#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p97 h ALA 2 N 0.00 0.37 0.00 4.61 0.00 -2.09 -3.42 119.26 118.73 1p97 h ALA 2 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1p97 h ALA 2 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1p97 h ALA 2 CO 0.00 0.29 -0.15 -0.12 0.00 0.00 0.00 179.25 179.26 1p97 n MET 3 N -4.41 0.00 -3.56 0.00 0.00 -1.26 -5.14 117.12 102.75 1p97 n MET 3 Ca -0.04 0.00 -0.10 0.00 -0.00 0.00 0.00 57.70 57.56 1p97 n MET 3 Cb 0.40 -0.37 -0.02 0.00 0.00 0.00 0.00 33.22 33.23 1p97 n MET 3 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 175.97 176.13 1p97 s ASP 4 N -5.59 -0.43 -0.02 6.12 -4.77 -1.26 -5.02 116.67 105.70 1p97 s ASP 4 Ca 0.00 -0.17 0.05 0.00 -3.30 0.00 0.00 52.55 49.13 1p97 s ASP 4 Cb 0.00 0.59 0.20 0.00 -1.09 0.00 0.00 42.92 42.61 1p97 s ASP 4 CO 0.00 -1.00 1.05 -1.20 0.70 0.00 0.00 175.17 174.72 1p97 n SER 5 N -0.38 1.49 -2.93 2.11 7.64 -1.26 -4.75 113.62 115.54 1p97 n SER 5 Ca -0.12 -2.08 -0.07 0.00 1.01 0.00 0.00 58.87 57.61 1p97 n SER 5 Cb 0.63 -0.27 0.01 0.00 -1.01 0.00 0.00 64.21 63.56 1p97 n SER 5 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1p97 n LYS 6 N 0.12 -2.10 -4.24 1.43 4.76 -1.26 -3.83 118.16 113.04 1p97 n LYS 6 Ca 0.07 1.94 -0.23 0.00 -2.87 0.00 0.00 58.31 57.22 1p97 n LYS 6 Cb 0.28 -5.58 -0.17 0.00 -1.84 0.00 0.00 35.03 27.73 1p97 n LYS 6 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1p97 s THR 7 N -2.68 0.86 -0.01 -0.18 2.01 -1.26 -0.26 115.64 114.12 1p97 s THR 7 Ca 0.19 -0.28 0.04 0.00 0.31 0.00 0.00 61.69 61.95 1p97 s THR 7 Cb -0.05 -0.85 -0.01 0.00 0.01 0.00 0.00 72.50 71.61 1p97 s THR 7 CO 0.77 0.31 -0.12 0.72 -0.69 0.00 0.00 174.62 175.61 1p97 s PHE 8 N 1.07 1.10 0.25 4.92 -0.71 -1.01 -4.96 117.98 118.64 1p97 s PHE 8 Ca -0.08 -0.22 -0.30 0.00 -1.04 0.00 0.00 56.93 55.29 1p97 s PHE 8 Cb -0.14 -0.72 -0.09 0.00 -1.21 0.00 0.00 43.02 40.85 1p97 s PHE 8 CO -0.01 -0.03 0.98 -1.17 -1.34 0.00 0.00 175.22 173.65 1p97 s LEU 9 N -0.22 4.62 0.14 -1.99 1.98 -1.26 -2.64 118.68 119.32 1p97 s LEU 9 Ca 0.03 2.04 -0.05 0.00 -2.89 0.00 0.00 54.13 53.26 1p97 s LEU 9 Cb -0.05 -3.61 -0.02 0.00 0.66 0.00 0.00 46.19 43.16 1p97 s LEU 9 CO -0.00 0.07 0.17 -0.94 -1.89 0.00 0.00 176.35 173.76 1p97 s SER 10 N -1.09 0.18 -0.01 3.68 1.04 -0.68 -1.26 113.70 115.55 1p97 s SER 10 Ca 0.42 -1.00 -0.01 0.00 0.48 0.00 0.00 55.95 55.84 1p97 s SER 10 Cb -0.28 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.20 1p97 s SER 10 CO 0.35 -0.80 0.02 -0.13 0.98 0.00 0.00 173.24 173.65 1p97 s ARG 11 N -3.99 0.06 0.46 4.02 0.52 0.10 -1.77 118.95 118.34 1p97 s ARG 11 Ca 0.19 -0.04 0.05 0.00 -0.52 0.00 0.00 55.73 55.41 1p97 s ARG 11 Cb 0.05 0.03 -0.03 0.00 0.52 0.00 0.00 34.95 35.52 1p97 s ARG 11 CO -0.00 -0.01 0.13 -1.01 0.02 0.00 0.00 175.30 174.42 1p97 s HIS 12 N -0.15 2.22 -0.10 -0.53 3.76 0.11 -0.44 115.29 120.15 1p97 s HIS 12 Ca -0.02 -0.75 -0.08 0.00 -0.15 0.00 0.00 55.06 54.06 1p97 s HIS 12 Cb -0.01 -1.81 0.03 0.00 1.11 0.00 0.00 32.58 31.90 1p97 s HIS 12 CO -0.00 0.15 0.26 0.45 -0.85 0.00 0.00 174.74 174.75 1p97 s SER 13 N -3.91 -0.28 0.00 1.40 0.15 -1.26 -0.02 113.70 109.78 1p97 s SER 13 Ca 0.28 0.54 0.00 0.00 0.70 0.00 0.00 55.95 57.47 1p97 s SER 13 Cb 0.04 0.50 0.00 0.00 -1.71 0.00 0.00 66.02 64.85 1p97 s SER 13 CO 0.16 -0.12 0.00 0.80 1.20 0.00 0.00 173.24 175.28 1p97 n MET 14 N 3.36 0.00 0.32 5.44 1.56 -1.24 -0.36 117.12 126.20 1p97 n MET 14 Ca -0.17 0.00 0.20 0.00 -0.27 0.00 0.00 57.70 57.47 1p97 n MET 14 Cb 0.57 0.00 1.10 0.00 2.15 0.00 0.00 33.22 37.04 1p97 n MET 14 CO 0.00 0.00 0.00 0.22 -0.73 0.00 0.00 175.97 175.46 1p97 h ASP 15 N 0.00 0.00 -0.83 6.12 3.58 -1.96 -3.45 116.42 119.87 1p97 h ASP 15 Ca 0.00 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.32 1p97 h ASP 15 Cb 0.00 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 1p97 h ASP 15 CO 0.00 0.00 -0.16 0.80 -2.88 0.00 0.00 179.24 177.00 1p97 n MET 16 N -3.24 -0.51 0.12 0.28 0.00 0.51 -4.98 117.12 109.31 1p97 n MET 16 Ca -0.03 0.39 -0.07 0.00 -0.00 0.00 0.00 57.70 57.99 1p97 n MET 16 Cb 0.13 -4.24 -0.04 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 0.00 -0.39 0.00 2.12 2.10 -1.80 -3.40 116.57 115.21 1p97 h LYS 17 Ca -0.15 0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.52 1p97 h LYS 17 Cb 1.00 0.09 0.00 0.00 -0.90 0.00 0.00 32.23 32.42 1p97 h LYS 17 CO 0.19 -0.20 0.00 1.19 -2.00 0.00 0.00 179.45 178.62 1p97 n PHE 18 N -5.04 0.00 0.03 0.07 3.72 -1.14 -1.13 117.46 113.96 1p97 n PHE 18 Ca -0.06 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.37 1p97 n PHE 18 Cb 0.19 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.68 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 0.00 -3.75 4.37 -2.24 0.41 0.14 114.28 113.21 1p97 n THR 19 Ca 0.00 -0.16 -0.13 0.00 -2.27 0.00 0.00 64.05 61.49 1p97 n THR 19 Cb 0.00 0.45 -0.10 0.00 -2.10 0.00 0.00 70.33 68.58 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 -2.29 -0.34 -0.02 4.78 5.04 -0.88 -4.75 117.35 118.89 1p97 s TYR 20 Ca -0.02 0.78 0.01 0.00 -2.44 0.00 0.00 57.07 55.40 1p97 s TYR 20 Cb 0.04 0.13 0.02 0.00 0.35 0.00 0.00 41.96 42.49 1p97 s TYR 20 CO 0.24 -0.24 -0.01 0.00 -1.34 0.00 0.00 175.55 174.19 1p97 s ASP 22 N 0.72 4.22 0.48 0.00 -1.08 -0.39 -4.71 116.67 115.91 1p97 s ASP 22 Ca -0.07 1.97 0.15 0.00 -0.52 0.00 0.00 52.55 54.08 1p97 s ASP 22 Cb -0.11 -2.54 1.13 0.00 -1.46 0.00 0.00 42.92 39.94 1p97 s ASP 22 CO -0.01 -2.23 2.07 -0.78 0.52 0.00 0.00 175.17 174.73 1p97 h ASP 23 N -1.06 0.00 -0.14 -0.34 3.58 -2.00 -2.26 116.42 114.21 1p97 h ASP 23 Ca -0.44 0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.05 1p97 h ASP 23 Cb 1.25 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.29 1p97 h ASP 23 CO 0.49 0.10 0.19 0.03 -2.88 0.00 0.00 179.24 177.17 1p97 h ARG 24 N 0.00 0.00 0.00 0.28 2.47 -1.92 -2.07 114.38 113.14 1p97 h ARG 24 Ca -0.00 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.70 1p97 h ARG 24 Cb 0.17 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.49 1p97 h ARG 24 CO 0.01 0.00 -0.09 0.97 0.56 0.00 0.00 179.97 181.42 1p97 h ILE 25 N 0.00 0.89 -0.89 2.04 2.10 -1.74 -0.03 117.51 119.88 1p97 h ILE 25 Ca 0.07 -0.32 0.12 0.00 1.08 0.00 0.00 64.86 65.80 1p97 h ILE 25 Cb 0.44 1.18 -0.07 0.00 -1.09 0.00 0.00 36.82 37.29 1p97 h ILE 25 CO -0.00 0.09 0.57 0.71 -1.08 0.00 0.00 178.15 178.44 1p97 h THR 26 N 0.00 0.90 0.00 2.19 1.35 -1.38 0.28 112.91 116.24 1p97 h THR 26 Ca -0.00 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1p97 h THR 26 Cb 0.18 0.05 0.00 0.00 -1.73 0.00 0.00 68.15 66.64 1p97 h THR 26 CO 0.01 0.14 -0.93 -0.62 -0.25 0.00 0.00 175.52 173.87 1p97 n GLU 27 N -4.55 0.25 -0.10 4.72 -0.58 -0.11 -3.50 120.64 116.77 1p97 n GLU 27 Ca 0.16 0.01 -0.15 0.00 -0.42 0.00 0.00 57.16 56.75 1p97 n GLU 27 Cb 0.39 -1.59 -0.05 0.00 -0.57 0.00 0.00 31.44 29.61 1p97 n GLU 27 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1p97 n LEU 28 N -1.92 1.89 -0.57 -4.62 4.77 -0.57 -4.68 117.00 111.31 1p97 n LEU 28 Ca 0.02 0.32 0.08 0.00 -0.03 0.00 0.00 56.01 56.41 1p97 n LEU 28 Cb 0.42 -0.74 0.04 0.00 -2.33 0.00 0.00 43.42 40.81 1p97 n LEU 28 CO 0.39 -0.00 0.42 -0.38 -1.33 0.00 0.00 177.39 176.49 1p97 n ILE 29 N -4.34 0.00 0.00 -0.08 5.41 0.87 -4.95 119.36 116.27 1p97 n ILE 29 Ca -0.27 -0.43 0.00 0.00 