#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p97 n ALA 2 N 0.00 0.00 -3.45 4.61 0.00 -1.26 -4.90 120.51 115.51 1p97 n ALA 2 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 1p97 n ALA 2 Cb 0.00 -1.02 -0.12 0.00 0.00 0.00 0.00 19.45 18.32 1p97 n ALA 2 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1p97 s MET 3 N -1.33 0.32 -0.02 0.00 1.00 -1.26 -5.14 119.30 112.88 1p97 s MET 3 Ca 0.00 -0.46 0.01 0.00 0.00 0.00 0.00 55.69 55.24 1p97 s MET 3 Cb 0.00 -0.91 -0.04 0.00 0.00 0.00 0.00 34.83 33.89 1p97 s MET 3 CO 0.00 -1.06 0.00 -0.51 0.00 0.00 0.00 175.02 173.46 1p97 s ASP 4 N 2.07 5.16 0.00 3.03 1.11 -1.26 -5.07 116.67 121.70 1p97 s ASP 4 Ca 0.11 0.03 0.00 0.00 0.18 0.00 0.00 52.55 52.86 1p97 s ASP 4 Cb -0.16 -1.37 0.00 0.00 1.07 0.00 0.00 42.92 42.46 1p97 s ASP 4 CO -0.29 0.30 0.00 -0.24 1.18 0.00 0.00 175.17 176.12 1p97 n SER 5 N 1.52 0.00 -4.57 0.27 2.88 -1.26 -5.10 113.62 107.36 1p97 n SER 5 Ca -0.15 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 56.96 1p97 n SER 5 Cb 0.53 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.94 1p97 n SER 5 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1p97 s LYS 6 N 1.99 3.59 -0.07 -1.46 -0.14 -1.25 -4.97 119.74 117.44 1p97 s LYS 6 Ca 0.00 0.16 0.01 0.00 -1.36 0.00 0.00 55.97 54.78 1p97 s LYS 6 Cb 0.00 -3.88 0.02 0.00 -1.68 0.00 0.00 37.83 32.29 1p97 s LYS 6 CO 0.00 -1.04 -0.06 0.99 -0.76 0.00 0.00 175.35 174.48 1p97 s THR 7 N 3.35 0.73 -0.04 2.17 2.01 -1.26 0.05 115.64 122.66 1p97 s THR 7 Ca 0.33 -0.19 0.03 0.00 0.31 0.00 0.00 61.69 62.18 1p97 s THR 7 Cb -0.12 -0.75 0.00 0.00 0.01 0.00 0.00 72.50 71.64 1p97 s THR 7 CO 0.21 0.29 -0.13 0.72 -0.69 0.00 0.00 174.62 175.02 1p97 s PHE 8 N 1.21 1.35 0.34 4.92 -0.71 -0.97 -4.97 117.98 119.15 1p97 s PHE 8 Ca -0.06 -0.38 -0.26 0.00 -1.04 0.00 0.00 56.93 55.19 1p97 s PHE 8 Cb -0.14 -0.93 -0.09 0.00 -1.21 0.00 0.00 43.02 40.64 1p97 s PHE 8 CO -0.02 -0.14 1.03 -1.17 -1.34 0.00 0.00 175.22 173.58 1p97 s LEU 9 N 0.16 4.34 0.08 -1.99 1.98 -1.26 -2.25 118.68 119.73 1p97 s LEU 9 Ca -0.04 2.04 -0.01 0.00 -2.89 0.00 0.00 54.13 53.22 1p97 s LEU 9 Cb -0.11 -3.95 -0.04 0.00 0.66 0.00 0.00 46.19 42.76 1p97 s LEU 9 CO 0.01 -0.24 0.01 -0.94 -1.89 0.00 0.00 176.35 173.30 1p97 s SER 10 N -1.37 0.42 -0.05 3.68 1.04 0.39 -1.03 113.70 116.78 1p97 s SER 10 Ca 0.51 -1.04 0.01 0.00 0.48 0.00 0.00 55.95 55.91 1p97 s SER 10 Cb -0.24 0.24 0.02 0.00 0.10 0.00 0.00 66.02 66.13 1p97 s SER 10 CO 0.30 -0.64 -0.06 -0.13 0.98 0.00 0.00 173.24 173.69 1p97 s ARG 11 N -3.95 1.04 0.21 4.02 1.81 -0.01 -1.42 118.95 120.65 1p97 s ARG 11 Ca 0.12 -0.18 0.09 0.00 -1.72 0.00 0.00 55.73 54.03 1p97 s ARG 11 Cb 0.08 -0.97 -0.04 0.00 -0.45 0.00 0.00 34.95 33.56 1p97 s ARG 11 CO -0.07 -0.05 -0.03 -1.01 -0.68 0.00 0.00 175.30 173.47 1p97 s HIS 12 N 0.83 2.73 0.72 -0.53 3.76 0.57 -0.58 115.29 122.79 1p97 s HIS 12 Ca -0.12 -0.19 -0.03 0.00 -0.15 0.00 0.00 55.06 54.57 1p97 s HIS 12 Cb -0.15 -1.29 0.15 0.00 1.11 0.00 0.00 32.58 32.40 1p97 s HIS 12 CO 0.01 0.55 0.99 -1.13 -0.85 0.00 0.00 174.74 174.32 1p97 n SER 13 N -0.35 1.10 -0.23 1.40 3.41 -1.26 0.13 113.62 117.82 1p97 n SER 13 Ca -0.09 -1.98 0.03 0.00 -0.26 0.00 0.00 58.87 56.57 1p97 n SER 13 Cb 0.57 -0.66 0.15 0.00 -0.26 0.00 0.00 64.21 64.00 1p97 n SER 13 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 1p97 h MET 14 N 0.00 0.23 0.00 4.33 4.05 -1.78 0.16 114.93 121.93 1p97 h MET 14 Ca -0.33 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.08 1p97 h MET 14 Cb 1.15 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.90 1p97 h MET 14 CO 0.33 0.16 0.00 0.38 0.23 0.00 0.00 176.91 178.00 1p97 h