#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p97 s ALA 2 N 0.00 3.44 -0.08 4.61 0.00 -1.26 -5.06 121.76 123.41 1p97 s ALA 2 Ca 0.00 -2.45 -0.04 0.00 0.00 0.00 0.00 51.96 49.47 1p97 s ALA 2 Cb 0.00 -2.90 -0.04 0.00 0.00 0.00 0.00 23.12 20.19 1p97 s ALA 2 CO 0.00 -1.88 0.08 -1.64 0.00 0.00 0.00 175.76 172.33 1p97 s MET 3 N 1.43 3.21 0.33 0.00 1.00 -1.26 -5.10 119.30 118.91 1p97 s MET 3 Ca 0.05 -0.30 -0.09 0.00 0.00 0.00 0.00 55.69 55.35 1p97 s MET 3 Cb -0.26 -2.99 -0.06 0.00 0.00 0.00 0.00 34.83 31.52 1p97 s MET 3 CO 0.01 0.72 0.66 -0.51 0.00 0.00 0.00 175.02 175.90 1p97 s ASP 4 N -1.16 6.53 -0.18 3.03 1.01 -1.26 -5.07 116.67 119.57 1p97 s ASP 4 Ca 0.17 0.96 -0.16 0.00 0.71 0.00 0.00 52.55 54.23 1p97 s ASP 4 Cb -0.12 -2.25 -0.04 0.00 1.01 0.00 0.00 42.92 41.52 1p97 s ASP 4 CO 0.06 -0.26 0.38 -0.44 0.21 0.00 0.00 175.17 175.12 1p97 s SER 5 N -2.97 6.47 -0.44 0.27 0.01 -1.26 -5.02 113.70 110.75 1p97 s SER 5 Ca 0.48 0.55 -0.21 0.00 1.31 0.00 0.00 55.95 58.08 1p97 s SER 5 Cb -0.11 -2.23 0.02 0.00 0.21 0.00 0.00 66.02 63.92 1p97 s SER 5 CO 0.28 -0.02 0.66 -0.54 0.41 0.00 0.00 173.24 174.03 1p97 s LYS 6 N 1.02 3.32 -0.18 12.44 3.01 -1.21 -4.93 119.74 133.21 1p97 s LYS 6 Ca 0.19 -0.31 -0.02 0.00 -1.01 0.00 0.00 55.97 54.83 1p97 s LYS 6 Cb -0.14 -3.94 -0.01 0.00 -1.01 0.00 0.00 37.83 32.73 1p97 s LYS 6 CO 0.07 -1.01 -0.09 0.99 0.51 0.00 0.00 175.35 175.82 1p97 s THR 7 N 2.89 3.15 -0.04 2.17 2.01 -1.26 -0.18 115.64 124.38 1p97 s THR 7 Ca 0.24 -0.60 0.02 0.00 0.31 0.00 0.00 61.69 61.67 1p97 s THR 7 Cb -0.14 -2.38 0.01 0.00 0.01 0.00 0.00 72.50 70.00 1p97 s THR 7 CO 0.19 0.48 -0.10 0.72 -0.69 0.00 0.00 174.62 175.23 1p97 s PHE 8 N 0.93 1.08 0.35 4.92 -0.71 -0.89 -4.97 117.98 118.69 1p97 s PHE 8 Ca -0.02 -0.30 -0.26 0.00 -1.04 0.00 0.00 56.93 55.31 1p97 s PHE 8 Cb -0.15 -0.78 -0.09 0.00 -1.21 0.00 0.00 43.02 40.79 1p97 s PHE 8 CO -0.00 -0.14 1.08 -1.17 -1.34 0.00 0.00 175.22 173.64 1p97 s LEU 9 N 0.34 4.31 0.05 -1.99 1.98 -1.26 -2.69 118.68 119.42 1p97 s LEU 9 Ca -0.06 2.16 0.02 0.00 -2.89 0.00 0.00 54.13 53.36 1p97 s LEU 9 Cb -0.11 -3.95 -0.03 0.00 0.66 0.00 0.00 46.19 42.76 1p97 s LEU 9 CO 0.01 -0.38 -0.08 -0.44 -1.89 0.00 0.00 176.35 173.58 1p97 s SER 10 N -1.25 0.91 -0.01 3.68 0.01 0.18 -0.80 113.70 116.41 1p97 s SER 10 Ca 0.53 -0.64 0.03 0.00 1.31 0.00 0.00 55.95 57.18 1p97 s SER 10 Cb -0.27 0.05 -0.00 0.00 0.21 0.00 0.00 66.02 66.00 1p97 s SER 10 CO 0.34 -0.25 -0.10 -0.13 0.41 0.00 0.00 173.24 173.50 1p97 s ARG 11 N -2.01 0.91 0.46 12.44 1.81 0.40 -1.34 118.95 131.63 1p97 s ARG 11 Ca -0.06 -0.37 0.03 0.00 -1.72 0.00 0.00 55.73 53.61 1p97 s ARG 11 Cb -0.07 -0.87 -0.02 0.00 -0.45 0.00 0.00 34.95 33.54 1p97 s ARG 11 CO -0.01 0.20 0.04 -1.01 -0.68 0.00 0.00 175.30 173.85 1p97 s HIS 12 N -0.12 1.91 -0.01 -0.53 3.76 -0.17 0.06 115.29 120.19 1p97 s HIS 12 Ca 0.02 -1.03 0.00 0.00 -0.15 0.00 0.00 55.06 53.90 1p97 s HIS 12 Cb -0.05 -1.47 0.02 0.00 1.11 0.00 0.00 32.58 32.18 1p97 s HIS 12 CO -0.00 0.08 0.02 0.45 -0.85 0.00 0.00 174.74 174.43 1p97 s SER 13 N -3.76 0.10 0.00 1.40 0.15 -1.26 0.25 113.70 110.58 1p97 s SER 13 Ca 0.15 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.82 1p97 s SER 13 Cb 0.03 -0.07 0.00 0.00 -1.71 0.00 0.00 66.02 64.27 1p97 s SER 13 CO 0.08 -0.08 0.00 1.15 1.20 0.00 0.00 173.24 175.59 1p97 n MET 14 N 3.82 0.00 0.33 5.44 0.00 -1.25 -0.49 117.12 124.96 1p97 n MET 14 Ca -0.23 0.00 0.21 0.00 0.00 0.00 0.00 57.70 57.69 1p97 n MET 14 Cb 0.53 0.00 1.16 0.00 0.00 0.00 0.00 33.22 34.91 1p97 n MET 14 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 175.97 176.19 1p97 h ASP 15 N 0.00 0.00 -1.99 3.17 3.58 -1.96 -3.46 116.42 115.76 1p97 h ASP 15 Ca 0.00 