1.00 0.00 0.00 62.75 63.05 1p97 n ILE 29 Cb 0.62 1.30 0.00 0.00 -0.71 0.00 0.00 39.64 40.85 1p97 n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1p97 n GLY 30 N 1.05 2.85 2.64 7.39 0.00 -0.71 -0.92 105.19 117.49 1p97 n GLY 30 Ca 0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.49 -3.94 -3.96 1.61 4.01 -1.26 -4.80 117.16 107.34 1p97 n TYR 31 Ca 0.00 -0.83 -0.31 0.00 -0.16 0.00 0.00 57.90 56.60 1p97 n TYR 31 Cb 0.00 -0.69 -0.05 0.00 -0.31 0.00 0.00 39.34 38.29 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 -2.93 3.42 0.29 -0.72 2.46 -1.26 -3.40 115.29 113.15 1p97 s HIS 32 Ca 0.51 0.20 0.03 0.00 0.47 0.00 0.00 55.06 56.27 1p97 s HIS 32 Cb -0.01 -1.72 0.70 0.00 -0.13 0.00 0.00 32.58 31.41 1p97 s HIS 32 CO 0.36 0.57 1.70 -1.35 -2.47 0.00 0.00 174.74 173.55 1p97 h PRO 33 N 3.19 0.40 0.00 2.88 0.11 -1.84 0.20 132.00 136.94 1p97 h PRO 33 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1p97 h PRO 33 Cb 1.16 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1p97 h PRO 33 CO 0.72 0.26 0.00 0.93 -0.21 0.00 0.00 178.00 179.71 1p97 h GLU 34 N 0.41 0.00 0.14 1.05 4.39 -1.90 -0.82 114.58 117.84 1p97 h GLU 34 Ca 0.54 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.95 1p97 h GLU 34 Cb 1.01 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.68 1p97 h GLU 34 CO -0.52 0.00 -1.26 0.93 -1.16 0.00 0.00 179.01 177.00 1p97 h GLU 35 N 0.00 0.53 0.11 2.33 4.39 -1.01 -3.36 114.58 117.57 1p97 h GLU 35 Ca 0.00 -0.75 -0.25 0.00 0.34 0.00 0.00 59.36 58.69 1p97 h GLU 35 Cb 0.57 0.26 0.00 0.00 -0.10 0.00 0.00 28.75 29.48 1p97 h GLU 35 CO 0.00 1.34 -1.26 -0.07 -1.16 0.00 0.00 179.01 177.86 1p97 h LEU 36 N 0.22 0.37 -8.44 1.33 4.07 -1.00 -3.43 115.31 108.42 1p97 h LEU 36 Ca -0.18 -0.86 -0.31 0.00 0.08 0.00 0.00 57.88 56.60 1p97 h LEU 36 Cb 1.94 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 43.55 1p97 h LEU 36 CO 0.23 1.56 0.97 -1.48 -1.08 0.00 0.00 178.44 178.64 1p97 s LEU 37 N -7.64 3.19 0.00 1.67 0.05 -0.35 -1.50 118.68 114.10 1p97 s LEU 37 Ca -0.19 0.33 0.00 0.00 0.05 0.00 0.00 54.13 54.32 1p97 s LEU 37 Cb 0.04 -2.53 0.00 0.00 -2.05 0.00 0.00 46.19 41.65 1p97 s LEU 37 CO 0.77 -3.04 0.00 0.61 -0.55 0.00 0.00 176.35 174.13 1p97 n GLY 38 N 6.32 1.55 3.20 -3.48 0.00 0.12 -4.89 105.19 108.01 1p97 n GLY 38 Ca 0.37 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.30 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 0.00 0.87 -0.32 1.61 1.70 -0.56 -5.04 118.95 117.21 1p97 s ARG 39 Ca 0.00 -1.12 -0.26 0.00 -0.47 0.00 0.00 55.73 53.88 1p97 s ARG 39 Cb 0.00 0.31 0.01 0.00 -0.57 0.00 0.00 34.95 34.70 1p97 s ARG 39 CO 0.00 -0.27 0.90 -1.12 -1.08 0.00 0.00 175.30 173.74 1p97 s SER 40 N -2.92 6.74 0.56 -2.89 0.01 -1.26 -2.90 113.70 111.05 1p97 s SER 40 Ca 0.10 0.75 0.32 0.00 1.31 0.00 0.00 55.95 58.43 1p97 s SER 40 Cb 0.06 -2.46 1.46 0.00 0.21 0.00 0.00 66.02 65.29 1p97 s SER 40 CO -0.07 -0.75 1.82 0.00 0.41 0.00 0.00 173.24 174.66 1p97 h ALA 41 N 8.19 2.73 -1.06 1.44 0.00 -1.34 -2.96 119.26 126.27 1p97 h ALA 41 Ca -0.23 -0.03 0.31 0.00 0.00 0.00 0.00 54.91 54.96 1p97 h ALA 41 Cb 1.08 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 1p97 h ALA 41 CO 0.95 -1.14 0.90 1.88 0.00 0.00 0.00 179.25 181.84 1p97 h TYR 42 N 0.00 0.00 0.00 0.00 -1.99 -1.88 1.32 116.97 114.42 1p97 h TYR 42 Ca 0.40 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.13 1p97 h TYR 42 Cb 1.80 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.53 1p97 h TYR 42 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 178.16 178.55 1p97 n GLU 43 N -3.83 0.06 -1.95 4.88 -0.58 -1.12 -3.76 120.64 114.34 1p97 n GLU 43 Ca 0.23 0.19 -0.03 