.03 3.15 1.02 0.16 -2.85 119.74 118.67 1v32 s LYS 61 Ca -0.04 -1.06 0.00 0.00 0.02 0.00 0.00 55.97 54.89 1v32 s LYS 61 Cb 0.16 -2.46 0.03 0.00 -0.52 0.00 0.00 37.83 35.05 1v32 s LYS 61 CO 0.58 -1.03 0.01 0.08 -0.92 0.00 0.00 175.35 174.07 1v32 s VAL 62 N -2.89 0.13 -0.54 3.17 1.01 0.20 -3.59 120.40 117.89 1v32 s VAL 62 Ca 0.62 0.13 -0.16 0.00 0.00 0.00 0.00 61.98 62.56 1v32 s VAL 62 Cb -0.08 -0.25 0.13 0.00 0.00 0.00 0.00 36.38 36.18 1v32 s VAL 62 CO 0.41 0.14 0.50 -0.69 0.00 0.00 0.00 175.10 175.46 1v32 s VAL 63 N 1.13 5.21 0.74 2.92 1.01 0.37 -0.24 120.40 131.54 1v32 s VAL 63 Ca -0.08 -1.47 -0.16 0.00 0.00 0.00 0.00 61.98 60.28 1v32 s VAL 63 Cb -0.13 -4.33 0.00 0.00 0.00 0.00 0.00 36.38 31.92 1v32 s VAL 63 CO -0.02 -0.85 0.83 0.00 0.00 0.00 0.00 175.10 175.05 1v32 n ASP 65 N -1.38 0.34 0.15 0.00 2.03 -1.26 -4.89 116.55 111.54 1v32 n ASP 65 Ca 0.12 0.05 0.00 0.00 0.52 0.00 0.00 54.79 55.48 1v32 n ASP 65 Cb 0.50 -0.17 0.00 0.00 -0.72 0.00 0.00 41.12 40.73 1v32 n ASP 65 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1v32 n LYS 66 N -2.81 0.00 -0.10 -0.67 5.02 -1.26 -4.79 118.16 113.55 1v32 n LYS 66 Ca -0.01 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.23 1v32 n LYS 66 Cb 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.04 1v32 n LYS 66 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1v32 h ARG 67 N 0.00 -0.03 -0.29 1.97 3.08 -1.98 0.42 114.38 117.55 1v32 h ARG 67 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1v32 h ARG 67 Cb 0.00 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1v32 h ARG 67 CO 0.00 -0.02 0.18 -0.07 -1.07 0.00 0.00 179.97 178.99 1v32 h LEU 68 N -0.03 0.34 0.06 3.04 3.38 -1.95 0.24 115.31 120.38 1v32 h LEU 68 Ca 0.17 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.13 1v32 h LEU 68 Cb 0.29 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 1v32 h LEU 68 CO -0.37 0.28 -0.33 0.58 0.09 0.00 0.00 178.44 178.69 1v32 h VAL 69 N 0.38 0.30 -0.65 1.22 2.07 -1.46 1.52 116.25 119.62 1v32 h VAL 69 Ca 0.11 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.75 1v32 h VAL 69 Cb -0.00 0.30 -0.04 0.00 -1.52 0.00 0.00 31.29 30.02 1v32 h VAL 69 CO -0.02 0.00 0.44 0.25 0.02 0.00 0.00 177.57 178.26 1v32 h LEU 70 N -0.52 0.32 0.12 2.57 5.85 0.06 1.49 115.31 125.21 1v32 h LEU 70 Ca 0.05 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1v32 h LEU 70 Cb 0.58 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.55 1v32 h LEU 70 CO -0.23 0.18 -0.06 0.25 -0.34 0.00 0.00 178.44 178.24 1v32 h LEU 71 N 0.35 -0.14 0.00 2.25 5.85 0.13 -3.43 115.31 120.32 1v32 h LEU 71 Ca 0.31 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.04 