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.28 1p97 h ASP 15 Cb 0.00 0.00 0.02 0.00 1.72 0.00 0.00 39.33 41.07 1p97 h ASP 15 CO 0.00 0.00 -0.25 0.80 -2.88 0.00 0.00 179.24 176.91 1p97 n MET 16 N -3.18 -1.79 0.05 0.28 0.00 0.35 -4.98 117.12 107.84 1p97 n MET 16 Ca -0.03 0.40 -0.03 0.00 -0.00 0.00 0.00 57.70 58.04 1p97 n MET 16 Cb 0.10 -4.23 -0.02 0.00 0.00 0.00 0.00 33.22 29.07 1p97 n MET 16 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 175.97 177.54 1p97 h LYS 17 N -0.46 -0.21 0.00 2.12 2.10 -1.80 -3.40 116.57 114.92 1p97 h LYS 17 Ca -0.22 0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.44 1p97 h LYS 17 Cb 1.16 0.05 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 1p97 h LYS 17 CO 0.24 -0.14 0.00 1.19 -2.00 0.00 0.00 179.45 178.75 1p97 n PHE 18 N -4.79 0.00 -0.00 0.07 3.72 -1.21 -2.65 117.46 112.60 1p97 n PHE 18 Ca -0.03 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.38 1p97 n PHE 18 Cb 0.09 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.61 1p97 n PHE 18 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1p97 n THR 19 N 0.00 0.02 -3.72 4.37 -2.24 0.11 -2.25 114.28 110.57 1p97 n THR 19 Ca 0.00 -0.04 -0.14 0.00 -2.27 0.00 0.00 64.05 61.60 1p97 n THR 19 Cb 0.00 0.26 -0.09 0.00 -2.10 0.00 0.00 70.33 68.39 1p97 n THR 19 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1p97 s TYR 20 N -2.11 -0.40 -0.05 4.78 6.14 -0.91 -4.72 117.35 120.09 1p97 s TYR 20 Ca -0.01 0.91 0.01 0.00 0.64 0.00 0.00 57.07 58.62 1p97 s TYR 20 Cb 0.01 0.16 0.02 0.00 0.42 0.00 0.00 41.96 42.57 1p97 s TYR 20 CO 0.07 -0.29 -0.05 0.00 0.64 0.00 0.00 175.55 175.92 1p97 s ASP 22 N 0.99 4.95 0.54 0.00 -1.08 0.02 -4.72 116.67 117.37 1p97 s ASP 22 Ca -0.10 2.60 0.20 0.00 -0.52 0.00 0.00 52.55 54.73 1p97 s ASP 22 Cb -0.14 -2.62 1.42 0.00 -1.46 0.00 0.00 42.92 40.12 1p97 s ASP 22 CO -0.00 -1.77 2.18 0.44 0.52 0.00 0.00 175.17 176.53 1p97 h ASP 23 N 0.90 0.00 -0.01 -0.34 3.32 -2.00 -0.69 116.42 117.60 1p97 h ASP 23 Ca -0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1p97 h ASP 23 Cb 1.32 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.87 1p97 h ASP 23 CO 0.55 0.00 0.07 0.03 -1.72 0.00 0.00 179.24 178.16 1p97 h ARG 24 N 0.00 0.00 -0.13 3.56 3.08 -1.94 -2.55 114.38 116.40 1p97 h ARG 24 Ca 0.00 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.09 1p97 h ARG 24 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1p97 h ARG 24 CO -0.00 0.00 0.10 0.97 -1.07 0.00 0.00 179.97 179.97 1p97 h ILE 25 N 0.00 0.81 -0.96 2.04 2.10 -1.45 0.38 117.51 120.43 1p97 h ILE 25 Ca 0.01 0.00 0.14 0.00 1.08 0.00 0.00 64.86 66.09 1p97 h ILE 25 Cb 0.14 0.93 -0.08 0.00 -1.09 0.00 0.00 36.82 36.71 1p97 h ILE 25 CO -0.00 0.00 0.61 0.71 -1.08 0.00 0.00 178.15 178.39 1p97 h THR 26 N 0.00 0.85 0.00 2.19 1.35 -1.38 0.34 112.91 116.26 1p97 h THR 26 Ca 0.06 -0.28 -0.08 0.00 -0.55 0.00 0.00 66.41 65.56 1p97 h THR 26 Cb 0.27 -0.06 -0.01 0.00 -1.73 0.00 0.00 68.15 66.62 1p97 h THR 26 CO -0.00 0.15 -0.85 -0.33 -0.25 0.00 0.00 175.52 174.24 1p97 h GLU 27 N 0.83 0.00 0.00 4.72 4.39 -1.16 -3.10 114.58 120.26 1p97 h GLU 27 Ca 0.49 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.92 1p97 h GLU 27 Cb 0.66 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.27 1p97 h GLU 27 CO -0.26 0.21 -1.78 1.28 -1.16 0.00 0.00 179.01 177.30 1p97 n LEU 28 N -2.95 1.93 -0.38 1.33 4.77 -0.52 -4.57 117.00 116.61 1p97 n LEU 28 Ca -0.02 0.38 0.09 0.00 -0.03 0.00 0.00 56.01 56.43 1p97 n LEU 28 Cb 0.68 -0.83 -0.01 0.00 -2.33 0.00 0.00 43.42 40.94 1p97 n LEU 28 CO 0.40 0.23 0.25 -0.38 -1.33 0.00 0.00 177.39 176.56 1p97 n ILE 29 N -4.36 0.00 0.00 -0.08 2.08 0.11 -4.91 119.36 112.19 1p97 n ILE 29 Ca -0.37 -0.29 0.00 0.00 0.56 0.00 0.00 