0.00 -0.42 0.00 0.00 57.16 57.12 1p97 n GLU 43 Cb 1.25 -1.59 0.04 0.00 -0.57 0.00 0.00 31.44 30.56 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 -1.69 -0.81 -2.26 -0.32 -1.74 0.39 -4.97 117.46 106.06 1p97 n PHE 44 Ca 0.05 -1.19 -0.34 0.00 -0.56 0.00 0.00 57.45 55.41 1p97 n PHE 44 Cb 0.26 0.86 0.02 0.00 1.52 0.00 0.00 39.48 42.14 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 -0.71 3.22 -1.18 2.97 9.36 0.22 -3.61 117.16 127.42 1p97 n TYR 45 Ca -0.18 -2.77 0.00 0.00 3.32 0.00 0.00 57.90 58.27 1p97 n TYR 45 Cb 0.82 -0.66 0.00 0.00 -0.63 0.00 0.00 39.34 38.87 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 -0.47 -1.58 0.25 2.98 8.25 -1.21 -3.60 115.22 119.83 1p97 n HIS 46 Ca 0.46 0.95 -0.10 0.00 -0.26 0.00 0.00 57.72 58.77 1p97 n HIS 46 Cb 0.43 -2.57 -0.05 0.00 1.12 0.00 0.00 29.99 28.93 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 1.38 -0.91 0.00 -1.41 0.00 -1.93 -0.61 119.26 115.78 1p97 h ALA 47 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1p97 h ALA 47 Cb 0.00 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1p97 h ALA 47 CO 0.00 -0.86 -0.46 1.37 0.00 0.00 0.00 179.25 179.30 1p97 h LEU 48 N -0.82 0.00 -0.21 0.00 8.10 -1.93 -3.33 115.31 117.12 1p97 h LEU 48 Ca -0.07 -0.09 0.00 0.00 0.11 0.00 0.00 57.88 57.83 1p97 h LEU 48 Cb 0.50 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.72 1p97 h LEU 48 CO 0.11 0.04 -0.65 0.47 -4.11 0.00 0.00 178.44 174.30 1p97 n ASP 49 N -2.43 0.98 -0.13 0.17 8.00 -1.23 -4.21 116.55 117.69 1p97 n ASP 49 Ca 0.03 -0.80 -0.04 0.00 0.71 0.00 0.00 54.79 54.69 1p97 n ASP 49 Cb 0.47 0.55 0.03 0.00 -0.02 0.00 0.00 41.12 42.15 1p97 n ASP 49 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 1p97 h SER 50 N 0.52 -0.30 -0.50 -2.24 0.87 -1.16 -1.56 113.55 109.18 1p97 h SER 50 Ca 0.00 0.12 0.09 0.00 -1.23 0.00 0.00 61.79 60.76 1p97 h SER 50 Cb 0.54 0.23 -0.07 0.00 -0.44 0.00 0.00 62.40 62.65 1p97 h SER 50 CO 0.00 -0.10 0.10 -0.08 -0.53 0.00 0.00 176.83 176.22 1p97 h GLU 51 N 0.05 0.23 -0.20 2.24 4.22 -1.85 0.67 114.58 119.94 1p97 h GLU 51 Ca 0.21 -0.01 -0.07 0.00 0.08 0.00 0.00 59.36 59.57 1p97 h GLU 51 Cb 0.32 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1p97 h GLU 51 CO -0.40 0.15 -0.17 -0.91 -2.18 0.00 0.00 179.01 175.50 1p97 h ASN 52 N 0.24 0.33 1.47 1.04 -0.26 -1.68 0.75 115.58 117.46 1p97 h ASN 52 Ca 0.25 -0.08 -0.11 0.00 -0.56 0.00 0.00 56.30 55.80 1p97 h ASN 52 Cb 0.34 -0.09 -0.02 0.00 -1.06 0.00 0.00 38.32 37.50 1p97 h ASN 52 CO -0.33 0.52 -0.53 0.24 -1.06 0.00 0.00 177.43 176.27 1p97 h MET 53 N 0.31 0.00 -0.21 0.81 2.86 -0.21 0.76 114.93 119.25 1p97 h MET 53 Ca 0.06 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.66 1p97 h MET 53 Cb 0.49 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.15 1p97 h MET 53 CO 0.03 0.50 -0.02 1.15 1.06 0.00 0.00 176.91 179.63 1p97 h THR 54 N 0.00 1.27 -0.46 2.22 2.02 0.12 0.28 112.91 118.36 1p97 h THR 54 Ca -0.01 -0.93 -0.02 0.00 0.77 0.00 0.00 66.41 66.22 1p97 h THR 54 Cb 1.39 1.46 -0.02 0.00 -1.74 0.00 0.00 68.15 69.24 1p97 h THR 54 CO 0.07 0.29 0.19 0.11 0.37 0.00 0.00 175.52 176.54 1p97 h LYS 55 N 0.13 0.64 -0.23 6.66 1.79 -0.85 -1.46 116.57 123.27 1p97 h LYS 55 Ca 0.06 -0.08 -0.06 0.00 -2.18 0.00 0.00 60.65 58.38 1p97 h LYS 55 Cb 0.43 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 30.95 1p97 h LYS 55 CO 0.01 0.52 -0.13 1.03 -1.08 0.00 0.00 179.45 179.81 1p97 h SER 56 N 0.64 0.35 -0.33 0.86 0.87 -0.39 0.65 113.55 116.21 1p97 h SER 56 Ca 0.16 -0.08 -0.06 0.00 -1.23 0.00 0.00 61.79 60.58 1p97 h SER 56 Cb 0.11 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 61.96 1p97 h SER 