#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 -3.24 -2.19 4.61 0.00 -1.26 -4.70 120.51 113.73 1p97 n ALA 2 Ca 0.00 0.80 -0.01 0.00 0.00 0.00 0.00 53.44 54.23 1p97 n ALA 2 Cb 0.00 -2.29 -0.01 0.00 0.00 0.00 0.00 19.45 17.15 1p97 n ALA 2 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1p97 n MET 3 N 0.25 -2.29 -2.39 0.00 2.00 -1.26 -5.04 117.12 108.39 1p97 n MET 3 Ca 0.05 1.99 -0.27 0.00 0.00 0.00 0.00 57.70 59.48 1p97 n MET 3 Cb 0.23 -3.51 0.03 0.00 0.00 0.00 0.00 33.22 29.96 1p97 n MET 3 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1p97 s ASP 4 N -0.76 5.69 0.00 7.83 2.15 -1.26 -4.65 116.67 125.67 1p97 s ASP 4 Ca -0.06 0.78 0.00 0.00 0.43 0.00 0.00 52.55 53.69 1p97 s ASP 4 Cb 0.00 -1.80 0.00 0.00 -0.30 0.00 0.00 42.92 40.82 1p97 s ASP 4 CO 0.46 -1.01 0.00 -0.24 -0.17 0.00 0.00 175.17 174.22 1p97 n SER 5 N -2.56 0.00 -2.68 -0.34 2.88 -1.24 -4.82 113.62 104.86 1p97 n SER 5 Ca 0.04 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.56 1p97 n SER 5 Cb 0.57 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.01 1p97 n SER 5 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1p97 n LYS 6 N 0.00 -3.94 -3.84 -1.46 5.02 -1.26 -2.74 118.16 109.93 1p97 n LYS 6 Ca 0.00 3.06 -0.35 0.00 -2.02 0.00 0.00 58.31 59.00 1p97 n LYS 6 Cb 0.00 -5.28 -0.10 0.00 -0.02 0.00 0.00 35.03 29.63 1p97 n LYS 6 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1p97 s THR 7 N -1.27 4.92 -0.11 -0.18 2.01 -1.26 -2.71 115.64 117.04 1p97 s THR 7 Ca -0.11 0.02 0.02 0.00 0.31 0.00 0.00 61.69 61.93 1p97 s THR 7 Cb 0.01 -3.26 0.01 0.00 0.01 0.00 0.00 72.50 69.28 1p97 s THR 7 CO 0.79 0.40 -0.15 0.72 -0.69 0.00 0.00 174.62 175.69 1p97 s PHE 8 N 0.81 1.95 0.34 4.92 -0.12 -0.96 -4.98 117.98 119.94 1p97 s PHE 8 Ca 0.05 -0.92 -0.27 0.00 -0.05 0.00 0.00 56.93 55.75 1p97 s PHE 8 Cb -0.13 -1.41 -0.09 0.00 -0.63 0.00 0.00 43.02 40.75 1p97 s PHE 8 CO 0.02 -0.47 1.08 -1.17 -0.05 0.00 0.00 175.22 174.63 1p97 s LEU 9 N 0.99 4.35 0.06 -1.99 1.98 -1.26 -2.54 118.68 120.27 1p97 s LEU 9 Ca -0.07 2.18 -0.01 0.00 -2.89 0.00 0.00 54.13 53.34 1p97 s LEU 9 Cb -0.15 -3.90 -0.04 0.00 0.66 0.00 0.00 46.19 42.76 1p97 s LEU 9 CO -0.02 -0.34 -0.01 -0.94 -1.89 0.00 0.00 176.35 173.16 1p97 s SER 10 N -1.19 0.45 -0.01 3.68 1.04 -0.24 -1.39 113.70 116.03 1p97 s SER 10 Ca 0.51 -1.01 0.03 0.00 0.48 0.00 0.00 55.95 55.96 1p97 s SER 10 Cb -0.28 0.22 -0.00 0.00 0.10 0.00 0.00 66.02 66.06 1p97 s SER 10 CO 0.35 -0.63 -0.08 -0.13 0.98 0.00 0.00 173.24 173.73 1p97 s ARG 11 N -3.94 0.74 0.45 4.02 1.81 0.28 -1.96 118.95 120.36 1p97 s ARG 11 Ca 0.09 -0.30 0.03 0.00 -1.72 0.00 0.00 55.73 53.84 1p97 s ARG 11 Cb 0.08 -0.71 -0.03 0.00 -0.45 0.00 0.00 34.95 33.83 1p97 s ARG 