ASP 15 N 0.24 0.00 -5.00 1.39 2.03 -1.94 -3.48 116.42 109.66 1p97 h ASP 15 Ca 0.37 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 56.57 1p97 h ASP 15 Cb 0.61 0.00 0.08 0.00 -0.83 0.00 0.00 39.33 39.19 1p97 h ASP 15 CO -0.49 0.00 -0.35 0.80 -1.03 0.00 0.00 179.24 178.18 1p97 n MET 16 N -2.95 -1.47 -0.09 4.15 1.56 0.58 -5.01 117.12 113.89 1p97 n MET 16 Ca 0.02 1.04 -0.12 0.00 -0.27 0.00 0.00 57.70 58.37 1p97 n MET 16 Cb 0.38 -5.08 -0.04 0.00 2.15 0.00 0.00 33.22 30.63 1p97 n MET 16 CO 0.00 0.00 0.00 0.36 -0.73 0.00 0.00 175.97 175.60 1p97 n LYS 17 N -2.27 0.48 0.00 2.12 2.85 -1.26 -4.29 118.16 115.79 1p97 n LYS 17 Ca -0.03 0.20 0.00 0.00 -1.05 0.00 0.00 58.31 57.43 1p97 n LYS 17 Cb 0.55 -1.33 0.00 0.00 -0.65 0.00 0.00 35.03 33.59 1p97 n LYS 17 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1p97 n PHE 18 N -4.29 0.00 0.28 5.58 3.72 -1.17 -1.07 117.46 120.51 1p97 n PHE 18 Ca -0.21 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.25 1p97 n PHE 18 Cb 0.55 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 39.02 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 -3.65 4.37 -2.24 0.26 -0.79 114.28 112.22 1p97 n THR 19 Ca 0.00 -0.25 -0.15 0.00 -2.27 0.00 0.00 64.05 61.38 1p97 n THR 19 Cb 0.00 0.66 -0.08 0.00 -2.10 0.00 0.00 70.33 68.81 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 -2.35 -0.57 -0.03 4.78 5.04 -1.00 -4.84 117.35 118.38 1p97 s TYR 20 Ca 0.00 1.26 0.01 0.00 -2.44 0.00 0.00 57.07 55.90 1p97 s TYR 20 Cb 0.08 0.24 0.02 0.00 0.35 0.00 0.00 41.96 42.65 1p97 s TYR 20 CO 0.45 -0.39 -0.03 0.00 -1.34 0.00 0.00 175.55 174.24 1p97 s ASP 22 N 0.64 5.67 0.60 0.00 -1.08 -0.20 -4.63 116.67 117.68 1p97 s ASP 22 Ca -0.07 2.21 0.35 0.00 -0.52 0.00 0.00 52.55 54.52 1p97 s ASP 22 Cb -0.11 -2.58 1.93 0.00 -1.46 0.00 0.00 42.92 40.70 1p97 s ASP 22 CO -0.00 -1.26 2.24 0.44 0.52 0.00 0.00 175.17 177.11 1p97 h ASP 23 N 1.20 0.00 -0.08 -0.34 3.32 -2.00 0.12 116.42 118.65 1p97 h ASP 23 Ca -0.50 0.00 0.02 0.00 0.02 0.00 0.00 57.03 56.57 1p97 h ASP 23 Cb 1.27 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.81 1p97 h ASP 23 CO 0.57 0.03 0.16 0.03 -1.72 0.00 0.00 179.24 178.31 1p97 h ARG 24 N 0.00 0.00 -0.26 3.56 2.47 -1.93 -2.51 114.38 115.71 1p97 h ARG 24 Ca -0.00 0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.73 1p97 h ARG 24 Cb 0.12 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.43 1p97 h ARG 24 CO 0.00 0.00 0.17 0.97 0.56 0.00 0.00 179.97 181.68 1p97 h ILE 25 N 0.00 1.05 -0.77 2.04 -0.00 -1.27 0.55 117.51 119.10 1p97 h ILE 25 Ca 0.04 -0.11 0.16 0.00 -0.00 0.00 0.00 64.86 64.94 1p97 h ILE 25 Cb 0.36 0.70 -0.05 0.00 -0.00 0.00 0.00 36.82 37.83 1p97 h ILE 25 CO -0.00 0.06 0.52 0.71 -0.00 0.00 0.00 178.15 179.43 1p97 h THR 26 N 0.32 0.78 0.00 2.19 1.35 -1.21 0.28 112.91 116.62 1p97 h THR 26 Ca 0.10 -0.14 -0.03 0.00 -0.55 0.00 0.00 66.41 65.78 1p97 h THR 26 Cb 0.01 0.33 -0.01 0.00 -1.73 0.00 0.00 68.15 66.75 1p97 h THR 26 CO -0.02 0.08 -1.21 -0.62 -0.25 0.00 0.00 175.52 173.50 1p97 n GLU 27 N -4.48 0.62 -0.11 4.72 -0.58 0.12 -3.30 120.64 117.62 1p97 n GLU 27 Ca 0.15 0.10 -0.20 0.00 -0.42 0.00 0.00 57.16 56.79 1p97 n GLU 27 Cb 0.55 -1.79 -0.07 0.00 -0.57 0.00 0.00 31.44 29.57 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 -2.67 1.94 -0.10 -4.62 4.77 -0.39 -4.62 117.00 111.31 1p97 n LEU 28 Ca -0.03 0.35 0.08 0.00 -0.03 0.00 0.00 56.01 56.39 1p97 n LEU 28 Cb 0.61 -0.80 -0.07 0.00 -2.33 0.00 0.00 43.42 40.83 1p97 n LEU 28 CO 0.41 0.16 0.04 -0.38 -1.33 0.00 0.00 177.39 176.30 1p97 n ILE 29 N -4.36 0.00 0.00 -0.08 2.08 0.84 -4.91 119.36 112.93 1p97 n ILE 29 Ca -0.35 -0.16 0.00 0.00 