62.75 62.65 1p97 n ILE 29 Cb 0.71 1.20 0.00 0.00 -0.75 0.00 0.00 39.64 40.80 1p97 n ILE 29 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1p97 n GLY 30 N 1.26 2.90 3.84 7.39 0.00 -0.83 -0.59 105.19 119.17 1p97 n GLY 30 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 1p97 n GLY 30 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1p97 n TYR 31 N -1.42 -3.71 -3.62 1.61 4.01 -1.26 -4.83 117.16 107.94 1p97 n TYR 31 Ca 0.00 -1.33 -0.31 0.00 -0.16 0.00 0.00 57.90 56.11 1p97 n TYR 31 Cb 0.00 -0.94 -0.04 0.00 -0.31 0.00 0.00 39.34 38.05 1p97 n TYR 31 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1p97 s HIS 32 N -3.67 3.47 0.32 -0.72 2.46 -1.26 -3.08 115.29 112.81 1p97 s HIS 32 Ca 0.73 0.56 0.07 0.00 0.47 0.00 0.00 55.06 56.89 1p97 s HIS 32 Cb -0.02 -2.02 0.78 0.00 -0.13 0.00 0.00 32.58 31.19 1p97 s HIS 32 CO 0.50 0.38 1.80 -1.35 -2.47 0.00 0.00 174.74 173.60 1p97 h PRO 33 N 2.55 0.71 0.00 2.88 0.11 -1.84 0.14 132.00 136.56 1p97 h PRO 33 Ca -0.46 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 1p97 h PRO 33 Cb 1.17 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 1p97 h PRO 33 CO 0.71 0.47 -0.06 0.93 -0.21 0.00 0.00 178.00 179.84 1p97 h GLU 34 N 0.73 0.00 0.00 1.05 4.39 -1.93 -1.37 114.58 117.45 1p97 h GLU 34 Ca 0.55 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 60.06 1p97 h GLU 34 Cb 0.90 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.52 1p97 h GLU 34 CO -0.33 0.06 -0.91 0.93 -1.16 0.00 0.00 179.01 177.60 1p97 h GLU 35 N 0.00 0.00 0.00 2.33 5.08 -1.11 -3.36 114.58 117.52 1p97 h GLU 35 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1p97 h GLU 35 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 1p97 h GLU 35 CO 0.01 0.91 -0.16 -0.07 -1.00 0.00 0.00 179.01 178.70 1p97 h LEU 36 N 0.00 0.00 0.00 1.33 4.07 -1.19 -3.47 115.31 116.04 1p97 h LEU 36 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1p97 h LEU 36 Cb 1.62 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.36 1p97 h LEU 36 CO 0.12 0.29 0.00 0.18 -1.08 0.00 0.00 178.44 177.95 1p97 n LEU 37 N -3.24 0.00 -3.21 1.67 4.77 -0.53 -2.37 117.00 114.08 1p97 n LEU 37 Ca -0.02 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.67 1p97 n LEU 37 Cb 0.08 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.15 1p97 n LEU 37 CO 0.03 0.00 2.81 0.61 -1.33 0.00 0.00 177.39 179.51 1p97 n GLY 38 N 0.00 3.60 3.39 -0.72 0.00 -0.95 -3.82 105.19 106.68 1p97 n GLY 38 Ca 0.00 -1.13 -0.22 0.00 0.00 0.00 0.00 46.02 44.67 1p97 n GLY 38 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1p97 s ARG 39 N 2.83 1.44 -0.48 1.61 1.70 -1.00 -4.95 118.95 120.10 1p97 s ARG 39 Ca 0.53 -1.60 -0.28 0.00 -0.47 0.00 0.00 55.73 53.91 1p97 s ARG 39 Cb 0.14 -1.44 0.00 0.00 -0.57 0.00 0.00 34.95 33.08 1p97 s ARG 39 CO -0.04 0.27 1.52 -1.12 -1.08 0.00 0.00 175.30 174.85 1p97 s SER 40 N -3.17 6.07 0.23 -2.89 0.01 -1.26 -3.31 113.70 109.38 1p97 s SER 40 Ca 0.23 0.63 -0.09 0.00 1.31 0.00 0.00 55.95 58.03 1p97 s SER 40 Cb -0.04 -2.54 0.37 0.00 0.21 0.00 0.00 66.02 64.02 1p97 s SER 40 CO 0.10 -1.69 1.64 0.00 0.41 0.00 0.00 173.24 173.69 1p97 h ALA 41 N 11.65 0.67 0.00 1.44 0.00 -1.72 -2.70 119.26 128.61 1p97 h ALA 41 Ca -0.28 0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1p97 h ALA 41 Cb 1.12 0.43 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1p97 h ALA 41 CO 1.13 -0.42 0.19 0.66 0.00 0.00 0.00 179.25 180.81 1p97 n TYR 42 N -5.36 0.24 1.47 0.00 4.02 -1.26 0.40 117.16 116.66 1p97 n TYR 42 Ca 0.12 0.13 0.14 0.00 -0.01 0.00 0.00 57.90 58.27 1p97 n TYR 42 Cb 0.42 -0.55 0.75 0.00 -0.02 0.00 0.00 39.34 39.95 1p97 n TYR 42 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1p97 n GLU 43 N -1.70 0.54 0.00 -0.72 -0.58 -1.02 -4.06 120.64 113.10 1p97 n GLU 43 Ca -0.00 0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 1p97 n GLU 43 Cb 0.20 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 1p97 n GLU 43 CO 0.00 0.00 0.00 1.97 -0.48 0.00 0.00 177.13 178.62 1p97 n PHE 44 N -1.21 0.00 -0.97 -0.32 -1.74 0.53 -5.02 117.46 108.73 1p97 n PHE 44 Ca 0.16 0.00 -0.35 0.00 -0.56 0.00 0.00 57.45 56.69 1p97 n PHE 44 Cb 0.19 0.00 -0.11 0.00 1.52 0.00 0.00 39.48 41.08 1p97 n PHE 44 CO 0.00 0.00 0.00 0.98 -0.56 0.00 0.00 176.76 177.18 1p97 n TYR 45 N 0.00 0.64 -2.39 2.97 9.36 0.16 -2.88 117.16 125.02 1p97 n TYR 45 Ca 0.00 -0.62 -0.02 0.00 3.32 0.00 0.00 57.90 60.58 1p97 n TYR 45 Cb 0.00 -1.49 -0.02 0.00 -0.63 0.00 0.00 39.34 37.20 1p97 n TYR 45 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 1p97 n HIS 46 N 12.23 -3.34 0.39 2.98 8.25 -1.24 -4.01 115.22 130.47 1p97 n HIS 46 Ca 0.46 1.74 0.13 0.00 -0.26 0.00 0.00 57.72 59.79 1p97 n HIS 46 Cb 0.43 -3.43 0.41 0.00 1.12 0.00 0.00 29.99 28.52 1p97 n HIS 46 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1p97 h ALA 47 N 2.81 1.00 0.00 -1.41 0.00 -1.76 0.23 119.26 120.13 1p97 h ALA 47 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1p97 h ALA 47 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1p97 h ALA 47 CO 0.04 0.00 -1.37 1.47 0.00 0.00 0.00 179.25 179.39 1p97 n LEU 48 N -2.69 0.07 -0.11 0.00 -0.00 -1.26 -4.62 117.00 108.39 1p97 n LEU 48 Ca 0.03 -0.07 0.02 0.00 -0.00 0.00 0.00 56.01 55.99 1p97 n LEU 48 Cb 0.40 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 43.83 1p97 n LEU 48 CO 0.29 0.02 0.23 -0.67 -0.00 0.00 0.00 177.39 177.26 1p97 n ASP 49 N -1.80 1.04 -0.33 1.45 2.03 -1.12 -4.67 116.55 113.14 1p97 n ASP 49 Ca -0.01 -1.02 0.12 0.00 0.52 0.00 0.00 54.79 54.40 1p97 n ASP 49 Cb 0.27 0.23 0.33 0.00 -0.72 0.00 0.00 41.12 41.23 1p97 n ASP 49 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 1p97 h SER 50 N 0.55 0.77 -0.12 1.67 0.87 -0.68 -0.17 113.55 116.44 1p97 h SER 50 Ca 0.00 0.07 0.03 0.00 -1.23 0.00 0.00 61.79 60.66 1p97 h SER 50 Cb 0.13 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 61.99 1p97 h SER 50 CO 0.00 0.33 -0.06 -0.08 -0.53 0.00 0.00 176.83 176.50 1p97 h GLU 51 N 0.78 -0.04 -0.39 2.24 4.57 -1.84 0.62 114.58 120.52 1p97 h GLU 51 Ca 0.53 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.65 1p97 h GLU 51 Cb 0.79 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.38 1p97 h GLU 51 CO -0.30 -0.03 -0.00 -0.91 -1.18 0.00 0.00 179.01 176.58 1p97 h ASN 52 N -0.05 0.59 1.80 1.04 -0.26 -1.42 -0.61 115.58 116.66 1p97 h ASN 52 Ca 0.07 -0.12 -0.02 0.00 -0.56 0.00 0.00 56.30 55.66 1p97 h ASN 52 Cb 0.14 -0.15 -0.00 0.00 -1.06 0.00 0.00 38.32 37.25 1p97 h ASN 52 CO -0.15 0.66 -0.10 -0.03 -1.06 0.00 0.00 177.43 176.75 1p97 h MET 53 N 0.59 0.00 -0.01 0.81 4.05 -0.61 -0.63 114.93 119.13 1p97 h MET 53 Ca 0.12 0.00 -0.23 0.00 -0.28 0.00 0.00 59.70 59.31 1p97 h MET 53 Cb 0.38 0.00 0.01 0.00 -0.80 0.00 0.00 31.60 31.18 1p97 h MET 53 CO 0.01 0.10 -0.94 1.15 0.23 0.00 0.00 176.91 177.46 1p97 h THR 54 N 0.00 1.37 -0.38 -0.77 2.02 0.11 0.16 112.91 115.41 1p97 h THR 54 Ca -0.00 -2.37 -0.03 0.00 0.77 0.00 0.00 66.41 64.79 1p97 h THR 54 Cb 1.02 2.37 -0.02 0.00 -1.74 0.00 0.00 68.15 69.79 1p97 h THR 54 CO 0.01 0.71 0.12 0.11 0.37 0.00 0.00 175.52 176.85 1p97 h LYS 55 N 0.28 0.55 -0.51 6.66 6.56 -0.99 0.12 116.57 129.25 1p97 h LYS 55 Ca -0.09 -0.08 -0.05 0.00 -1.06 0.00 0.00 60.65 59.38 1p97 h LYS 55 Cb 1.58 -0.10 -0.02 0.00 -0.57 0.00 0.00 32.23 33.12 1p97 h LYS 55 CO 0.17 0.48 0.14 1.03 -2.06 0.00 0.00 179.45 179.21 1p97 h SER 56 N 0.55 0.75 -0.26 0.86 0.87 -0.64 -0.12 113.55 115.57 1p97 h SER 56 Ca 0.13 -0.22 -0.00 0.00 -1.23 