11 CO -0.08 0.16 0.03 -1.01 -0.68 0.00 0.00 175.30 173.72 1p97 s HIS 12 N -0.10 2.00 -0.07 -0.53 3.76 -0.05 -0.10 115.29 120.20 1p97 s HIS 12 Ca 0.02 -0.96 -0.04 0.00 -0.15 0.00 0.00 55.06 53.93 1p97 s HIS 12 Cb -0.04 -1.54 0.03 0.00 1.11 0.00 0.00 32.58 32.14 1p97 s HIS 12 CO -0.00 0.16 0.17 0.45 -0.85 0.00 0.00 174.74 174.67 1p97 s SER 13 N -3.76 -0.16 0.00 1.40 0.15 -1.26 0.20 113.70 110.27 1p97 s SER 13 Ca 0.18 0.36 0.00 0.00 0.70 0.00 0.00 55.95 57.19 1p97 s SER 13 Cb 0.04 0.28 0.00 0.00 -1.71 0.00 0.00 66.02 64.63 1p97 s SER 13 CO 0.09 -0.13 0.00 0.23 1.20 0.00 0.00 173.24 174.64 1p97 n MET 14 N 3.85 0.00 0.01 5.44 2.81 -1.26 -0.10 117.12 127.87 1p97 n MET 14 Ca -0.22 0.00 0.07 0.00 -1.81 0.00 0.00 57.70 55.74 1p97 n MET 14 Cb 0.54 0.00 0.31 0.00 -0.71 0.00 0.00 33.22 33.36 1p97 n MET 14 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1p97 n ASP 15 N 0.90 0.05 -3.54 7.83 2.03 -1.26 -4.89 116.55 117.66 1p97 n ASP 15 Ca 0.00 0.51 -0.20 0.00 0.52 0.00 0.00 54.79 55.62 1p97 n ASP 15 Cb 0.00 -0.52 0.06 0.00 -0.72 0.00 0.00 41.12 39.93 1p97 n ASP 15 CO 0.00 0.00 0.00 1.15 -1.92 0.00 0.00 177.20 176.43 1p97 n MET 16 N -1.56 -4.43 0.19 -0.67 0.00 0.86 -4.96 117.12 106.55 1p97 n MET 16 Ca 0.03 0.71 -0.08 0.00 0.00 0.00 0.00 57.70 58.35 1p97 n MET 16 Cb 0.17 -5.36 -0.04 0.00 0.00 0.00 0.00 33.22 27.99 1p97 n MET 16 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 1p97 h LYS 17 N -1.73 -0.53 0.00 3.17 1.57 -1.79 -3.40 116.57 113.86 1p97 h LYS 17 Ca -0.61 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.20 1p97 h LYS 17 Cb 1.34 0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.77 1p97 h LYS 17 CO 0.51 -0.35 0.00 1.19 -0.57 0.00 0.00 179.45 180.23 1p97 n PHE 18 N -5.10 0.00 0.38 -1.35 3.72 -1.25 -2.60 117.46 111.26 1p97 n PHE 18 Ca -0.07 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.40 1p97 n PHE 18 Cb 0.22 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.66 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 -3.68 4.37 -2.24 0.86 -0.11 114.28 113.48 1p97 n THR 19 Ca 0.00 -0.24 -0.14 0.00 -2.27 0.00 0.00 64.05 61.40 1p97 n THR 19 Cb 0.00 0.64 -0.08 0.00 -2.10 0.00 0.00 70.33 68.78 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 -2.64 -0.47 -0.01 4.78 5.04 -0.80 -4.88 117.35 118.37 1p97 s TYR 20 Ca 0.01 0.99 0.00 0.00 -2.44 0.00 0.00 57.07 55.62 1p97 s TYR 20 Cb 0.10 0.21 0.01 0.00 0.35 0.00 0.00 41.96 42.64 1p97 s TYR 20 CO 0.60 -0.37 0.01 0.00 -1.34 0.00 0.00 175.55 174.44 1p97 s ASP 22 N 0.54 5.54 0.43 0.00 2.15 -0.49 -4.64 116.67 120.20 1p97 s ASP 22 Ca -0.05 1.83 0.11 0.00 0.43 0.00 0.00 52.55 54.88 1p97 s ASP 22 Cb -0.07 -2.53 0.98 0.00 -0.30 0.00 0.00 42.92 40.99 1p97 s ASP 22 