0.56 0.00 0.00 62.75 62.80 1p97 n ILE 29 Cb 0.70 1.05 0.00 0.00 -0.75 0.00 0.00 39.64 40.64 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 1.34 2.97 3.23 7.39 0.00 -0.33 0.39 105.19 120.18 1p97 n GLY 30 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.40 -3.97 -4.00 1.61 4.01 -1.26 -4.74 117.16 107.42 1p97 n TYR 31 Ca 0.00 -0.98 -0.26 0.00 -0.16 0.00 0.00 57.90 56.50 1p97 n TYR 31 Cb 0.00 -0.88 -0.04 0.00 -0.31 0.00 0.00 39.34 38.11 1p97 n TYR 31 CO 0.00 0.00 0.00 -1.01 -0.46 0.00 0.00 176.86 175.39 1p97 s HIS 32 N -3.36 3.35 0.26 -0.72 3.76 -1.26 -2.66 115.29 114.65 1p97 s HIS 32 Ca 0.63 0.06 -0.02 0.00 -0.15 0.00 0.00 55.06 55.58 1p97 s HIS 32 Cb -0.02 -1.60 0.55 0.00 1.11 0.00 0.00 32.58 32.62 1p97 s HIS 32 CO 0.45 0.52 1.69 -1.35 -0.85 0.00 0.00 174.74 175.20 1p97 h PRO 33 N 2.23 0.31 0.00 8.40 0.11 -1.83 0.14 132.00 141.36 1p97 h PRO 33 Ca -0.48 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 1p97 h PRO 33 Cb 1.20 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1p97 h PRO 33 CO 0.66 0.21 -0.01 0.93 -0.21 0.00 0.00 178.00 179.58 1p97 h GLU 34 N 0.32 0.00 0.12 1.05 4.39 -1.94 -1.63 114.58 116.89 1p97 h GLU 34 Ca 0.47 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.89 1p97 h GLU 34 Cb 0.83 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.49 1p97 h GLU 34 CO -0.52 0.01 -1.21 0.93 -1.16 0.00 0.00 179.01 177.05 1p97 h GLU 35 N 0.00 0.38 0.00 2.33 4.39 -1.11 -3.29 114.58 117.28 1p97 h GLU 35 Ca -0.00 -0.56 -0.13 0.00 0.34 0.00 0.00 59.36 59.00 1p97 h GLU 35 Cb 0.44 0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 29.27 1p97 h GLU 35 CO 0.00 1.24 -1.08 -0.07 -1.16 0.00 0.00 179.01 177.95 1p97 h LEU 36 N 0.14 0.00 -8.32 1.33 4.07 -0.96 -3.45 115.31 108.12 1p97 h LEU 36 Ca -0.15 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.80 1p97 h LEU 36 Cb 1.91 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 43.65 1p97 h LEU 36 CO 0.21 0.50 0.08 0.18 -1.08 0.00 0.00 178.44 178.34 1p97 n LEU 37 N -2.98 1.67 0.00 1.67 4.77 -0.66 -1.61 117.00 119.87 1p97 n LEU 37 Ca -0.05 -1.48 0.00 0.00 -0.03 0.00 0.00 56.01 54.45 1p97 n LEU 37 Cb 0.78 -1.62 0.00 0.00 -2.33 0.00 0.00 43.42 40.25 1p97 n LEU 37 CO 0.42 -2.62 0.00 0.61 -1.33 0.00 0.00 177.39 174.47 1p97 n GLY 38 N 6.75 1.96 3.26 -0.72 0.00 0.03 -5.00 105.19 111.47 1p97 n GLY 38 Ca 0.48 0.00 -0.20 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 -0.33 1.07 -0.42 1.61 1.70 -0.63 -5.01 118.95 116.94 1p97 s ARG 39 Ca 0.00 -1.22 -0.29 0.00 -0.47 0.00 0.00 55.73 53.75 1p97 s ARG 39 Cb 0.00 -1.08 0.01 0.00 -0.57 0.00 0.00 34.95 33.31 1p97 s ARG 39 CO 0.00 0.23 1.33 -1.12 -1.08 0.00 0.00 175.30 174.66 1p97 s SER 40 N -2.29 6.45 0.28 -2.89 0.01 -1.26 -3.04 113.70 110.96 1p97 s SER 40 Ca 0.08 0.78 -0.01 0.00 1.31 0.00 0.00 55.95 58.11 1p97 s SER 40 Cb -0.07 -2.54 0.64 0.00 0.21 0.00 0.00 66.02 64.26 1p97 s SER 40 CO 0.04 -1.35 1.63 0.00 0.41 0.00 0.00 173.24 173.97 1p97 h ALA 41 N 10.17 1.11 0.00 1.44 0.00 -1.28 -1.66 119.26 129.05 1p97 h ALA 41 Ca -0.26 0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1p97 h ALA 41 Cb 1.09 0.41 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1p97 h ALA 41 CO 1.09 -0.48 0.13 0.66 0.00 0.00 0.00 179.25 180.64 1p97 n TYR 42 N -5.32 0.09 0.63 0.00 4.01 -1.26 0.46 117.16 115.78 1p97 n TYR 42 Ca 0.20 0.05 0.11 0.00 -0.16 0.00 0.00 57.90 58.09 1p97 n TYR 42 Cb 0.64 -0.46 0.45 0.00 -0.31 0.00 0.00 39.34 39.66 1p97 n TYR 42 CO 0.00 0.00 0.00 -0.85 -0.46 0.00 0.00 176.86 175.55 1p97 n GLU 43 N -1.51 0.09 0.00 -0.72 0.28 -0.62 -3.89 120.64 114.26 1p97 n GLU 43 Ca -0.00 0.22 0.00 0.00 -0.16 0.00 0.00 57.16 