0.00 0.00 61.79 60.47 1p97 h SER 56 Cb 0.16 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 1p97 h SER 56 CO -0.01 0.78 0.15 -0.74 -0.53 0.00 0.00 176.83 176.47 1p97 h HIS 57 N 0.70 0.35 0.00 2.24 -0.00 -0.04 0.54 115.15 118.94 1p97 h HIS 57 Ca 0.16 -0.01 -0.05 0.00 -0.00 0.00 0.00 60.37 60.47 1p97 h HIS 57 Cb 0.31 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.59 1p97 h HIS 57 CO 0.02 0.29 -0.24 -0.56 -0.00 0.00 0.00 177.93 177.44 1p97 h GLN 58 N 0.31 0.00 0.10 5.26 3.07 -0.67 -2.37 115.11 120.81 1p97 h GLN 58 Ca 0.09 0.00 -0.22 0.00 0.09 0.00 0.00 58.65 58.62 1p97 h GLN 58 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.61 1p97 h GLN 58 CO -0.02 0.24 -1.08 -0.97 0.09 0.00 0.00 178.83 177.09 1p97 h ASN 59 N 0.00 0.32 -0.14 0.06 -1.24 -0.63 -3.28 115.58 110.67 1p97 h ASN 59 Ca -0.00 -0.86 0.01 0.00 0.71 0.00 0.00 56.30 56.16 1p97 h ASN 59 Cb 0.60 -0.10 -0.01 0.00 0.73 0.00 0.00 38.32 39.53 1p97 h ASN 59 CO 0.03 1.48 0.06 0.25 -1.29 0.00 0.00 177.43 177.96 1p97 h LEU 60 N -0.47 0.09 0.07 0.34 5.85 0.25 0.22 115.31 121.66 1p97 h LEU 60 Ca -0.23 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 1p97 h LEU 60 Cb 1.60 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.62 1p97 h LEU 60 CO 0.05 0.07 -0.03 0.00 -0.34 0.00 0.00 178.44 178.19 1p97 h THR 62 N -0.19 1.25 -0.01 0.00 2.02 -1.57 -3.21 112.91 111.20 1p97 h THR 62 Ca -0.01 -0.60 0.00 0.00 0.77 0.00 0.00 66.41 66.57 1p97 h THR 62 Cb 0.16 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.65 1p97 h THR 62 CO 0.02 0.28 -0.71 0.29 0.37 0.00 0.00 175.52 175.76 1p97 n LYS 63 N -4.38 0.69 0.00 6.66 4.76 0.74 -4.94 118.16 121.69 1p97 n LYS 63 Ca 0.09 -0.56 0.00 0.00 -2.87 0.00 0.00 58.31 54.97 1p97 n LYS 63 Cb 0.09 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.79 1p97 n LYS 63 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1p97 n GLY 64 N 1.45 2.88 3.53 0.72 0.00 0.11 -4.92 105.19 108.96 1p97 n GLY 64 Ca 0.07 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.95 1p97 n GLY 64 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1p97 s GLN 65 N -0.05 0.92 -0.12 1.61 0.74 -1.14 -1.11 119.66 120.51 1p97 s GLN 65 Ca 0.00 0.09 -0.11 0.00 0.05 0.00 0.00 55.36 55.39 1p97 s GLN 65 Cb 0.00 0.43 0.03 0.00 1.10 0.00 0.00 33.01 34.57 1p97 s GLN 65 CO 0.00 -0.31 0.32 0.54 -0.55 0.00 0.00 175.29 175.28 1p97 s VAL 66 N -1.62 0.00 -0.47 1.34 0.11 0.16 -4.45 120.40 115.48 1p97 s VAL 66 Ca -0.05 -0.01 0.04 0.00 -2.93 0.00 0.00 61.98 59.02 1p97 s VAL 66 Cb -0.00 -0.45 0.12 0.00 -1.53 0.00 0.00 36.38 34.52 1p97 s VAL 66 CO 0.03 -0.01 0.20 -0.69 -3.33 0.00 0.00 175.10 171.31 1p97 s VAL 67 N 0.14 2.42 0.65 2.04 1.01 -1.26 0.12 120.40 125.52 1p97 s VAL 67 Ca -0.00 -3.01 -0.11 0.00 0.00 0.00 0.00 61.98 58.87 1p97 s VAL 67 Cb -0.02 -2.71 0.15 0.00 0.00 0.00 0.00 36.38 33.79 1p97 s VAL 67 CO 0.01 -0.75 0.88 -1.20 0.00 0.00 0.00 175.10 174.03 1p97 n SER 68 N 3.45 0.12 -1.80 3.32 7.64 -0.96 -5.04 113.62 120.34 1p97 n SER 68 Ca 0.05 -1.35 -0.00 0.00 1.01 0.00 0.00 58.87 58.58 1p97 n SER 68 Cb 0.35 -0.67 -0.00 0.00 -1.01 0.00 0.00 64.21 62.88 1p97 n SER 68 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1p97 n GLY 69 N -0.80 4.17 3.62 0.23 0.00 -1.26 -4.39 105.19 106.76 1p97 n GLY 69 Ca 0.11 -2.10 -0.52 0.00 0.00 0.00 0.00 46.02 43.51 1p97 n GLY 69 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1p97 n GLN 70 N -0.00 1.47 -4.36 1.61 6.02 -1.24 -4.08 117.38 116.80 1p97 n GLN 70 Ca -0.00 0.50 -0.29 0.00 -0.01 0.00 0.00 57.00 57.20 1p97 n GLN 70 Cb 0.00 -2.40 -0.06 0.00 1.02 0.00 0.00 30.24 28.80 1p97 n GLN 70 CO 0.00 0.00 0.00 1.52 -1.01 0.00 0.00 177.06 177.57 1p97 s TYR 71 N 4.96 1.99 -0.41 1.08 -0.85 0.11 -4.80 