CO -0.01 -1.33 2.01 -0.78 -0.17 0.00 0.00 175.17 174.89 1p97 h ASP 23 N 0.16 0.39 -0.04 -0.34 3.58 -1.99 -2.13 116.42 116.05 1p97 h ASP 23 Ca -0.46 0.00 0.01 0.00 0.42 0.00 0.00 57.03 57.00 1p97 h ASP 23 Cb 1.22 -0.08 -0.00 0.00 1.72 0.00 0.00 39.33 42.19 1p97 h ASP 23 CO 0.56 0.26 0.10 -0.09 -2.88 0.00 0.00 179.24 177.19 1p97 h ARG 24 N 0.45 0.00 -0.28 0.28 2.43 -1.94 -2.27 114.38 113.06 1p97 h ARG 24 Ca 0.22 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.45 1p97 h ARG 24 Cb 0.31 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 1p97 h ARG 24 CO -0.06 0.00 0.19 0.97 -1.51 0.00 0.00 179.97 179.56 1p97 h ILE 25 N 0.00 0.93 -0.50 1.20 2.10 -1.69 0.15 117.51 119.70 1p97 h ILE 25 Ca 0.02 -0.04 0.15 0.00 1.08 0.00 0.00 64.86 66.06 1p97 h ILE 25 Cb 0.21 0.79 -0.02 0.00 -1.09 0.00 0.00 36.82 36.71 1p97 h ILE 25 CO -0.00 0.02 0.37 0.71 -1.08 0.00 0.00 178.15 178.18 1p97 h THR 26 N 0.13 0.70 0.09 2.19 1.35 -1.06 0.22 112.91 116.53 1p97 h THR 26 Ca 0.12 0.00 -0.31 0.00 -0.55 0.00 0.00 66.41 65.68 1p97 h THR 26 Cb 0.34 0.74 -0.02 0.00 -1.73 0.00 0.00 68.15 67.48 1p97 h THR 26 CO -0.02 0.00 -1.60 -0.33 -0.25 0.00 0.00 175.52 173.32 1p97 h GLU 27 N 0.00 0.20 0.00 4.72 5.08 -0.93 -3.30 114.58 120.34 1p97 h GLU 27 Ca 0.24 -0.34 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 1p97 h GLU 27 Cb 0.98 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 1p97 h GLU 27 CO -0.00 1.02 -0.54 -0.07 -1.00 0.00 0.00 179.01 178.41 1p97 h LEU 28 N 0.05 0.00 -0.89 1.33 3.38 -0.61 -3.39 115.31 115.18 1p97 h LEU 28 Ca -0.26 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1p97 h LEU 28 Cb 2.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.76 1p97 h LEU 28 CO 0.14 0.84 -0.50 -0.38 0.09 0.00 0.00 178.44 178.63 1p97 n ILE 29 N -4.61 0.00 0.00 1.22 2.08 0.62 -4.86 119.36 113.80 1p97 n ILE 29 Ca -0.10 -0.25 0.00 0.00 0.56 0.00 0.00 62.75 62.96 1p97 n ILE 29 Cb 0.30 1.22 0.00 0.00 -0.75 0.00 0.00 39.64 40.41 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 1.38 2.98 3.10 7.39 0.00 -0.80 0.27 105.19 119.51 1p97 n GLY 30 Ca 0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.60 -3.88 -4.43 1.61 4.01 -1.26 -4.81 117.16 106.80 1p97 n TYR 31 Ca 0.00 -1.00 -0.24 0.00 -0.16 0.00 0.00 57.90 56.50 1p97 n TYR 31 Cb 0.00 -0.80 -0.09 0.00 -0.31 0.00 0.00 39.34 38.14 1p97 n TYR 31 CO 0.00 0.00 0.00 -3.38 -0.46 0.00 0.00 176.86 173.02 1p97 s HIS 32 N -3.23 2.43 0.23 -0.72 -3.43 -1.26 -2.44 115.29 106.86 1p97 s HIS 32 Ca 0.60 -0.37 -0.11 0.00 -0.80 0.00 0.00 55.06 54.37 1p97 s HIS 32 Cb -0.02 -1.20 0.31 0.00 -1.43 0.00 0.00 32.58 30.24 1p97 s HIS 32 CO 0.42 0.63 1.62 -1.35 -2.00 0.00 0.00 174.74 174.06 1p97 h PRO 33 N 2.07 0.02 0.00 -0.38 0.11 -1.82 0.39 132.00 132.39 1p97 h PRO 33 Ca -0.42 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1p97 h PRO 33 Cb 1.25 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1p97 h PRO 33 CO 0.63 0.01 0.00 0.39 -0.21 0.00 0.00 178.00 178.83 1p97 n GLU 34 N -5.44 0.17 0.08 1.05 -0.58 -1.26 -1.95 120.64 112.71 1p97 n GLU 34 Ca 0.10 0.34 -0.19 0.00 -0.42 0.00 0.00 57.16 57.00 1p97 n GLU 34 Cb 0.38 -1.79 -0.10 0.00 -0.57 0.00 0.00 31.44 29.36 1p97 n GLU 34 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1p97 h GLU 35 N 0.00 0.53 0.00 3.49 4.39 -0.63 -3.28 114.58 119.08 1p97 h GLU 35 Ca 0.00 -0.66 -0.01 0.00 0.34 0.00 0.00 59.36 59.03 1p97 h GLU 35 Cb 0.42 0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 29.27 1p97 h GLU 35 CO 0.00 1.27 -0.69 -0.07 -1.16 0.00 0.00 179.01 178.36 1p97 h LEU 36 N 0.26 0.00 -8.33 1.33 4.07 -0.96 -3.45 115.31 108.23 1p97 h LEU 36 Ca -0.14 0.00 -0.16 0.00 0.08 0.00 0.00 57.88 57.66 1p97 h LEU 36 Cb 1.79 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 43.52 1p97 h LEU 36 CO 0.21 0.04 0.44 -0.76 -1.08 0.00 0.00 178.44 177.28 1p97 s LEU 37 N -5.68 3.02 0.00 1.67 1.43 -0.82 -2.24 118.68 116.06 1p97 s LEU 37 Ca 0.02 -0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 1p97 s LEU 37 Cb 0.08 -2.55 0.00 0.00 0.03 0.00 0.00 46.19 43.75 1p97 s LEU 37 CO 0.75 -3.37 0.00 0.61 0.23 0.00 0.00 176.35 174.57 1p97 n GLY 38 N 6.72 1.67 3.32 -3.19 0.00 0.84 -4.99 105.19 109.56 1p97 n GLY 38 Ca 0.43 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.27 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 -0.45 1.27 -0.33 1.61 1.70 -0.95 -5.01 118.95 116.79 1p97 s ARG 39 Ca 0.00 -1.55 -0.29 0.00 -0.47 0.00 0.00 55.73 53.43 1p97 s ARG 39 Cb 0.00 -1.03 -0.01 0.00 -0.57 0.00 0.00 34.95 33.34 1p97 s ARG 39 CO 0.00 0.17 1.60 0.45 -1.08 0.00 0.00 175.30 176.44 1p97 s SER 40 N -3.24 6.19 0.17 -2.89 0.15 -1.26 -3.79 113.70 109.02 1p97 s SER 40 Ca 0.21 1.20 -0.18 0.00 0.70 0.00 0.00 55.95 57.89 1p97 s SER 40 Cb -0.00 -2.53 0.11 0.00 -1.71 0.00 0.00 66.02 61.88 1p97 s SER 40 CO 0.06 -1.49 1.65 0.00 1.20 0.00 0.00 173.24 174.66 1p97 h ALA 41 N 11.50 0.20 0.00 5.45 0.00 -1.71 -2.30 119.26 132.39 1p97 h ALA 41 Ca -0.31 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1p97 h ALA 41 Cb 1.14 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.32 1p97 h ALA 41 CO 1.04 -0.50 0.24 0.66 0.00 0.00 0.00 179.25 180.70 1p97 n TYR 42 N -5.35 0.17 0.55 0.00 4.01 -1.26 0.41 117.16 115.69 1p97 n TYR 42 Ca 0.03 0.09 0.12 0.00 -0.16 0.00 0.00 57.90 57.98 1p97 n TYR 42 Cb 0.26 -0.43 0.45 0.00 -0.31 0.00 0.00 39.34 39.31 1p97 n TYR 42 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1p97 n GLU 43 N -1.58 0.20 0.00 -0.72 -0.58 -0.87 -4.09 120.64 113.01 1p97 n GLU 43 Ca -0.00 0.29 0.00 0.00 -0.42 0.00 0.00 57.16 57.03 1p97 n GLU 43 Cb 0.25 -1.79 0.00 0.00 -0.57 0.00 0.00 31.44 29.33 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 -2.15 0.00 -0.85 -0.32 -1.74 -0.02 -4.99 117.46 107.39 1p97 n PHE 44 Ca 0.04 0.00 -0.43 0.00 -0.56 0.00 0.00 57.45 56.50 1p97 n PHE 44 Cb 0.32 0.02 -0.08 0.00 1.52 0.00 0.00 39.48 41.26 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 1.04 -0.65 2.97 9.36 0.17 -2.79 117.16 127.26 1p97 n TYR 45 Ca 0.00 -1.24 0.00 0.00 3.32 0.00 0.00 57.90 59.98 1p97 n TYR 45 Cb 0.10 -1.29 0.00 0.00 -0.63 0.00 0.00 39.34 37.53 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 8.00 -1.56 -0.04 2.98 8.25 -1.24 -4.01 115.22 127.59 1p97 n HIS 46 Ca 0.48 0.83 -0.01 0.00 -0.26 0.00 0.00 57.72 58.75 1p97 n HIS 46 Cb 0.40 -2.24 -0.00 0.00 1.12 0.00 0.00 29.99 29.26 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 1.02 0.00 0.00 -1.41 0.00 -1.83 -3.02 119.26 114.02 1p97 h ALA 47 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1p97 h ALA 47 Cb 0.00 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1p97 h ALA 47 CO 0.00 0.12 -0.64 1.37 0.00 0.00 0.00 179.25 180.10 1p97 h LEU 48 N -0.76 0.00 -2.33 0.00 -0.00 -1.94 -3.33 115.31 106.96 1p97 h LEU 48 Ca 0.00 -0.09 0.00 0.00 -0.00 0.00 0.00 57.88 57.79 1p97 h LEU 48 Cb 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.78 1p97 h LEU 48 CO 0.00 0.04 0.00 0.47 -0.00 0.00 0.00 178.44 178.95 1p97 n ASP 49 N -2.48 3.44 0.07 0.17 8.00 -1.26 -4.42 116.55 120.07 1p97 n ASP 49 Ca 0.02 -1.98 -0.12 0.00 0.71 0.00 0.00 54.79 53.42 1p97 n ASP 49 Cb 0.49 -0.24 -0.05 0.00 -0.02 0.00 0.00 41.12 41.31 1p97 n ASP 49 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 1p97 h SER 50 N 4.41 -0.66 -0.60 -2.24 4.64 -1.64 -2.22 113.55 115.24 1p97 h SER 50 Ca 0.00 0.09 0.11 0.00 -0.47 0.00 0.00 61.79 61.52 1p97 h SER 50 Cb 0.98 0.26 -0.12 0.00 -0.31 0.00 0.00 62.40 63.22 1p97 h SER 50 CO 0.00 -0.30 -0.28 -0.33 -0.87 0.00 0.00 176.83 175.06 1p97 h GLU 51 N -0.37 -0.11 -0.41 4.77 4.39 -1.85 0.21 114.58 121.20 1p97 h GLU 51 Ca 0.05 0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.83 1p97 h GLU 51 Cb 0.44 0.03 -0.07 0.00 -0.10 0.00 0.00 28.75 29.05 1p97 h GLU 51 CO -0.18 -0.07 0.00 -0.97 -1.16 0.00 0.00 179.01 176.63 1p97 h ASN 52 N -0.11 -0.16 1.16 1.42 -0.73 -1.76 -1.16 115.58 114.23 1p97 h ASN 52 Ca 0.26 0.09 -0.10 0.00 1.87 0.00 0.00 56.30 58.42 1p97 h ASN 52 Cb 0.53 0.17 -0.01 0.00 0.27 0.00 0.00 38.32 39.27 1p97 h ASN 52 CO -0.67 -0.04 -0.47 -0.03 -0.37 0.00 0.00 177.43 175.84 1p97 h MET 53 N 0.11 0.00 -0.30 6.67 4.05 -0.70 -2.76 114.93 122.01 1p97 h MET 