1v32 h LEU 71 Cb 0.74 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.80 1v32 h LEU 71 CO -0.08 0.02 -0.07 -0.26 -0.34 0.00 0.00 178.44 177.70 1v32 h PHE 72 N -0.40 0.00 0.00 1.25 0.04 0.23 -3.45 116.94 114.61 1v32 h PHE 72 Ca -0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.75 1v32 h PHE 72 Cb 0.13 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.28 1v32 h PHE 72 CO 0.05 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 178.17 1v32 n GLY 73 N 1.83 0.73 3.98 -1.45 0.00 0.51 -4.98 105.19 105.80 1v32 n GLY 73 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.63 4.23 -0.10 2.61 -4.23 -1.26 -4.97 115.64 110.29 1v32 s THR 74 Ca 0.00 -1.01 0.01 0.00 -1.18 0.00 0.00 61.69 59.51 1v32 s THR 74 Cb 0.00 -3.47 -0.25 0.00 1.34 0.00 0.00 72.50 70.13 1v32 s THR 74 CO 0.00 -0.18 0.44 -1.14 -0.54 0.00 0.00 174.62 173.20 1v32 n ARG 75 N -1.60 0.71 -4.15 3.99 3.00 -1.26 -4.37 116.66 112.99 1v32 n ARG 75 Ca -0.01 0.26 -0.16 0.00 -0.00 0.00 0.00 57.85 57.94 1v32 n ARG 75 Cb 0.58 -1.73 -0.12 0.00 0.00 0.00 0.00 32.46 31.19 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 -2.57 0.71 0.12 5.15 -4.23 -1.26 0.42 115.64 113.98 1v32 s THR 76 Ca -0.16 -0.96 -0.01 0.00 -1.18 0.00 0.00 61.69 59.37 1v32 s THR 76 Cb 0.07 -0.71 0.01 0.00 1.34 0.00 0.00 72.50 73.20 1v32 s THR 76 CO 0.78 -0.21 0.18 2.30 -0.54 0.00 0.00 174.62 177.14 1v32 n ILE 77 N 1.75 0.00 -4.15 2.99 -5.35 0.67 -4.94 119.36 110.33 1v32 n ILE 77 Ca -0.20 -0.58 -0.34 0.00 -0.27 0.00 0.00 62.75 61.36 1v32 n ILE 77 Cb 0.55 0.37 -0.15 0.00 -1.74 0.00 0.00 39.64 38.68 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 -4.59 2.86 0.59 4.28 0.40 -1.26 0.59 117.98 120.85 1v32 s PHE 78 Ca 0.09 -1.13 0.33 0.00 -0.60 0.00 0.00 56.93 55.63 1v32 s PHE 78 Cb -0.00 -1.99 1.30 0.00 0.51 0.00 0.00 43.02 42.83 1v32 s PHE 78 CO 0.07 -0.58 1.56 -0.09 0.70 0.00 0.00 175.22 176.88 1v32 h ARG 79 N 7.80 0.00 0.18 0.44 2.43 -1.78 1.20 114.38 124.64 1v32 h ARG 79 Ca -0.40 0.00 -0.30 0.00 -0.81 0.00 0.00 59.98 58.47 1v32 h ARG 79 Cb 1.16 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 30.73 1v32 h ARG 79 CO 0.60 0.00 -1.43 0.52 -1.51 0.00 0.00 179.97 178.15 1v32 h MET 80 N 0.00 0.38 0.00 0.20 2.86 -1.93 -3.27 114.93 113.16 1v32 h MET 80 Ca 0.52 -0.65 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 1v32 h MET 80 Cb 2.59 0.24 -0.00 0.00 0.06 0.00 0.00 31.60 34.49 1v32 h MET 80 CO -0.01 1.31 -0.06 0.87 1.06 0.00 0.00 176.91 180.09 1v32 h LYS 81 N -0.07 0.00 -0.85 1.72 1.79 0.93 -3.05 116.57 117.04 1v32 h LYS 81 Ca -0.28 0.00 0.08 0.00 -2.18 0.00 0.00 60.65 58.27 1v32 h LYS 81 Cb 1.95 