117.35 119.43 1p97 s TYR 71 Ca 1.00 -0.83 -0.09 0.00 -0.52 0.00 0.00 57.07 56.64 1p97 s TYR 71 Cb -0.88 -1.79 0.08 0.00 0.38 0.00 0.00 41.96 39.75 1p97 s TYR 71 CO 0.56 0.02 0.25 1.03 -1.52 0.00 0.00 175.55 175.89 1p97 s ARG 72 N -3.99 2.59 -0.06 -3.49 3.00 -1.26 -1.44 118.95 114.30 1p97 s ARG 72 Ca 0.24 -1.44 -0.08 0.00 0.00 0.00 0.00 55.73 54.44 1p97 s ARG 72 Cb 0.02 -3.76 -0.05 0.00 0.00 0.00 0.00 34.95 31.16 1p97 s ARG 72 CO 0.14 -0.93 0.23 1.41 0.00 0.00 0.00 175.30 176.14 1p97 s MET 73 N 1.42 3.57 -0.00 3.54 1.75 0.43 -3.73 119.30 126.28 1p97 s MET 73 Ca 0.03 -0.01 -0.30 0.00 -1.25 0.00 0.00 55.69 54.16 1p97 s MET 73 Cb -0.23 -3.17 -0.05 0.00 2.84 0.00 0.00 34.83 34.22 1p97 s MET 73 CO 0.02 0.73 1.31 -1.17 -0.65 0.00 0.00 175.02 175.26 1p97 s LEU 74 N -1.22 4.31 0.57 4.11 2.96 -1.14 -1.07 118.68 127.21 1p97 s LEU 74 Ca 0.20 2.02 -0.05 0.00 -0.22 0.00 0.00 54.13 56.08 1p97 s LEU 74 Cb -0.13 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 43.00 1p97 s LEU 74 CO 0.09 -0.64 0.86 0.00 -1.32 0.00 0.00 176.35 175.34 1p97 s ALA 75 N 2.08 3.40 0.31 5.97 0.00 0.99 -4.87 121.76 129.64 1p97 s ALA 75 Ca 0.61 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.79 1p97 s ALA 75 Cb -0.29 -2.50 0.76 0.00 0.00 0.00 0.00 23.12 21.09 1p97 s ALA 75 CO 0.26 -0.75 1.58 -0.22 0.00 0.00 0.00 175.76 176.63 1p97 h LYS 76 N -0.09 0.03 -1.03 0.00 3.64 -1.17 0.13 116.57 118.08 1p97 h LYS 76 Ca -0.45 -0.00 -0.38 0.00 -1.27 0.00 0.00 60.65 58.55 1p97 h LYS 76 Cb 1.26 -0.01 -0.21 0.00 -0.41 0.00 0.00 32.23 32.86 1p97 h LYS 76 CO 0.60 0.02 0.48 -2.39 -2.27 0.00 0.00 179.45 175.89 1p97 n HIS 77 N -5.44 2.16 -1.36 1.91 1.44 -1.26 -4.78 115.22 107.89 1p97 n HIS 77 Ca 0.23 -1.55 -0.10 0.00 -2.01 0.00 0.00 57.72 54.29 1p97 n HIS 77 Cb 0.76 -0.79 -0.04 0.00 0.12 0.00 0.00 29.99 30.05 1p97 n HIS 77 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1p97 n GLY 78 N -0.60 1.07 3.41 -1.39 0.00 0.44 -5.00 105.19 103.10 1p97 n GLY 78 Ca 0.42 -0.56 -0.25 0.00 0.00 0.00 0.00 46.02 45.63 1p97 n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p97 n GLY 79 N -1.69 -1.01 2.88 -0.02 0.00 -1.10 -4.74 105.19 99.52 1p97 n GLY 79 Ca -0.10 -1.77 -0.14 0.00 0.00 0.00 0.00 46.02 44.00 1p97 n GLY 79 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1p97 s TYR 80 N -3.38 0.22 0.04 1.61 2.02 -1.15 -0.00 117.35 116.70 1p97 s TYR 80 Ca 0.65 -0.02 0.04 0.00 -0.37 0.00 0.00 57.07 57.36 1p97 s TYR 80 Cb -0.02 -0.20 -0.02 0.00 -0.40 0.00 0.00 41.96 41.32 1p97 s TYR 80 CO 0.45 -0.03 -0.11 0.14 -1.57 0.00 0.00 175.55 174.42 1p97 s VAL 81 N 0.22 0.88 -0.22 0.71 -7.23 -0.23 0.86 120.40 115.40 1p97 s VAL 81 Ca -0.02 -0.92 -0.19 0.00 -1.81 0.00 0.00 61.98 59.03 1p97 s VAL 81 Cb -0.04 -0.82 -0.03 0.00 0.56 0.00 0.00 36.38 36.05 1p97 s VAL 81 CO -0.01 -0.08 0.58 0.26 -0.31 0.00 0.00 175.10 175.54 1p97 s TRP 82 N -0.89 3.34 -0.02 2.82 0.52 -1.23 -0.43 118.94 123.04 1p97 s TRP 82 Ca -0.01 0.81 0.03 0.00 0.02 0.00 0.00 56.10 56.94 1p97 s TRP 82 Cb -0.08 -2.76 -0.00 0.00 -1.15 0.00 0.00 33.47 29.49 1p97 s TRP 82 CO 0.01 -0.20 -0.09 -0.51 0.02 0.00 0.00 176.95 176.18 1p97 s LEU 83 N 2.02 1.86 -0.15 2.99 1.02 -0.52 -0.94 118.68 124.96 1p97 s LEU 83 Ca 0.25 -0.17 -0.08 0.00 0.02 0.00 0.00 54.13 54.16 1p97 s LEU 83 Cb -0.16 -0.50 -0.04 0.00 0.02 0.00 0.00 46.19 45.51 1p97 s LEU 83 CO 0.09 0.08 0.11 -0.70 0.02 0.00 0.00 176.35 175.96 1p97 s GLU 84 N 0.06 3.73 -0.07 1.70 2.12 -0.22 0.07 118.70 126.09 1p97 s GLU 84 Ca -0.01 -0.21 0.01 0.00 0.36 0.00 0.00 54.97 55.12 1p97 s GLU 84 Cb -0.07 -3.24 0.02 0.00 0.26 0.00 0.00 34.13 31.11 1p97 s GLU 84 CO 0.00 0.54 -0.09 0.99 -0.54 0.00 0.00 175.26 176.17 1p97 s THR 85 N -0.36 0.91 -0.24 -1.70 2.01 -1.26 0.08 115.64 115.09 1p97 s THR 85 Ca 0.11 -0.31 -0.20 0.00 0.31 0.00 0.00 61.69 61.60 1p97 s THR 85 Cb -0.12 -0.88 -0.02 0.00 0.01 0.00 0.00 72.50 71.49 1p97 s THR 85 CO 0.01 0.32 0.60 0.00 -0.69 0.00 0.00 174.62 174.86 1p97 s GLN 86 N 1.00 4.14 0.07 4.92 1.03 -0.30 -2.27 119.66 128.25 1p97 s GLN 86 Ca -0.09 0.51 0.05 0.00 0.04 0.00 0.00 55.36 55.87 1p97 s GLN 86 Cb -0.15 -3.62 -0.04 0.00 0.03 0.00 0.00 33.01 29.23 1p97 s GLN 86 CO -0.00 -0.33 -0.02 0.20 -2.54 0.00 0.00 175.29 172.60 1p97 s GLY 87 N 1.38 1.88 -0.18 2.60 0.00 0.12 -1.10 107.32 112.02 1p97 s GLY 87 Ca 0.26 -1.11 -0.13 0.00 0.00 0.00 0.00 44.72 43.74 1p97 s GLY 87 CO 0.09 -1.06 0.46 -1.59 0.00 0.00 0.00 173.10 171.00 1p97 s THR 88 N -1.24 -0.01 -0.29 0.90 2.01 -0.46 -0.66 115.64 115.89 1p97 s THR 88 Ca 0.24 0.05 -0.13 0.00 0.31 0.00 0.00 61.69 62.15 1p97 s THR 88 Cb -0.12 -0.67 -0.04 0.00 0.01 0.00 0.00 72.50 71.69 1p97 s THR 88 CO 0.16 0.02 0.30 -0.69 -0.69 0.00 0.00 174.62 173.71 1p97 s VAL 89 N 0.95 5.23 -0.38 3.82 1.01 -0.27 -0.01 120.40 130.75 1p97 s VAL 89 Ca -0.06 0.27 -0.19 0.00 0.00 0.00 0.00 61.98 62.00 1p97 s VAL 89 Cb -0.06 -3.66 0.01 0.00 0.00 0.00 0.00 36.38 32.66 1p97 s VAL 89 CO -0.08 0.13 0.57 -0.51 0.00 0.00 0.00 175.10 175.21 1p97 s ILE 90 N 1.93 4.95 0.29 2.22 2.07 -0.63 -4.89 121.20 127.13 1p97 s ILE 90 Ca 0.11 0.28 -0.02 0.00 -1.41 0.00 0.00 60.65 59.60 1p97 s ILE 90 Cb -0.16 -4.06 -0.04 0.00 0.13 0.00 0.00 42.46 38.33 1p97 s ILE 90 CO 0.11 -0.35 0.51 -0.31 -1.91 0.00 0.00 174.94 172.99 1p97 s TYR 91 N 2.55 3.49 0.22 3.50 1.51 -1.26 -0.64 117.35 126.72 1p97 s TYR 91 Ca 0.20 0.47 -0.30 0.00 -1.01 0.00 0.00 57.07 56.43 1p97 s TYR 91 Cb -0.15 -1.97 -0.10 0.00 -0.11 0.00 0.00 41.96 39.63 1p97 s TYR 91 CO 0.15 0.21 1.44 1.21 -1.11 0.00 0.00 175.55 177.45 1p97 s ASN 92 N -3.44 6.69 0.26 2.29 3.84 0.55 -4.66 114.94 120.47 1p97 s ASN 92 Ca 0.41 2.60 0.13 0.00 0.21 0.00 0.00 52.86 56.21 1p97 s ASN 92 Cb -0.10 -2.61 0.18 0.00 -0.55 0.00 0.00 41.25 38.16 1p97 s ASN 92 CO 0.32 -0.69 1.49 1.55 -2.79 0.00 0.00 177.10 176.98 1p97 h PRO 93 N 5.49 0.00 0.08 0.43 0.13 -1.95 0.15 132.00 136.34 1p97 h PRO 93 Ca -0.45 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.32 1p97 h PRO 93 Cb 1.21 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 1p97 h PRO 93 CO 0.80 0.61 -2.08 0.54 -0.23 0.00 0.00 178.00 177.64 1p97 n ARG 94 N -3.39 0.72 -0.05 0.86 5.12 -1.26 -4.56 116.66 114.10 1p97 n ARG 94 Ca 0.01 0.26 0.02 0.00 -1.93 0.00 0.00 57.85 56.20 1p97 n ARG 94 Cb 0.72 -1.66 -0.16 0.00 -1.16 0.00 0.00 32.46 30.20 1p97 n ARG 94 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1p97 n ASN 95 N -3.52 0.27 -0.62 0.55 2.85 -1.26 -4.97 115.26 108.55 1p97 n ASN 95 Ca -0.36 0.00 -0.08 0.00 -0.11 0.00 0.00 54.58 54.03 1p97 n ASN 95 Cb 1.00 1.53 -0.03 0.00 1.24 0.00 0.00 39.78 43.52 1p97 n ASN 95 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1p97 n LEU 96 N -2.43 -0.04 -4.86 1.20 7.99 0.53 -4.93 117.00 114.46 1p97 n LEU 96 Ca -0.15 0.20 -0.31 0.00 -0.01 0.00 0.00 56.01 55.73 1p97 n LEU 96 Cb 0.79 -2.52 0.00 0.00 -0.11 0.00 0.00 43.42 41.59 1p97 n LEU 96 CO 0.42 -0.97 0.71 0.00 -1.51 0.00 0.00 177.39 176.04 1p97 s GLN 97 N -2.61 3.60 -0.66 3.23 1.03 -1.26 -4.51 119.66 118.48 1p97 s GLN 97 Ca 0.00 0.83 -0.26 0.00 0.04 0.00 0.00 55.36 55.97 1p97 s GLN 97 Cb 0.00 -2.08 -0.12 0.00 0.03 0.00 0.00 33.01 30.83 1p97 s GLN 97 CO 0.00 -0.56 2.46 -2.30 -2.54 0.00 0.00 175.29 172.34 1p97 n PRO 98 N -2.52 0.71 -0.04 9.60 -0.02 -1.26 -0.33 135.00 141.14 1p97 n PRO 98 Ca 0.06 -0.16 -0.11 0.00 -2.02 0.00 0.00 63.50 61.28 1p97 n PRO 98 Cb 0.54 -3.02 -0.05 0.00 -0.02 0.00 0.00 33.50 30.95 1p97 n PRO 98 