57.21 1p97 n GLU 43 Cb 0.13 -1.63 0.00 0.00 1.43 0.00 0.00 31.44 31.37 1p97 n GLU 43 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 1p97 n PHE 44 N -1.79 0.00 -0.81 -1.84 1.16 0.62 -5.01 117.46 109.79 1p97 n PHE 44 Ca 0.04 0.00 -0.33 0.00 -1.87 0.00 0.00 57.45 55.29 1p97 n PHE 44 Cb 0.27 0.03 -0.05 0.00 -1.61 0.00 0.00 39.48 38.12 1p97 n PHE 44 CO 0.00 0.00 0.00 0.98 -1.87 0.00 0.00 176.76 175.87 1p97 n TYR 45 N 0.00 1.22 -2.08 2.97 9.36 0.17 -3.09 117.16 125.72 1p97 n TYR 45 Ca 0.00 -1.49 -0.02 0.00 3.32 0.00 0.00 57.90 59.71 1p97 n TYR 45 Cb 0.23 -1.42 -0.02 0.00 -0.63 0.00 0.00 39.34 37.51 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 6.61 -3.02 0.22 2.98 8.25 -1.25 -3.84 115.22 125.18 1p97 n HIS 46 Ca 0.42 1.78 -0.16 0.00 -0.26 0.00 0.00 57.72 59.50 1p97 n HIS 46 Cb 0.29 -3.13 -0.09 0.00 1.12 0.00 0.00 29.99 28.18 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 2.70 -1.07 0.00 -1.41 0.00 -1.80 0.81 119.26 118.49 1p97 h ALA 47 Ca -0.23 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1p97 h ALA 47 Cb 0.52 0.71 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1p97 h ALA 47 CO 0.00 -1.12 -0.88 1.37 0.00 0.00 0.00 179.25 178.63 1p97 h LEU 48 N -0.83 0.00 -1.28 0.00 -0.00 -1.91 -3.34 115.31 107.94 1p97 h LEU 48 Ca -0.05 -0.09 0.00 0.00 -0.00 0.00 0.00 57.88 57.75 1p97 h LEU 48 Cb 0.74 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.40 1p97 h LEU 48 CO -0.09 0.04 -0.16 0.47 -0.00 0.00 0.00 178.44 178.70 1p97 n ASP 49 N -2.47 2.15 -0.26 0.17 9.92 -1.18 -4.09 116.55 120.79 1p97 n ASP 49 Ca 0.01 -1.61 0.05 0.00 -0.53 0.00 0.00 54.79 52.70 1p97 n ASP 49 Cb 0.51 0.14 0.18 0.00 -0.64 0.00 0.00 41.12 41.31 1p97 n ASP 49 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 1p97 h SER 50 N 3.13 0.36 -0.27 -2.24 0.87 -0.94 -2.01 113.55 112.45 1p97 h SER 50 Ca 0.00 0.09 0.05 0.00 -1.23 0.00 0.00 61.79 60.71 1p97 h SER 50 Cb 0.76 0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 62.72 1p97 h SER 50 CO 0.00 0.16 -0.08 -0.33 -0.53 0.00 0.00 176.83 176.05 1p97 h GLU 51 N 0.50 -0.01 -0.94 2.24 4.39 -1.85 0.45 114.58 119.36 1p97 h GLU 51 Ca 0.41 0.00 0.05 0.00 0.34 0.00 0.00 59.36 60.15 1p97 h GLU 51 Cb 0.57 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.17 1p97 h GLU 51 CO -0.37 -0.01 0.62 -0.91 -1.16 0.00 0.00 179.01 177.18 1p97 h ASN 52 N -0.01 1.00 1.26 1.42 4.21 -1.65 -0.22 115.58 121.58 1p97 h ASN 52 Ca 0.13 -0.00 -0.16 0.00 1.21 0.00 0.00 56.30 57.48 1p97 h ASN 52 Cb 0.21 -0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 37.17 1p97 h ASN 52 CO -0.28 0.67 -0.74 0.24 -1.29 0.00 0.00 177.43 176.02 1p97 h MET 53 N 1.15 0.00 -0.52 0.81 2.86 -0.71 -1.33 114.93 117.18 1p97 h MET 53 Ca 0.39 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.91 1p97 h MET 53 Cb 0.08 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 1p97 h MET 53 CO -0.13 0.74 -0.14 1.15 1.06 0.00 0.00 176.91 179.59 1p97 h THR 54 N 0.00 1.27 -0.43 2.22 2.02 0.82 0.26 112.91 119.07 1p97 h THR 54 Ca -0.01 -1.29 -0.09 0.00 0.77 0.00 0.00 66.41 65.79 1p97 h THR 54 Cb 1.57 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 68.98 1p97 h THR 54 CO 0.10 0.45 -0.09 0.11 0.37 0.00 0.00 175.52 176.46 1p97 h LYS 55 N 0.88 0.76 -0.32 6.66 6.56 -1.02 -1.63 116.57 128.45 1p97 h LYS 55 Ca 0.13 -0.24 -0.05 0.00 -1.06 0.00 0.00 60.65 59.43 1p97 h LYS 55 Cb 0.71 -0.07 -0.02 0.00 -0.57 0.00 0.00 32.23 32.28 1p97 h LYS 55 CO 0.05 0.82 -0.01 0.77 -2.06 0.00 0.00 179.45 179.03 1p97 h SER 56 N 0.69 0.47 -0.59 0.86 0.02 -0.78 0.13 113.55 114.36 1p97 h SER 56 Ca 0.12 -0.09 -0.07 0.00 -0.84 0.00 0.00 61.79 60.92 1p97 h SER 56 