53 Ca 0.20 0.00 -0.07 0.00 -0.28 0.00 0.00 59.70 59.55 1p97 h MET 53 Cb 0.29 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.07 1p97 h MET 53 CO -0.34 0.47 -0.11 1.15 0.23 0.00 0.00 176.91 178.32 1p97 h THR 54 N 0.00 1.23 -0.67 -0.77 2.02 0.52 -0.69 112.91 114.54 1p97 h THR 54 Ca -0.00 -1.00 0.00 0.00 0.77 0.00 0.00 66.41 66.18 1p97 h THR 54 Cb 1.18 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 68.68 1p97 h THR 54 CO 0.06 0.33 0.43 0.11 0.37 0.00 0.00 175.52 176.82 1p97 h LYS 55 N 0.47 0.90 -0.80 6.66 6.56 -0.99 -2.51 116.57 126.85 1p97 h LYS 55 Ca 0.09 -0.06 -0.03 0.00 -1.06 0.00 0.00 60.65 59.58 1p97 h LYS 55 Cb 0.48 -0.20 -0.04 0.00 -0.57 0.00 0.00 32.23 31.91 1p97 h LYS 55 CO 0.03 0.61 0.37 1.03 -2.06 0.00 0.00 179.45 179.42 1p97 h SER 56 N 0.92 1.05 -0.37 0.86 0.87 -1.04 0.24 113.55 116.09 1p97 h SER 56 Ca 0.25 -0.13 -0.03 0.00 -1.23 0.00 0.00 61.79 60.64 1p97 h SER 56 Cb -0.08 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 61.59 1p97 h SER 56 CO -0.05 0.90 0.14 -0.74 -0.53 0.00 0.00 176.83 176.55 1p97 h HIS 57 N 1.14 0.63 0.00 2.24 -0.00 -1.01 0.50 115.15 118.65 1p97 h HIS 57 Ca 0.27 -0.03 -0.14 0.00 -0.00 0.00 0.00 60.37 60.47 1p97 h HIS 57 Cb 0.14 -0.19 -0.02 0.00 -0.00 0.00 0.00 27.41 27.33 1p97 h HIS 57 CO 0.02 0.52 -0.67 1.96 -0.00 0.00 0.00 177.93 179.76 1p97 h GLN 58 N 0.62 0.00 0.04 5.26 4.20 -0.94 -2.84 115.11 121.45 1p97 h GLN 58 Ca 0.15 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.76 1p97 h GLN 58 Cb 0.18 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.96 1p97 h GLN 58 CO -0.01 0.67 -0.49 -0.97 -0.67 0.00 0.00 178.83 177.36 1p97 h ASN 59 N 0.00 0.14 0.19 1.46 -1.24 0.12 -3.30 115.58 112.94 1p97 h ASN 59 Ca -0.01 -0.91 -0.01 0.00 0.71 0.00 0.00 56.30 56.08 1p97 h ASN 59 Cb 1.37 -0.05 -0.00 0.00 0.73 0.00 0.00 38.32 40.37 1p97 h ASN 59 CO 0.09 1.22 -0.05 0.25 -1.29 0.00 0.00 177.43 177.64 1p97 h LEU 60 N -0.79 0.00 -1.82 0.34 5.85 -0.13 -2.45 115.31 116.31 1p97 h LEU 60 Ca -0.11 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1p97 h LEU 60 Cb 1.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.29 1p97 h LEU 60 CO 0.01 0.05 0.00 0.00 -0.34 0.00 0.00 178.44 178.16 1p97 n THR 62 N -2.91 0.00 0.00 0.00 -1.04 -0.96 -4.80 114.28 104.57 1p97 n THR 62 Ca -0.00 -0.62 0.00 0.00 -2.04 0.00 0.00 64.05 61.39 1p97 n THR 62 Cb 0.20 0.80 0.00 0.00 -1.82 0.00 0.00 70.33 69.51 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 0.31 2.33 0.00 -2.82 4.76 -0.98 -5.02 118.16 116.74 1p97 n LYS 63 Ca -0.06 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.38 1p97 n LYS 63 Cb 0.97 -0.90 0.00 0.00 -1.84 0.00 0.00 35.03 33.27 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 