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1p97 h GLN 99 N 16.63 0.25 -2.49 -0.52 5.75 -1.14 -3.33 115.11 130.26 1p97 h GLN 99 Ca -0.15 -0.05 0.15 0.00 -0.15 0.00 0.00 58.65 58.45 1p97 h GLN 99 Cb 1.22 -0.04 -0.06 0.00 1.07 0.00 0.00 27.48 29.67 1p97 h GLN 99 CO 1.20 0.37 0.47 0.00 -2.65 0.00 0.00 178.83 178.21 1p97 s ILE 101 N -3.03 2.98 -0.37 0.00 -1.09 0.14 -1.61 121.20 118.21 1p97 s ILE 101 Ca 0.14 -0.69 -0.08 0.00 -2.23 0.00 0.00 60.65 57.80 1p97 s ILE 101 Cb -0.02 -2.25 0.05 0.00 -1.58 0.00 0.00 42.46 38.66 1p97 s ILE 101 CO 0.04 0.53 0.17 -0.04 -1.23 0.00 0.00 174.94 174.41 1p97 s MET 102 N 0.38 2.65 -0.20 2.79 -1.94 0.98 -1.00 119.30 122.96 1p97 s MET 102 Ca -0.11 -1.25 -0.02 0.00 -1.71 0.00 0.00 55.69 52.60 1p97 s MET 102 Cb -0.16 -3.62 -0.00 0.00 2.01 0.00 0.00 34.83 33.06 1p97 s MET 102 CO 0.06 -0.76 -0.09 0.00 -0.01 0.00 0.00 175.02 174.21 1p97 s VAL 104 N 1.30 5.20 -0.09 0.00 1.01 -0.25 -0.64 120.40 126.93 1p97 s VAL 104 Ca 0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 1p97 s VAL 104 Cb -0.14 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.56 1p97 s VAL 104 CO -0.05 0.03 -0.02 0.20 0.00 0.00 0.00 175.10 175.26 1p97 s ASN 105 N 1.71 5.00 -0.32 3.32 0.01 -1.09 -1.15 114.94 122.42 1p97 s ASN 105 Ca 0.06 0.06 0.03 0.00 -0.71 0.00 0.00 52.86 52.30 1p97 s ASN 105 Cb -0.17 -1.41 0.09 0.00 0.41 0.00 0.00 41.25 40.17 1p97 s ASN 105 CO 0.10 0.35 0.04 -0.31 -1.51 0.00 0.00 177.10 175.77 1p97 s TYR 106 N -0.72 3.19 -0.15 2.20 1.51 0.11 -2.09 117.35 121.39 1p97 s TYR 106 Ca 0.11 -2.59 -0.29 0.00 -1.01 0.00 0.00 57.07 53.29 1p97 s TYR 106 Cb -0.11 -2.48 -0.03 0.00 -0.11 0.00 0.00 41.96 39.22 1p97 s TYR 106 CO 0.02 -0.91 1.52 0.08 -1.11 0.00 0.00 175.55 175.15 1p97 s VAL 107 N 1.11 3.83 0.00 0.71 1.01 0.74 -1.05 120.40 126.75 1p97 s VAL 107 Ca 0.08 0.98 0.00 0.00 0.00 0.00 0.00 61.98 63.04 1p97 s VAL 107 Cb -0.19 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.47 1p97 s VAL 107 CO -0.11 -0.19 0.00 0.18 0.00 0.00 0.00 175.10 174.98 1p97 n LEU 108 N 7.48 0.00 -4.86 3.92 4.77 -0.12 -3.35 117.00 124.84 1p97 n LEU 108 Ca 0.17 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.84 1p97 n LEU 108 Cb 0.44 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1p97 n LEU 108 CO 0.62 -0.30 0.71 -0.55 -1.33 0.00 0.00 177.39 176.54 1p97 s SER 109 N -2.62 6.27 0.00 -1.43 0.15 -1.17 -4.98 113.70 109.92 1p97 s SER 109 Ca 0.00 1.45 0.00 0.00 0.70 0.00 0.00 55.95 58.10 1p97 s SER 109 Cb 0.00 -2.48 0.00 0.00 -1.71 0.00 0.00 66.02 61.83 1p97 s SER 109 CO 0.00 -0.84 0.00 -0.62 1.20 0.00 0.00 173.24 172.98 1p97 n GLU 110 N -2.56 2.76 -2.09 5.44 1.02 -1.26 -3.55 120.64 120.39 1p97 n GLU 110 Ca 0.06 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.78 1p97 n GLU 110 Cb 0.54 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.93 1p97 n GLU 110 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1p97 s ILE 111 N 0.89 3.70 -0.35 -3.67 1.01 -1.26 -4.10 121.20 117.41 1p97 s ILE 111 Ca 0.00 0.82 -0.12 0.00 0.00 0.00 0.00 60.65 61.35 1p97 s ILE 111 Cb 0.00 -3.62 -0.00 0.00 0.01 0.00 0.00 42.46 38.85 1p97 s ILE 111 CO 0.00 -0.17 0.23 -0.70 0.00 0.00 0.00 174.94 174.29 1p97 s GLU 112 N 4.31 3.25 -0.91 2.79 -6.30 0.25 -4.97 118.70 117.13 1p97 s GLU 112 Ca 0.71 -0.80 -0.02 0.00 -2.50 0.00 0.00 54.97 52.36 1p97 s GLU 112 Cb -0.28 -3.78 0.23 0.00 0.00 0.00 0.00 34.13 30.30 1p97 s GLU 112 CO 0.28 -0.54 0.84 1.63 0.02 0.00 0.00 175.26 177.49 1p97 n LYS 113 N 5.07 2.78 0.00 4.30 5.02 -1.26 -2.95 118.16 131.12 1p97 n LYS 113 Ca -0.12 -4.49 0.13 0.00 -2.02 0.00 0.00 58.31 51.80 1p97 n LYS 113 Cb 0.48 -2.42 0.26 0.00 -0.02 0.00 0.00 35.03 33.34 1p97 n LYS 113 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15