56 CO -0.02 0.52 0.01 -0.74 -0.53 0.00 0.00 176.83 176.07 1p97 h HIS 57 N 0.35 0.71 0.00 2.24 -0.00 0.58 0.75 115.15 119.77 1p97 h HIS 57 Ca 0.07 -0.08 -0.14 0.00 -0.00 0.00 0.00 60.37 60.21 1p97 h HIS 57 Cb 0.44 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 27.63 1p97 h HIS 57 CO 0.01 0.67 -0.68 1.96 -0.00 0.00 0.00 177.93 179.89 1p97 h GLN 58 N 0.64 0.00 0.03 5.26 1.08 -0.73 -3.02 115.11 118.36 1p97 h GLN 58 Ca 0.13 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 57.23 1p97 h GLN 58 Cb 0.38 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.81 1p97 h GLN 58 CO 0.01 0.68 -0.53 -0.97 -0.95 0.00 0.00 178.83 177.07 1p97 h ASN 59 N 0.00 0.08 -0.44 1.46 -1.24 -0.22 -3.18 115.58 112.05 1p97 h ASN 59 Ca -0.01 -0.86 0.03 0.00 0.71 0.00 0.00 56.30 56.17 1p97 h ASN 59 Cb 1.26 -0.03 -0.02 0.00 0.73 0.00 0.00 38.32 40.26 1p97 h ASN 59 CO 0.09 1.22 0.29 0.25 -1.29 0.00 0.00 177.43 177.99 1p97 h LEU 60 N -0.87 0.41 0.30 0.34 5.85 0.38 0.14 115.31 121.86 1p97 h LEU 60 Ca -0.13 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.57 1p97 h LEU 60 Cb 1.21 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1p97 h LEU 60 CO -0.03 0.29 -0.14 0.00 -0.34 0.00 0.00 178.44 178.21 1p97 h THR 62 N -0.69 1.19 0.00 0.00 2.02 -1.38 -3.19 112.91 110.86 1p97 h THR 62 Ca -0.04 -0.71 0.00 0.00 0.77 0.00 0.00 66.41 66.43 1p97 h THR 62 Cb 0.48 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1p97 h THR 62 CO 0.07 0.25 -1.23 0.29 0.37 0.00 0.00 175.52 175.26 1p97 n LYS 63 N -4.31 0.20 0.00 6.66 4.76 0.42 -4.95 118.16 120.95 1p97 n LYS 63 Ca 0.02 -0.05 0.00 0.00 -2.87 0.00 0.00 58.31 55.41 1p97 n LYS 63 Cb 0.22 -1.52 0.00 0.00 -1.84 0.00 0.00 35.03 31.89 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 1.42 2.42 3.61 0.72 0.00 0.30 -4.89 105.19 108.78 1p97 n GLY 64 Ca 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 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 0.00 0.83 0.01 1.61 0.74 -1.23 -1.55 119.66 120.06 1p97 s GLN 65 Ca 0.00 0.82 -0.10 0.00 0.05 0.00 0.00 55.36 56.14 1p97 s GLN 65 Cb 0.00 0.40 0.01 0.00 1.10 0.00 0.00 33.01 34.52 1p97 s GLN 65 CO 0.00 -0.13 0.19 0.54 -0.55 0.00 0.00 175.29 175.34 1p97 s VAL 66 N 0.10 0.08 0.20 1.34 0.11 0.33 -4.74 120.40 117.82 1p97 s VAL 66 Ca -0.01 -0.68 0.08 0.00 -2.93 0.00 0.00 61.98 58.44 1p97 s VAL 66 Cb -0.04 -0.58 -0.05 0.00 -1.53 0.00 0.00 36.38 34.19 1p97 s VAL 66 CO 0.01 -0.37 -0.16 0.68 -3.33 0.00 0.00 175.10 171.93 1p97 s VAL 67 N -1.61 1.84 0.07 2.04 -7.23 -1.26 0.53 120.40 114.77 1p97 s VAL 67 Ca -0.13 -2.17 -0.26 0.00 -1.81 0.00 0.00 61.98 57.62 1p97 s VAL 67 Cb -0.06 -2.02 0.09 0.00 0.56 0.00 0.00 36.38 34.95 1p97 s VAL 67 CO 0.01 -0.51 0.75 -0.55 -0.31 0.00 0.00 175.10 174.49 1p97 s SER 68 N -3.19 -0.47 0.00 4.85 0.15 -0.91 -4.94 113.70 109.19 1p97 s SER 68 Ca 0.22 0.03 0.00 0.00 0.70 0.00 0.00 55.95 56.90 1p97 s SER 68 Cb -0.02 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.78 1p97 s SER 68 CO 0.08 -0.78 0.00 0.61 1.20 0.00 0.00 173.24 174.35 1p97 n GLY 69 N -0.25 2.00 3.69 9.45 0.00 -1.26 -3.11 105.19 115.70 1p97 n GLY 69 Ca -0.13 -2.11 -0.53 0.00 0.00 0.00 0.00 46.02 43.25 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 -0.80 1.66 -4.64 1.61 6.02 -1.23 -4.29 117.38 115.70 1p97 n GLN 70 Ca 0.00 0.61 -0.29 0.00 -0.01 0.00 0.00 57.00 57.31 1p97 n GLN 70 Cb 0.00 -2.36 -0.09 0.00 1.02 0.00 0.00 30.24 28.81 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 3.48 2.07 -0.36 1.08 -0.85 0.65 -4.81 117.35 118.61 1p97 s TYR 71 Ca 0.94 -0.91 -0.17 0.00 -0.52 0.00 0.00 57.07 56.41 1p97 s TYR 71 Cb -0.88 -1.56 -0.00 0.00 0.38 0.00 0.00 41.96 