2.26 2.81 3.61 0.72 0.00 -1.10 -4.91 105.19 108.57 1p97 n GLY 64 Ca 0.00 0.00 -0.12 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 -0.08 0.69 0.14 1.61 -0.44 -1.26 -3.48 119.66 116.85 1p97 s GLN 65 Ca 0.00 0.63 -0.16 0.00 -2.50 0.00 0.00 55.36 53.33 1p97 s GLN 65 Cb 0.00 0.34 0.03 0.00 -1.64 0.00 0.00 33.01 31.74 1p97 s GLN 65 CO 0.00 -0.12 0.42 0.54 0.50 0.00 0.00 175.29 176.62 1p97 s VAL 66 N -0.07 0.06 -0.24 1.34 0.11 0.40 -4.76 120.40 117.24 1p97 s VAL 66 Ca -0.00 -0.69 -0.04 0.00 -2.93 0.00 0.00 61.98 58.32 1p97 s VAL 66 Cb -0.04 -1.31 0.09 0.00 -1.53 0.00 0.00 36.38 33.59 1p97 s VAL 66 CO -0.01 -0.28 0.14 0.54 -3.33 0.00 0.00 175.10 172.16 1p97 s VAL 67 N -3.83 -0.12 0.38 2.04 0.11 -1.26 0.11 120.40 117.82 1p97 s VAL 67 Ca 0.05 -0.50 -0.25 0.00 -2.93 0.00 0.00 61.98 58.36 1p97 s VAL 67 Cb 0.01 -0.83 -0.09 0.00 -1.53 0.00 0.00 36.38 33.95 1p97 s VAL 67 CO -0.09 -0.53 1.06 -0.44 -3.33 0.00 0.00 175.10 171.77 1p97 s SER 68 N 2.15 6.83 0.08 3.54 0.01 0.18 -4.90 113.70 121.58 1p97 s SER 68 Ca 0.07 2.09 0.00 0.00 1.31 0.00 0.00 55.95 59.42 1p97 s SER 68 Cb -0.16 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.48 1p97 s SER 68 CO -0.26 -0.44 0.00 0.61 0.41 0.00 0.00 173.24 173.56 1p97 n GLY 69 N 0.50 1.66 3.46 3.44 0.00 -1.26 -0.95 105.19 112.04 1p97 n GLY 69 Ca 0.04 -2.08 -0.48 0.00 0.00 0.00 0.00 46.02 43.50 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 -0.93 0.97 -4.67 1.61 6.02 -1.20 -4.16 117.38 115.02 1p97 n GLN 70 Ca 0.00 0.22 -0.30 0.00 -0.01 0.00 0.00 57.00 56.92 1p97 n GLN 70 Cb 0.00 -2.50 -0.09 0.00 1.02 0.00 0.00 30.24 28.67 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 8.17 2.11 -0.35 1.08 -0.85 0.48 -4.84 117.35 123.14 1p97 s TYR 71 Ca 1.11 -0.88 -0.16 0.00 -0.52 0.00 0.00 57.07 56.62 1p97 s TYR 71 Cb -0.80 -1.62 -0.01 0.00 0.38 0.00 0.00 41.96 39.92 1p97 s TYR 71 CO 0.46 0.25 0.39 1.03 -1.52 0.00 0.00 175.55 176.16 1p97 s ARG 72 N -3.80 3.50 -0.15 -3.49 0.52 -1.26 -1.57 118.95 112.70 1p97 s ARG 72 Ca 0.20 -0.44 -0.11 0.00 -0.52 0.00 0.00 55.73 54.86 1p97 s ARG 72 Cb 0.05 -3.83 -0.05 0.00 0.52 0.00 0.00 34.95 31.65 1p97 s ARG 72 CO 0.10 -0.58 0.21 1.41 0.02 0.00 0.00 175.30 176.47 1p97 s MET 73 N 2.07 4.01 -0.02 3.54 1.75 0.63 -3.73 119.30 127.55 1p97 s MET 73 Ca 0.12 -0.03 -0.30 0.00 -1.25 0.00 0.00 55.69 54.23 1p97 s MET 73 Cb -0.17 -3.35 -0.04 0.00 2.84 0.00 0.00 34.83 34.11 1p97 s MET 73 CO 0.12 0.43 1.29 -1.17 -0.65 0.00 0.00 175.02 175.04 1p97 s LEU 74 N -0.06 4.30 0.59 4.11 2.96 -1.12 -1.53 118.68 127.93 1p97 s LEU 74 Ca 0.14 1.97 -0.07 0.00 -0.22 0.00 0.00 54.13 55.95 1p97 s LEU 74 Cb -0.12 -3.56 -0.00 0.00 0.50 0.00 0.00 46.19 43.00 1p97 s LEU 74 CO 0.03 -0.64 