Cb 0.55 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.94 1p97 h SER 56 CO 0.03 0.54 0.11 -0.74 -1.14 0.00 0.00 176.83 175.64 1p97 h HIS 57 N 0.48 1.02 0.00 3.45 -0.00 0.13 0.48 115.15 120.70 1p97 h HIS 57 Ca 0.10 -0.14 -0.06 0.00 -0.00 0.00 0.00 60.37 60.28 1p97 h HIS 57 Cb 0.33 -0.28 -0.01 0.00 -0.00 0.00 0.00 27.41 27.45 1p97 h HIS 57 CO 0.01 0.88 -0.27 1.96 -0.00 0.00 0.00 177.93 180.51 1p97 h GLN 58 N 0.87 0.00 0.00 5.26 4.20 -0.59 -1.64 115.11 123.21 1p97 h GLN 58 Ca 0.18 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.85 1p97 h GLN 58 Cb 0.40 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 1p97 h GLN 58 CO 0.01 0.27 -0.24 -0.97 -0.67 0.00 0.00 178.83 177.23 1p97 h ASN 59 N 0.00 0.00 0.17 1.46 -1.24 -0.35 -3.35 115.58 112.27 1p97 h ASN 59 Ca -0.00 -0.66 -0.03 0.00 0.71 0.00 0.00 56.30 56.32 1p97 h ASN 59 Cb 0.75 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.79 1p97 h ASN 59 CO 0.04 0.97 -0.15 0.25 -1.29 0.00 0.00 177.43 177.25 1p97 h LEU 60 N -1.00 0.00 -2.54 0.34 5.85 -0.05 -2.36 115.31 115.56 1p97 h LEU 60 Ca -0.06 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.67 1p97 h LEU 60 Cb 0.82 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.85 1p97 h LEU 60 CO -0.04 0.15 0.11 0.00 -0.34 0.00 0.00 178.44 178.32 1p97 n THR 62 N -3.39 0.00 -0.01 0.00 -1.04 -0.99 -4.81 114.28 104.04 1p97 n THR 62 Ca -0.02 -0.50 -0.01 0.00 -2.04 0.00 0.00 64.05 61.48 1p97 n THR 62 Cb 0.19 0.75 -0.03 0.00 -1.82 0.00 0.00 70.33 69.42 1p97 n THR 62 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1p97 n LYS 63 N 0.25 2.74 0.00 -2.82 4.76 -0.92 -5.01 118.16 117.16 1p97 n LYS 63 Ca -0.10 -0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.33 1p97 n LYS 63 Cb 0.92 -1.09 0.00 0.00 -1.84 0.00 0.00 35.03 33.03 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 2.69 1.83 3.56 0.72 0.00 -1.18 -4.96 105.19 107.84 1p97 n GLY 64 Ca -0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.53 0.72 -0.10 1.61 0.74 -1.26 -2.55 119.66 118.29 1p97 s GLN 65 Ca 0.00 0.11 -0.10 0.00 0.05 0.00 0.00 55.36 55.43 1p97 s GLN 65 Cb 0.00 0.34 0.03 0.00 1.10 0.00 0.00 33.01 34.47 1p97 s GLN 65 CO 0.00 -0.24 0.28 0.54 -0.55 0.00 0.00 175.29 175.32 1p97 s VAL 66 N -1.37 0.00 0.16 1.34 0.11 0.17 -4.63 120.40 116.19 1p97 s VAL 66 Ca -0.03 -0.00 0.10 0.00 -2.93 0.00 0.00 61.98 59.11 1p97 s VAL 66 Cb -0.00 -0.39 -0.04 0.00 -1.53 0.00 0.00 36.38 34.41 1p97 s VAL 66 CO 0.02 -0.00 -0.16 -0.69 -3.33 0.00 0.00 175.10 170.94 1p97 s VAL 67 N 0.13 2.86 0.26 2.04 1.01 -1.26 0.56 120.40 125.99 1p97 s VAL 67 Ca -0.00 -1.71 -0.13 0.00 0.00 0.00 0.00 61.98 60.14 1p97 s VAL 67 Cb -0.02 -2.37 0.05 0.00 0.00 0.00 0.00 36.38 34.04 1p97 s VAL 67 CO 0.00 -0.05 0.65 -0.24 0.00 0.00 0.00 175.10 175.46 1p97 n SER 68 N 0.34 -1.63 -4.48 3.32 2.88 -1.21 -4.98 113.62 107.86 1p97 n SER 68 Ca -0.13 -2.07 -0.30 0.00 -1.33 0.00 0.00 58.87 55.05 1p97 n SER 68 Cb 0.55 2.70 -0.08 0.00 -0.75 0.00 0.00 64.21 66.62 1p97 n SER 68 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1p97 s GLY 69 N -2.69 2.84 0.17 0.46 0.00 -1.26 -4.39 107.32 102.44 1p97 s GLY 69 Ca 0.13 -0.78 -0.34 0.00 0.00 0.00 0.00 44.72 43.74 1p97 s GLY 69 CO 0.08 -2.04 1.58 0.61 0.00 0.00 0.00 173.10 173.32 1p97 n GLN 70 N -1.11 2.18 -4.69 2.90 10.64 -1.24 -4.42 117.38 121.63 1p97 n GLN 70 Ca -0.13 0.79 -0.31 0.00 -1.83 0.00 0.00 57.00 55.52 1p97 n GLN 70 Cb 0.66 -2.55 -0.08 0.00 -0.86 0.00 0.00 30.24 27.40 1p97 n GLN 70 CO 0.00 0.00 0.00 1.52 -1.83 0.00 0.00 177.06 176.75 1p97 s TYR 71 N 0.87 1.96 -0.44 2.61 -0.85 0.37 -4.84 117.35 117.03 1p97 s TYR 71 Ca 0.78 -0.96 -0.20 0.00 -0.52 