39.90 1p97 s TYR 71 CO 0.57 0.20 0.44 1.03 -1.52 0.00 0.00 175.55 176.27 1p97 s ARG 72 N -3.80 3.51 -0.12 -3.49 0.52 -1.26 -1.22 118.95 113.08 1p97 s ARG 72 Ca 0.21 -0.37 -0.05 0.00 -0.52 0.00 0.00 55.73 55.00 1p97 s ARG 72 Cb 0.05 -3.83 -0.04 0.00 0.52 0.00 0.00 34.95 31.65 1p97 s ARG 72 CO 0.11 -0.64 0.07 1.41 0.02 0.00 0.00 175.30 176.28 1p97 s MET 73 N 2.21 3.42 -0.12 3.54 1.75 0.52 -3.34 119.30 127.28 1p97 s MET 73 Ca 0.15 -0.28 -0.29 0.00 -1.25 0.00 0.00 55.69 54.02 1p97 s MET 73 Cb -0.16 -3.06 -0.03 0.00 2.84 0.00 0.00 34.83 34.42 1p97 s MET 73 CO 0.13 0.63 1.31 -1.17 -0.65 0.00 0.00 175.02 175.27 1p97 s LEU 74 N -0.63 4.23 0.59 4.11 2.96 -1.24 -1.49 118.68 127.21 1p97 s LEU 74 Ca 0.11 1.81 -0.06 0.00 -0.22 0.00 0.00 54.13 55.78 1p97 s LEU 74 Cb -0.12 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.04 1p97 s LEU 74 CO 0.02 -0.75 0.91 0.00 -1.32 0.00 0.00 176.35 175.21 1p97 s ALA 75 N 3.27 3.28 0.40 5.97 0.00 0.91 -4.88 121.76 130.72 1p97 s ALA 75 Ca 0.58 -0.67 0.24 0.00 0.00 0.00 0.00 51.96 52.12 1p97 s ALA 75 Cb -0.24 -2.63 1.32 0.00 0.00 0.00 0.00 23.12 21.56 1p97 s ALA 75 CO 0.19 -0.80 1.64 -0.22 0.00 0.00 0.00 175.76 176.56 1p97 h LYS 76 N -0.19 0.14 -0.87 0.00 3.64 -1.34 0.50 116.57 118.45 1p97 h LYS 76 Ca -0.45 -0.01 -0.49 0.00 -1.27 0.00 0.00 60.65 58.43 1p97 h LYS 76 Cb 1.25 -0.03 -0.27 0.00 -0.41 0.00 0.00 32.23 32.77 1p97 h LYS 76 CO 0.61 0.09 0.51 -2.39 -2.27 0.00 0.00 179.45 176.00 1p97 n HIS 77 N -4.86 2.73 -1.20 1.91 1.44 -1.26 -4.83 115.22 109.15 1p97 n HIS 77 Ca 0.35 -2.07 -0.07 0.00 -2.01 0.00 0.00 57.72 53.93 1p97 n HIS 77 Cb 1.27 -0.95 -0.03 0.00 0.12 0.00 0.00 29.99 30.40 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 -1.08 0.89 3.91 -1.39 0.00 0.15 -5.00 105.19 102.68 1p97 n GLY 78 Ca 0.55 -0.43 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1p97 n GLY 78 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1p97 s GLY 79 N -2.65 1.66 -0.04 -0.02 0.00 -1.15 -4.52 107.32 100.60 1p97 s GLY 79 Ca 0.00 -0.87 -0.01 0.00 0.00 0.00 0.00 44.72 43.85 1p97 s GLY 79 CO 0.00 -0.28 0.01 -0.19 0.00 0.00 0.00 173.10 172.64 1p97 s TYR 80 N -3.67 0.40 0.04 1.90 2.02 -0.91 -0.06 117.35 117.07 1p97 s TYR 80 Ca 0.66 -0.01 0.08 0.00 -0.37 0.00 0.00 57.07 57.43 1p97 s TYR 80 Cb -0.08 -0.55 -0.03 0.00 -0.40 0.00 0.00 41.96 40.89 1p97 s TYR 80 CO 0.50 -0.20 -0.24 0.14 -1.57 0.00 0.00 175.55 174.18 1p97 s VAL 81 N 1.50 1.90 -0.27 0.71 -7.23 -0.56 0.58 120.40 117.04 1p97 s VAL 81 Ca -0.03 -1.29 -0.22 0.00 -1.81 0.00 0.00 61.98 58.63 1p97 s VAL 81 Cb -0.13 -1.64 -0.01 0.00 0.56 0.00 0.00 36.38 35.16 1p97 s VAL 81 CO -0.03 0.29 0.72 0.26 -0.31 0.00 0.00 175.10 176.03 1p97 s TRP 82 N -0.80 3.26 0.06 2.82 0.52 -1.22 -0.35 118.94 123.22 1p97 s TRP 82 Ca 0.10 0.85 0.06 0.00 0.02 0.00 0.00 56.10 57.13 1p97 s TRP 82 Cb -0.09 -3.01 -0.03 0.00 -1.15 0.00 0.00 33.47 29.19 1p97 s TRP 82 CO 0.02 -0.43 -0.18 -0.51 0.02 0.00 0.00 176.95 175.87 1p97 s LEU 83 N 2.72 2.21 -0.04 2.99 1.02 -0.36 -0.61 118.68 126.61 1p97 s LEU 83 Ca 0.30 -0.54 -0.02 0.00 0.02 0.00 0.00 54.13 53.89 1p97 s LEU 83 Cb -0.15 -0.77 -0.04 0.00 0.02 0.00 0.00 46.19 45.25 1p97 s LEU 83 CO 0.10 0.07 0.08 -0.70 0.02 0.00 0.00 176.35 175.91 1p97 s GLU 84 N -1.37 3.12 -0.11 1.70 2.12 -0.15 -0.25 118.70 123.76 1p97 s GLU 84 Ca 0.04 -0.40 -0.00 0.00 0.36 0.00 0.00 54.97 54.96 1p97 s GLU 84 Cb -0.09 -2.91 0.02 0.00 0.26 0.00 0.00 34.13 31.42 1p97 s GLU 84 CO 0.02 0.68 -0.07 0.99 -0.54 0.00 0.00 175.26 176.34 1p97 s THR 85 N -1.10 1.00 -0.43 -1.70 2.01 -1.18 -0.23 115.64 114.01 1p97 s THR 85 Ca 0.20 -0.27 -0.21 0.00 0.31 0.00 0.00 61.69 