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 32.50 1v32 h LYS 81 CO 0.17 0.06 -0.52 0.28 -1.08 0.00 0.00 179.45 178.37 1v32 h VAL 82 N 0.00 0.00 -0.39 0.50 2.07 -0.91 1.51 116.25 119.03 1v32 h VAL 82 Ca -0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 1v32 h VAL 82 Cb 0.23 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 29.91 1v32 h VAL 82 CO 0.01 0.00 -0.55 0.22 0.02 0.00 0.00 177.57 177.27 1v32 h TYR 83 N -0.02 -1.68 -0.16 1.57 5.03 -1.75 0.12 116.97 120.07 1v32 h TYR 83 Ca 0.14 0.08 0.05 0.00 2.58 0.00 0.00 58.73 61.57 1v32 h TYR 83 Cb 0.37 0.78 -0.05 0.00 1.55 0.00 0.00 36.73 39.38 1v32 h TYR 83 CO -1.00 -0.49 -0.15 -0.44 -1.32 0.00 0.00 178.16 174.76 1v32 h ASP 84 N -0.41 -0.47 -0.97 -2.11 3.32 -1.13 0.23 116.42 114.88 1v32 h ASP 84 Ca 0.07 0.09 0.32 0.00 0.02 0.00 0.00 57.03 57.53 1v32 h ASP 84 Cb 0.60 0.23 -0.16 0.00 0.22 0.00 0.00 39.33 40.22 1v32 h ASP 84 CO -0.58 -0.19 0.38 -0.07 -1.72 0.00 0.00 179.24 177.05 1v32 h LEU 85 N -0.17 0.15 -0.25 1.55 3.38 0.34 1.26 115.31 121.57 1v32 h LEU 85 Ca 0.10 0.23 -0.10 0.00 0.09 0.00 0.00 57.88 58.20 1v32 h LEU 85 Cb 0.32 0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 1v32 h LEU 85 CO -0.26 -0.27 -0.25 -0.07 0.09 0.00 0.00 178.44 177.68 1v32 h LEU 86 N 0.15 0.66 -1.79 1.67 3.38 0.85 -2.92 115.31 117.30 1v32 h LEU 86 Ca 0.70 -0.47 0.53 0.00 0.09 0.00 0.00 57.88 58.72 1v32 h LEU 86 Cb 1.61 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 42.09 1v32 h LEU 86 CO -0.72 1.00 1.28 1.21 0.09 0.00 0.00 178.44 181.29 1v32 n GLU 87 N -4.34 -0.00 -0.05 1.13 2.13 0.43 0.66 120.64 120.60 1v32 n GLU 87 Ca -0.04 1.04 -0.02 0.00 0.66 0.00 0.00 57.16 58.80 1v32 n GLU 87 Cb 0.44 -2.35 -0.02 0.00 0.27 0.00 0.00 31.44 29.79 1v32 n GLU 87 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1v32 h LYS 88 N 0.00 0.00 -0.95 5.31 1.57 -1.30 -3.34 116.57 117.87 1v32 h LYS 88 Ca 0.88 0.00 0.23 0.00 -1.87 0.00 0.00 60.65 59.89 1v32 h LYS 88 Cb 3.45 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 35.58 1v32 h LYS 88 CO -0.07 0.12 -0.07 0.45 -0.57 0.00 0.00 179.45 179.31 1v32 h HIS 89 N -1.00 -0.22 -4.04 -1.35 3.86 0.25 -3.40 115.15 109.26 1v32 h HIS 89 Ca -0.00 0.07 -0.54 0.00 -1.16 0.00 0.00 60.37 58.74 1v32 h HIS 89 Cb 0.13 0.25 0.18 0.00 1.06 0.00 0.00 27.41 29.03 1v32 h HIS 89 CO 0.03 -0.40 0.24 0.66 0.86 0.00 0.00 177.93 179.31 1v32 n TYR 90 N -5.51 1.02 -0.02 2.45 4.02 0.23 -2.70 117.16 116.65 1v32 n TYR 90 Ca 0.19 0.40 0.00 0.00 -0.01 0.00 0.00 57.90 58.48 1v32 n TYR 90 Cb 0.62 -2.09 0.00 0.00 -0.02 0.00 0.00 39.34 37.85 1v32 n TYR 90 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1v32 n LYS 91 N -2.76 3.52 0.00 -0.72 4.81 -1.03 -4.89 118.16 117.09 1v32 n LYS 91 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.57 1v32 n LYS 91 Cb 0.50 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.55 1v32 n LYS 91 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 1v32 n GLU 92 N 0.00 0.00 -1.61 1.64 0.00 -1.26 -5.03 120.64 114.38 1v32 n GLU 92 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 57.16 56.69 1v32 n GLU 92 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 31.44 31.39 1v32 n GLU 92 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 1v32 n ASN 93 N 0.00 3.18 -1.14 -1.84 5.15 -1.26 -4.51 115.26 114.85 1v32 n ASN 93 Ca 0.00 0.67 0.06 0.00 -0.60 0.00 0.00 54.58 54.70 1v32 n ASN 93 Cb 0.00 -1.40 -0.03 0.00 -0.53 0.00 0.00 39.78 37.81 1v32 n ASN 93 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1v32 n GLN 94 N 7.56 -2.83 -4.38 1.20 6.02 -1.26 -4.92 117.38 118.77 1v32 n GLN 94 Ca 0.28 2.25 -0.34 0.00 -0.01 0.00 0.00 57.00 59.18 1v32 n GLN 94 Cb 0.33 -2.97 -0.11 0.00 1.02 0.00 0.00 30.24 28.51 1v32 n GLN 94 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1v32 s ASP 95 N -5.53 5.01 0.13 1.08 1.01 -1.26 -5.08 116.67 112.03 1v32 s ASP 95 Ca 0.00 0.00 -0.24 0.00 0.71 0.00 0.00 52.55 53.02 1v32 s ASP 95 Cb 0.00 -1.61 0.08 0.00 1.01 0.00 0.00 42.92 42.40 1v32 s ASP 95 CO 0.00 0.27 1.12 -0.55 0.21 0.00 0.00 175.17 176.21 1v32 s SER 96 N -0.23 0.02 0.00 0.27 0.15 -1.26 -5.09 113.70 107.56 1v32 s SER 96 Ca 0.05 -0.55 0.00 0.00 0.70 0.00 0.00 55.95 56.14 1v32 s SER 96 Cb -0.13 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.58 1v32 s SER 96 CO 0.02 -0.79 0.00 0.61 1.20 0.00 0.00 173.24 174.28 1v32 n GLY 97 N -0.79 0.40 0.16 9.45 0.00 -1.26 -4.55 105.19 108.60 1v32 n GLY 97 Ca -0.00 0.04 0.03 0.00 0.00 0.00 0.00 46.02 46.09 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 0.00 0.00 1.61 0.13 -2.06 -3.43 132.00 128.25 1v32 h PRO 98 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1v32 h PRO 98 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1v32 h PRO 98 CO 0.00 0.47 0.00 0.45 -0.23 0.00 0.00 178.00 178.69 1v32 n SER 99 N -3.44 -0.53 0.00 1.44 2.88 -1.26 -5.11 113.62 107.59 1v32 n SER 99 Ca 0.00 0.28 0.00 0.00 -1.33 0.00 0.00 58.87 57.82 1v32 n SER 99 Cb 0.61 0.64 0.00 0.00 -0.75 0.00 0.00 64.21 64.71 1v32 n SER 99 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1v32 n SER 100 N -2.95 0.00 0.00 -3.46 2.88 -1.26 -5.20 113.62 103.63 1v32 n SER 100 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1v32 n SER 100 Cb 0.00 0.13 0.00 0.00 -0.75 0.00 0.00 64.21 63.59 1v32 n SER 100 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42