0.00 0.00 57.07 56.17 1p97 s TYR 71 Cb -0.67 -1.56 0.03 0.00 0.38 0.00 0.00 41.96 40.14 1p97 s TYR 71 CO 0.38 0.18 0.60 1.03 -1.52 0.00 0.00 175.55 176.22 1p97 s ARG 72 N -3.83 3.23 -0.17 -3.49 3.00 -1.26 -2.10 118.95 114.34 1p97 s ARG 72 Ca 0.14 -0.47 -0.07 0.00 0.00 0.00 0.00 55.73 55.33 1p97 s ARG 72 Cb 0.03 -3.96 -0.04 0.00 0.00 0.00 0.00 34.95 30.98 1p97 s ARG 72 CO 0.08 -0.99 0.08 1.41 0.00 0.00 0.00 175.30 175.88 1p97 s MET 73 N 2.68 3.85 -0.11 3.54 1.75 0.59 -3.74 119.30 127.86 1p97 s MET 73 Ca 0.20 -0.29 -0.30 0.00 -1.25 0.00 0.00 55.69 54.06 1p97 s MET 73 Cb -0.15 -3.21 -0.03 0.00 2.84 0.00 0.00 34.83 34.28 1p97 s MET 73 CO 0.18 0.40 1.31 -1.17 -0.65 0.00 0.00 175.02 175.09 1p97 s LEU 74 N 0.02 4.23 0.62 4.11 2.96 -1.18 -0.60 118.68 128.85 1p97 s LEU 74 Ca 0.07 1.83 -0.05 0.00 -0.22 0.00 0.00 54.13 55.76 1p97 s LEU 74 Cb -0.12 -3.54 0.03 0.00 0.50 0.00 0.00 46.19 43.06 1p97 s LEU 74 CO 0.00 -0.74 0.92 0.00 -1.32 0.00 0.00 176.35 175.22 1p97 s ALA 75 N 3.15 3.32 0.34 5.97 0.00 0.83 -4.88 121.76 130.49 1p97 s ALA 75 Ca 0.58 -0.85 0.13 0.00 0.00 0.00 0.00 51.96 51.83 1p97 s ALA 75 Cb -0.25 -2.54 1.09 0.00 0.00 0.00 0.00 23.12 21.42 1p97 s ALA 75 CO 0.19 -0.97 1.61 -0.22 0.00 0.00 0.00 175.76 176.38 1p97 h LYS 76 N -0.29 0.11 -1.01 0.00 3.64 -0.39 0.79 116.57 119.43 1p97 h LYS 76 Ca -0.45 -0.01 -0.50 0.00 -1.27 0.00 0.00 60.65 58.42 1p97 h LYS 76 Cb 1.28 -0.03 -0.29 0.00 -0.41 0.00 0.00 32.23 32.79 1p97 h LYS 76 CO 0.60 0.08 0.64 -2.39 -2.27 0.00 0.00 179.45 176.10 1p97 n HIS 77 N -5.24 2.90 -1.27 1.91 1.44 -1.26 -4.82 115.22 108.88 1p97 n HIS 77 Ca 0.32 -1.90 -0.09 0.00 -2.01 0.00 0.00 57.72 54.04 1p97 n HIS 77 Cb 1.04 -0.96 -0.04 0.00 0.12 0.00 0.00 29.99 30.14 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 -1.01 1.08 3.92 -1.39 0.00 0.26 -5.00 105.19 103.05 1p97 n GLY 78 Ca 0.56 -0.43 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.74 1.69 -0.13 -0.02 0.00 -1.16 -4.76 107.32 100.21 1p97 s GLY 79 Ca 0.00 -0.97 -0.02 0.00 0.00 0.00 0.00 44.72 43.73 1p97 s GLY 79 CO 0.00 -0.36 0.01 -0.19 0.00 0.00 0.00 173.10 172.57 1p97 s TYR 80 N -3.68 0.84 -0.01 1.90 2.02 -0.27 -0.12 117.35 118.04 1p97 s TYR 80 Ca 0.68 -0.49 0.04 0.00 -0.37 0.00 0.00 57.07 56.93 1p97 s TYR 80 Cb -0.07 -0.91 -0.03 0.00 -0.40 0.00 0.00 41.96 40.54 1p97 s TYR 80 CO 0.50 -0.46 -0.13 0.14 -1.57 0.00 0.00 175.55 174.03 1p97 s VAL 81 N 1.92 3.17 -0.40 0.71 -7.23 0.23 0.29 120.40 119.09 1p97 s VAL 81 Ca 0.02 -0.86 -0.25 0.00 -1.81 0.00 0.00 61.98 59.08 1p97 s VAL 81 Cb -0.14 -2.31 0.02 0.00 0.56 0.00 0.00 36.38 34.50 1p97 s VAL 81 CO -0.07 0.46 0.88 0.26 -0.31 0.00 0.00 175.10 176.32 1p97 s TRP 82 N -0.87 3.04 -0.00 2.82 0.52 -1.25 -0.30 118.94 122.90 1p97 s TRP 82 Ca 0.14 0.57 0.06 0.00 0.02 0.00 0.00 56.10 56.89 1p97 s TRP 82 Cb -0.11 -3.67 -0.02 0.00 -1.15 0.00 0.00 33.47 28.53 1p97 s TRP 82 CO 0.04 -0.88 -0.17 -0.51 0.02 0.00 0.00 176.95 175.44 1p97 s LEU 83 N 3.44 2.06 -0.00 2.99 1.02 -0.89 -0.43 118.68 126.87 1p97 s LEU 83 Ca 0.36 -0.34 -0.00 0.00 0.02 0.00 0.00 54.13 54.16 1p97 s LEU 83 Cb -0.12 -0.88 -0.04 0.00 0.02 0.00 0.00 46.19 45.17 1p97 s LEU 83 CO 0.20 0.20 0.08 -0.70 0.02 0.00 0.00 176.35 176.16 1p97 s GLU 84 N -0.53 3.07 -0.04 1.70 2.12 0.53 -0.48 118.70 125.07 1p97 s GLU 84 Ca 0.06 -0.49 0.00 0.00 0.36 0.00 0.00 54.97 54.91 1p97 s GLU 84 Cb -0.07 -2.86 0.03 0.00 0.26 0.00 0.00 34.13 31.48 1p97 s GLU 84 CO -0.00 0.65 -0.01 0.99 -0.54 0.00 0.00 175.26 176.34 1p97 s THR 85 N -1.21 0.29 -0.22 -1.70 2.01 -1.26 0.28 115.64 113.84 1p97 s THR 85 Ca 0.23 0.06 -0.11 0.00 0.31 0.00 0.00 61.69 62.18 1p97 s THR 85 Cb -0.12 -0.39 -0.05 0.00 0.01 0.00 0.00 72.50 71.95 1p97 s THR 85 CO 0.14 0.19 0.16 0.00 -0.69 0.00 0.00 174.62 174.42 1p97 s GLN 86 N 1.24 4.12 0.23 4.92 1.03 -0.96 -3.29 119.66 126.95 1p97 s GLN 86 Ca -0.07 -0.22 0.08 0.00 0.04 0.00 0.00 55.36 55.19 1p97 s GLN 86 Cb -0.13 -3.49 -0.04 0.00 0.03 0.00 0.00 33.01 29.37 1p97 s GLN 86 CO -0.02 0.15 0.05 0.20 -2.54 0.00 0.00 175.29 173.13 1p97 s GLY 87 N 0.79 1.62 -0.18 2.60 0.00 0.19 -2.21 107.32 110.14 1p97 s GLY 87 Ca 0.08 -1.49 -0.15 0.00 0.00 0.00 0.00 44.72 43.16 1p97 s GLY 87 CO 0.02 -1.53 0.47 -1.59 0.00 0.00 0.00 173.10 170.47 1p97 s THR 88 N -2.07 -0.00 -0.28 0.90 2.01 -0.61 -0.65 115.64 114.93 1p97 s THR 88 Ca 0.30 0.02 -0.08 0.00 0.31 0.00 0.00 61.69 62.24 1p97 s THR 88 Cb -0.08 -0.66 -0.01 0.00 0.01 0.00 0.00 72.50 71.76 1p97 s THR 88 CO 0.21 0.01 0.10 -0.69 -0.69 0.00 0.00 174.62 173.55 1p97 s VAL 89 N 0.50 4.29 -0.48 3.82 1.01 -1.06 0.10 120.40 128.58 1p97 s VAL 89 Ca -0.02 -0.43 -0.26 0.00 0.00 0.00 0.00 61.98 61.27 1p97 s VAL 89 Cb -0.04 -3.13 0.03 0.00 0.00 0.00 0.00 36.38 33.23 1p97 s VAL 89 CO -0.02 0.16 0.96 -0.51 0.00 0.00 0.00 175.10 175.68 1p97 s ILE 90 N 1.58 4.42 0.35 2.22 2.07 0.27 -4.79 121.20 127.31 1p97 s ILE 90 Ca 0.05 0.73 -0.07 0.00 -1.41 0.00 0.00 60.65 59.94 1p97 s ILE 90 Cb -0.16 -4.48 -0.06 0.00 0.13 0.00 0.00 42.46 37.89 1p97 s ILE 90 CO 0.04 -0.91 0.66 -0.31 -1.91 0.00 0.00 174.94 172.51 1p97 s TYR 91 N 3.89 3.48 0.19 3.50 1.51 -1.26 -0.44 117.35 128.21 1p97 s TYR 91 Ca 0.37 0.83 -0.31 0.00 -1.01 0.00 0.00 57.07 56.96 1p97 s TYR 91 Cb -0.10 -2.27 -0.09 0.00 -0.11 0.00 0.00 41.96 39.39 1p97 s TYR 91 CO 0.26 0.03 1.41 1.21 -1.11 0.00 0.00 175.55 177.34 1p97 s ASN 92 N -3.20 6.76 0.20 2.29 3.84 0.23 -4.68 114.94 120.37 1p97 s ASN 92 Ca 0.47 2.49 -0.04 0.00 0.21 0.00 0.00 52.86 55.99 1p97 s ASN 92 Cb -0.10 -2.61 0.14 0.00 -0.55 0.00 0.00 41.25 38.13 1p97 s ASN 92 CO 0.31 -0.66 1.56 1.55 -2.79 0.00 0.00 177.10 177.07 1p97 h PRO 93 N 5.88 0.69 0.00 0.43 0.13 -1.93 0.29 132.00 137.49 1p97 h PRO 93 Ca -0.44 -0.35 -0.31 0.00 -0.87 0.00 0.00 66.00 64.03 1p97 h PRO 93 Cb 1.21 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.29 1p97 h PRO 93 CO 0.82 0.96 -1.90 2.89 -0.23 0.00 0.00 178.00 180.54 1p97 n ARG 94 N -4.04 0.65 -0.01 0.86 1.85 -1.26 -4.39 116.66 110.32 1p97 n ARG 94 Ca -0.02 0.22 0.08 0.00 -1.00 0.00 0.00 57.85 57.13 1p97 n ARG 94 Cb 0.52 -1.72 -0.12 0.00 -1.05 0.00 0.00 32.46 30.09 1p97 n ARG 94 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1p97 n ASN 95 N -2.98 0.98 0.00 2.89 3.02 -1.25 -4.98 115.26 112.95 1p97 n ASN 95 Ca -0.22 -0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.09 1p97 n ASN 95 Cb 1.08 1.58 0.00 0.00 -0.61 0.00 0.00 39.78 41.83 1p97 n ASN 95 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1p97 n LEU 96 N -1.91 0.32 -4.82 3.41 7.99 0.10 -4.89 117.00 117.21 1p97 n LEU 96 Ca -0.01 0.00 -0.30 0.00 -0.01 0.00 0.00 56.01 55.69 1p97 n LEU 96 Cb 0.40 -0.74 0.09 0.00 -0.11 0.00 0.00 43.42 43.06 1p97 n LEU 96 CO 0.36 -0.16 0.72 0.00 -1.51 0.00 0.00 177.39 176.80 1p97 s GLN 97 N -0.32 2.03 -0.46 3.23 -2.07 -1.26 -4.38 119.66 116.42 1p97 s GLN 97 Ca 0.00 0.52 -0.27 0.00 -1.82 0.00 0.00 55.36 53.80 1p97 s GLN 97 Cb 0.00 -1.92 -0.07 0.00 -1.09 0.00 0.00 33.01 29.93 1p97 s GLN 97 CO 0.00 -1.63 2.39 -0.35 -1.32 0.00 0.00 175.29 174.38 1p97 n PRO 98 N -3.42 1.15 -0.06 9.60 -0.04 -1.26 -0.60 135.00 140.36 1p97 n PRO 98 Ca 0.07 0.08 -0.12 0.00 -0.04 0.00 0.00 63.50 63.49 1p97 n PRO 98 Cb 0.57 -3.35 -0.06 0.00 -0.04 0.00 0.00 33.50 30.62 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 18.61 0.38 -2.43 0.54 5.75 -1.03 -3.38 115.11 133.55 1p97 h GLN 99 Ca -0.26 -0.17 0.13 0.00 -0.15 0.00 0.00 58.65 58.20 1p97 h GLN 99 Cb 1.27 -0.01 -0.10 0.00 1.07 0.00 0.00 27.48 29.71 1p97 h GLN 99 CO 1.13 0.69 0.44 0.00 -2.65 0.00 0.00 178.83 178.45 1p97 s ILE 101 N -3.33 2.73 -0.30 0.00 1.09 0.12 -0.57 121.20 120.94 1p97 s ILE 101 Ca 0.09 -0.77 -0.11 0.00 -1.10 0.00 0.00 60.65 58.77 1p97 s ILE 101 Cb -0.02 -2.13 -0.03 0.00 -1.06 0.00 0.00 42.46 39.22 1p97 s ILE 101 CO -0.02 0.53 0.18 -0.04 -0.10 0.00 0.00 174.94 175.49 1p97 s MET 102 N 0.55 3.60 -0.13 2.79 -1.94 0.12 -0.32 119.30 123.97 1p97 s MET 102 Ca -0.10 -0.55 0.02 0.00 -1.71 0.00 0.00 55.69 53.35 1p97 s MET 102 Cb -0.16 -3.63 0.01 0.00 2.01 0.00 0.00 34.83 33.06 1p97 s MET 102 CO 0.04 -0.32 -0.20 0.00 -0.01 0.00 0.00 175.02 174.53 1p97 s VAL 104 N 0.92 5.29 -0.15 0.00 1.01 -0.94 -0.46 120.40 126.07 1p97 s VAL 104 Ca -0.06 0.16 -0.05 0.00 0.00 0.00 0.00 61.98 62.03 1p97 s VAL 104 Cb -0.15 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 1p97 s VAL 104 CO -0.03 0.20 0.02 0.20 0.00 0.00 0.00 175.10 175.50 1p97 s ASN 105 N 1.74 5.34 -0.36 3.32 0.01 -0.96 -2.25 114.94 121.78 1p97 s ASN 105 Ca 0.08 0.06 0.02 0.00 -0.71 0.00 0.00 52.86 52.30 1p97 s ASN 105 Cb -0.16 -1.79 0.10 0.00 0.41 0.00 0.00 41.25 39.81 1p97 s ASN 105 CO 0.11 0.24 0.09 -0.31 -1.51 0.00 0.00 177.10 175.72 1p97 s TYR 106 N -0.03 3.69 -0.45 2.20 1.51 0.14 -2.29 117.35 122.13 1p97 s TYR 106 Ca 0.04 -2.78 -0.28 0.00 -1.01 0.00 0.00 57.07 53.04 1p97 s TYR 106 Cb -0.13 -2.98 -0.02 0.00 -0.11 0.00 0.00 41.96 38.73 1p97 s TYR 106 CO 0.02 -0.95 1.78 0.08 -1.11 0.00 0.00 175.55 175.36 1p97 s VAL 107 N 0.99 3.48 -0.18 0.71 1.01 0.11 -0.35 120.40 126.17 1p97 s VAL 107 Ca 0.09 0.43 -0.17 0.00 0.00 0.00 0.00 61.98 62.33 1p97 s VAL 107 Cb -0.20 -3.83 -0.14 0.00 0.00 0.00 0.00 36.38 32.22 1p97 s VAL 107 CO -0.07 -0.65 0.09 -0.07 0.00 0.00 0.00 175.10 174.40 1p97 h LEU 108 N 14.59 0.00 0.00 3.92 3.38 -1.05 -3.32 115.31 132.84 1p97 h LEU 108 Ca -0.30 -0.34 -0.16 0.00 0.09 0.00 0.00 57.88 57.18 1p97 h LEU 108 Cb 1.16 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 1p97 h LEU 108 CO 1.11 1.22 -0.08 -0.24 0.09 0.00 0.00 178.44 180.54 1p97 n SER 109 N -4.50 1.64 -1.92 -0.43 2.88 -1.14 -5.03 113.62 105.11 1p97 n SER 109 Ca -0.23 -1.52 0.00 0.00 -1.33 0.00 0.00 58.87 55.79 1p97 n SER 109 Cb 0.53 0.01 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 1p97 n SER 109 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1p97 n GLU 110 N -0.75 1.24 -2.92 -1.46 -0.58 -1.26 -4.35 120.64 110.56 1p97 n GLU 110 Ca -0.02 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.30 1p97 n GLU 110 Cb 0.17 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 30.99 1p97 n GLU 110 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1p97 s ILE 111 N 0.38 4.67 -0.15 -3.67 1.01 -1.26 -3.85 121.20 118.32 1p97 s ILE 111 Ca 0.00 0.84 -0.07 0.00 0.00 0.00 0.00 60.65 61.42 1p97 s ILE 111 Cb 0.00 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.16 1p97 s ILE 111 CO 0.00 -0.53 0.09 -0.70 0.00 0.00 0.00 174.94 173.79 1p97 s GLU 112 N 3.25 3.70 -0.38 2.79 2.12 0.14 -4.94 118.70 125.38 1p97 s GLU 112 Ca 0.33 -0.27 0.01 0.00 0.36 0.00 0.00 54.97 55.40 1p97 s GLU 112 Cb -0.12 -3.18 0.12 0.00 0.26 0.00 0.00 34.13 31.21 1p97 s GLU 112 CO 0.19 0.50 0.17 0.15 -0.54 0.00 0.00 175.26 175.73 1p97 s LYS 113 N -0.26 0.98 0.00 4.30 1.02 -1.26 -1.11 119.74 123.41 1p97 s LYS 113 Ca 0.09 -1.55 0.00 0.00 0.02 0.00 0.00 55.97 54.53 1p97 s LYS 113 Cb -0.12 -2.11 0.00 0.00 -0.52 0.00 0.00 37.83 35.08 1p97 s LYS 113 CO 0.01 -1.09 0.00 0.27 -0.92 0.00 0.00 175.35 173.62