61.71 1p97 s THR 85 Cb -0.12 -1.02 0.02 0.00 0.01 0.00 0.00 72.50 71.39 1p97 s THR 85 CO 0.10 0.36 0.68 -1.58 -0.69 0.00 0.00 174.62 173.49 1p97 s GLN 86 N 1.72 3.38 0.10 4.92 0.74 -0.25 -2.15 119.66 128.12 1p97 s GLN 86 Ca 0.05 -0.23 0.03 0.00 0.05 0.00 0.00 55.36 55.27 1p97 s GLN 86 Cb -0.13 -3.92 -0.04 0.00 1.10 0.00 0.00 33.01 30.02 1p97 s GLN 86 CO -0.08 -0.99 0.10 0.20 -0.55 0.00 0.00 175.29 173.97 1p97 s GLY 87 N 2.00 1.96 -0.19 2.59 0.00 0.19 -1.38 107.32 112.48 1p97 s GLY 87 Ca 0.25 -1.05 -0.15 0.00 0.00 0.00 0.00 44.72 43.77 1p97 s GLY 87 CO 0.19 -1.03 0.48 -1.59 0.00 0.00 0.00 173.10 171.15 1p97 s THR 88 N -1.48 -0.01 -0.28 0.90 2.01 -0.64 -0.51 115.64 115.63 1p97 s THR 88 Ca 0.30 0.03 -0.11 0.00 0.31 0.00 0.00 61.69 62.21 1p97 s THR 88 Cb -0.12 -0.69 -0.05 0.00 0.01 0.00 0.00 72.50 71.65 1p97 s THR 88 CO 0.23 0.01 0.20 -0.69 -0.69 0.00 0.00 174.62 173.68 1p97 s VAL 89 N 0.70 5.30 -0.40 3.82 1.01 -0.60 -0.21 120.40 130.03 1p97 s VAL 89 Ca -0.04 0.19 -0.20 0.00 0.00 0.00 0.00 61.98 61.94 1p97 s VAL 89 Cb -0.05 -3.54 0.01 0.00 0.00 0.00 0.00 36.38 32.81 1p97 s VAL 89 CO -0.05 0.25 0.63 -0.51 0.00 0.00 0.00 175.10 175.42 1p97 s ILE 90 N 1.75 4.87 0.38 2.22 2.07 0.04 -4.86 121.20 127.66 1p97 s ILE 90 Ca 0.07 0.29 -0.06 0.00 -1.41 0.00 0.00 60.65 59.55 1p97 s ILE 90 Cb -0.16 -4.14 -0.05 0.00 0.13 0.00 0.00 42.46 38.24 1p97 s ILE 90 CO 0.11 -0.46 0.67 -0.31 -1.91 0.00 0.00 174.94 173.04 1p97 s TYR 91 N 2.74 3.50 0.24 3.50 1.51 -1.26 -1.07 117.35 126.50 1p97 s TYR 91 Ca 0.23 0.78 -0.30 0.00 -1.01 0.00 0.00 57.07 56.77 1p97 s TYR 91 Cb -0.14 -2.23 -0.09 0.00 -0.11 0.00 0.00 41.96 39.38 1p97 s TYR 91 CO 0.17 -0.03 1.22 1.21 -1.11 0.00 0.00 175.55 177.02 1p97 s ASN 92 N -3.48 7.02 0.25 2.29 3.84 -0.73 -4.75 114.94 119.38 1p97 s ASN 92 Ca 0.47 2.37 0.05 0.00 0.21 0.00 0.00 52.86 55.95 1p97 s ASN 92 Cb -0.10 -2.62 0.31 0.00 -0.55 0.00 0.00 41.25 38.28 1p97 s ASN 92 CO 0.35 -0.39 1.60 1.55 -2.79 0.00 0.00 177.10 177.42 1p97 h PRO 93 N 4.61 0.26 0.15 0.43 0.13 -1.96 0.34 132.00 135.96 1p97 h PRO 93 Ca -0.46 -0.16 -0.32 0.00 -0.87 0.00 0.00 66.00 64.19 1p97 h PRO 93 Cb 1.22 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1p97 h PRO 93 CO 0.72 0.73 -1.62 0.00 -0.23 0.00 0.00 178.00 177.60 1p97 h ARG 94 N 0.20 0.33 0.00 0.86 3.08 -1.99 -3.39 114.38 113.46 1p97 h ARG 94 Ca 0.00 -0.56 -0.01 0.00 0.07 0.00 0.00 59.98 59.49 1p97 h ARG 94 Cb 1.01 0.21 -0.00 0.00 0.08 0.00 0.00 29.97 31.27 1p97 h ARG 94 CO 0.08 1.27 -1.38 -1.71 -1.07 0.00 0.00 179.97 177.16 1p97 n ASN 95 N -3.73 3.15 -2.00 7.04 4.05 -1.25 -5.01 115.26 117.51 1p97 n ASN 95 Ca -0.25 0.00 -0.17 0.00 0.45 0.00 0.00 54.58 54.61 1p97 n ASN 95 Cb 1.00 1.33 -0.04 0.00 1.23 0.00 0.00 39.78 43.31 1p97 n ASN 95 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1p97 n LEU 96 N -1.81 -1.42 -4.84 1.20 4.77 0.12 -4.93 117.00 110.10 1p97 n LEU 96 Ca -0.02 0.23 -0.31 0.00 -0.03 0.00 0.00 56.01 55.88 1p97 n LEU 96 Cb 0.24 -2.50 0.03 0.00 -2.33 0.00 0.00 43.42 38.85 1p97 n LEU 96 CO 0.17 -0.49 0.71 0.00 -1.33 0.00 0.00 177.39 176.45 1p97 s GLN 97 N -4.32 3.26 -0.57 3.23 1.03 -1.26 -4.51 119.66 116.53 1p97 s GLN 97 Ca 0.00 0.90 -0.26 0.00 0.04 0.00 0.00 55.36 56.04 1p97 s GLN 97 Cb 0.00 -2.03 -0.09 0.00 0.03 0.00 0.00 33.01 30.91 1p97 s GLN 97 CO 0.00 -0.84 2.44 -0.35 -2.54 0.00 0.00 175.29 174.00 1p97 n PRO 98 N -2.81 0.88 -0.04 9.60 -0.04 -1.26 -1.77 135.00 139.56 1p97 n PRO 98 Ca 0.07 -0.09 -0.14 0.00 -0.04 0.00 0.00 63.50 63.30 1p97 n PRO 98 Cb 0.54 -3.27 -0.08 0.00 -0.04 0.00 0.00 33.50 30.64 1p97 n PRO 98 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 1p97 h GLN 99 N 18.20 0.34 -2.58 0.54 5.75 -1.39 -3.29 115.11 132.68 1p97 h GLN 99 Ca -0.20 -0.23 0.10 0.00 -0.15 0.00 0.00 58.65 58.17 1p97 h GLN 99 Cb 1.25 0.03 -0.11 0.00 1.07 0.00 0.00 27.48 29.72 1p97 h GLN 99 CO 1.17 0.83 0.38 0.00 -2.65 0.00 0.00 178.83 178.57 1p97 s ILE 101 N -3.44 2.91 -0.25 0.00 1.09 0.97 -0.78 121.20 121.70 1p97 s ILE 101 Ca 0.07 -0.71 -0.05 0.00 -1.10 0.00 0.00 60.65 58.87 1p97 s ILE 101 Cb -0.02 -2.22 -0.00 0.00 -1.06 0.00 0.00 42.46 39.16 1p97 s ILE 101 CO -0.04 0.52 -0.00 -0.04 -0.10 0.00 0.00 174.94 175.29 1p97 s MET 102 N 0.45 3.25 -0.19 2.79 -1.94 0.71 0.06 119.30 124.43 1p97 s MET 102 Ca -0.10 -0.72 -0.01 0.00 -1.71 0.00 0.00 55.69 53.14 1p97 s MET 102 Cb -0.16 -3.14 0.00 0.00 2.01 0.00 0.00 34.83 33.55 1p97 s MET 102 CO 0.05 -0.29 -0.12 0.00 -0.01 0.00 0.00 175.02 174.64 1p97 s VAL 104 N 1.19 4.96 -0.09 0.00 1.01 -0.48 -1.69 120.40 125.31 1p97 s VAL 104 Ca 0.02 0.42 -0.01 0.00 0.00 0.00 0.00 61.98 62.42 1p97 s VAL 104 Cb -0.14 -4.01 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 1p97 s VAL 104 CO -0.05 -0.26 -0.05 0.20 0.00 0.00 0.00 175.10 174.94 1p97 s ASN 105 N 1.78 4.78 -0.29 3.32 0.01 -1.08 -1.09 114.94 122.37 1p97 s ASN 105 Ca 0.21 -0.02 0.03 0.00 -0.71 0.00 0.00 52.86 52.37 1p97 s ASN 105 Cb -0.15 -1.36 0.07 0.00 0.41 0.00 0.00 41.25 40.22 1p97 s ASN 105 CO 0.14 0.32 -0.05 -0.31 -1.51 0.00 0.00 177.10 175.69 1p97 s TYR 106 N -0.56 3.41 -0.52 2.20 1.51 0.68 -2.42 117.35 121.65 1p97 s TYR 106 Ca 0.09 -2.48 -0.28 0.00 -1.01 0.00 0.00 57.07 53.39 1p97 s TYR 106 Cb -0.12 -2.24 0.01 0.00 -0.11 0.00 0.00 41.96 39.50 1p97 s TYR 106 CO 0.02 -0.90 1.49 0.08 -1.11 0.00 0.00 175.55 175.14 1p97 s VAL 107 N 1.06 3.73 -0.17 0.71 1.01 0.64 -0.98 120.40 126.41 1p97 s VAL 107 Ca -0.03 0.65 -0.16 0.00 0.00 0.00 0.00 61.98 62.44 1p97 s VAL 107 Cb -0.20 -4.28 -0.05 0.00 0.00 0.00 0.00 36.38 31.85 1p97 s VAL 107 CO -0.06 -1.01 -0.30 0.18 0.00 0.00 0.00 175.10 173.91 1p97 n LEU 108 N 9.84 1.87 -4.96 3.92 4.77 0.22 -4.62 117.00 128.05 1p97 n LEU 108 Ca 0.15 0.40 -0.23 0.00 -0.03 0.00 0.00 56.01 56.30 1p97 n LEU 108 Cb 0.49 -0.77 -0.02 0.00 -2.33 0.00 0.00 43.42 40.79 1p97 n LEU 108 CO 0.71 -0.32 -0.01 -0.55 -1.33 0.00 0.00 177.39 175.88 1p97 s SER 109 N -5.83 6.32 0.34 -1.43 0.15 -0.98 -4.99 113.70 107.29 1p97 s SER 109 Ca -0.25 0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.56 1p97 s SER 109 Cb 0.03 -1.90 0.00 0.00 -1.71 0.00 0.00 66.02 62.44 1p97 s SER 109 CO 0.37 -0.08 0.00 -1.84 1.20 0.00 0.00 173.24 172.89 1p97 n GLU 110 N -1.29 0.90 -2.18 5.44 0.28 -1.26 -3.40 120.64 119.13 1p97 n GLU 110 Ca -0.08 0.00 -0.43 0.00 -0.16 0.00 0.00 57.16 56.49 1p97 n GLU 110 Cb 0.56 0.00 -0.02 0.00 1.43 0.00 0.00 31.44 33.41 1p97 n GLU 110 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1p97 s ILE 111 N -0.01 3.75 -0.42 3.84 1.01 -1.26 -4.26 121.20 123.85 1p97 s ILE 111 Ca 0.00 0.81 -0.11 0.00 0.00 0.00 0.00 60.65 61.35 1p97 s ILE 111 Cb 0.00 -3.86 0.06 0.00 0.01 0.00 0.00 42.46 38.67 1p97 s ILE 111 CO 0.00 -0.45 0.27 -0.70 0.00 0.00 0.00 174.94 174.07 1p97 s GLU 112 N 4.89 2.77 -0.92 2.79 2.12 0.20 -4.94 118.70 125.60 1p97 s GLU 112 Ca 0.69 -1.30 -0.21 0.00 0.36 0.00 0.00 54.97 54.51 1p97 s GLU 112 Cb -0.21 -3.85 0.09 0.00 0.26 0.00 0.00 34.13 30.43 1p97 s GLU 112 CO 0.30 -0.88 1.22 0.15 -0.54 0.00 0.00 175.26 175.51 1p97 s LYS 113 N 1.52 3.52 0.00 4.30 1.02 -1.26 -2.14 119.74 126.70 1p97 s LYS 113 Ca 0.03 -1.38 0.00 0.00 0.02 0.00 0.00 55.97 54.64 1p97 s LYS 113 Cb -0.22 -4.95 0.00 0.00 -0.52 0.00 0.00 37.83 32.14 1p97 s LYS 113 CO 0.05 -1.94 0.00 0.09 -0.92 0.00 0.00 175.35 172.63