0.92 0.00 -1.32 0.00 0.00 176.35 175.34 1p97 s ALA 75 N 2.19 3.25 0.38 5.97 0.00 0.85 -4.87 121.76 129.53 1p97 s ALA 75 Ca 0.60 -0.57 0.21 0.00 0.00 0.00 0.00 51.96 52.20 1p97 s ALA 75 Cb -0.28 -2.69 1.26 0.00 0.00 0.00 0.00 23.12 21.41 1p97 s ALA 75 CO 0.25 -0.76 1.64 -0.22 0.00 0.00 0.00 175.76 176.67 1p97 h LYS 76 N -0.18 0.17 -0.82 0.00 3.64 -0.51 0.10 116.57 118.97 1p97 h LYS 76 Ca -0.45 -0.01 -0.45 0.00 -1.27 0.00 0.00 60.65 58.46 1p97 h LYS 76 Cb 1.24 -0.04 -0.26 0.00 -0.41 0.00 0.00 32.23 32.76 1p97 h LYS 76 CO 0.61 0.11 0.45 -2.39 -2.27 0.00 0.00 179.45 175.96 1p97 n HIS 77 N -4.96 2.57 -1.29 1.91 1.44 -1.26 -4.85 115.22 108.78 1p97 n HIS 77 Ca 0.35 -1.96 -0.09 0.00 -2.01 0.00 0.00 57.72 54.01 1p97 n HIS 77 Cb 1.20 -0.88 -0.04 0.00 0.12 0.00 0.00 29.99 30.39 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 -1.10 1.04 3.92 -1.39 0.00 0.34 -5.01 105.19 102.99 1p97 n GLY 78 Ca 0.53 -0.63 -0.28 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.89 1.69 -0.03 -0.02 0.00 -1.19 -4.75 107.32 100.12 1p97 s GLY 79 Ca 0.00 -0.97 0.01 0.00 0.00 0.00 0.00 44.72 43.76 1p97 s GLY 79 CO 0.00 -0.41 -0.03 -0.19 0.00 0.00 0.00 173.10 172.47 1p97 s TYR 80 N -3.57 0.54 0.01 1.90 2.02 -1.22 -0.10 117.35 116.92 1p97 s TYR 80 Ca 0.66 -0.11 0.05 0.00 -0.37 0.00 0.00 57.07 57.30 1p97 s TYR 80 Cb -0.08 -0.51 -0.02 0.00 -0.40 0.00 0.00 41.96 40.95 1p97 s TYR 80 CO 0.49 -0.14 -0.16 0.14 -1.57 0.00 0.00 175.55 174.31 1p97 s VAL 81 N 0.77 1.30 -0.18 0.71 -7.23 -0.58 -0.00 120.40 115.19 1p97 s VAL 81 Ca -0.09 -0.83 -0.23 0.00 -1.81 0.00 0.00 61.98 59.02 1p97 s VAL 81 Cb -0.12 -1.11 -0.02 0.00 0.56 0.00 0.00 36.38 35.69 1p97 s VAL 81 CO -0.00 0.27 0.75 0.26 -0.31 0.00 0.00 175.10 176.06 1p97 s TRP 82 N -0.53 3.41 0.04 2.82 0.52 -1.25 -0.27 118.94 123.68 1p97 s TRP 82 Ca 0.06 1.12 0.00 0.00 0.02 0.00 0.00 56.10 57.30 1p97 s TRP 82 Cb -0.07 -2.92 -0.03 0.00 -1.15 0.00 0.00 33.47 29.30 1p97 s TRP 82 CO 0.00 -0.21 -0.04 -0.51 0.02 0.00 0.00 176.95 176.21 1p97 s LEU 83 N 2.02 2.32 -0.04 2.99 1.02 -0.61 -0.49 118.68 125.91 1p97 s LEU 83 Ca 0.34 -0.66 0.03 0.00 0.02 0.00 0.00 54.13 53.86 1p97 s LEU 83 Cb -0.16 0.06 -0.03 0.00 0.02 0.00 0.00 46.19 46.08 1p97 s LEU 83 CO 0.12 -0.37 -0.11 -1.61 0.02 0.00 0.00 176.35 174.40 1p97 s GLU 84 N -2.24 2.55 -0.25 1.70 2.02 -0.51 -0.39 118.70 121.57 1p97 s GLU 84 Ca -0.07 -0.68 -0.00 0.00 0.02 0.00 0.00 54.97 54.24 1p97 s GLU 84 Cb -0.05 -2.45 0.07 0.00 0.10 0.00 0.00 34.13 31.80 1p97 s GLU 84 CO -0.03 0.63 0.01 0.99 0.02 0.00 0.00 175.26 176.88 1p97 s THR 85 N -0.83 1.21 -0.23 3.63 2.01 -0.13 -0.27 115.64 121.03 1p97 s THR 85 Ca 0.13 -1.22 -0.26 0.00 0.31 0.00 0.00 61.69 60.65 1p97 s THR 85 Cb -0.11 -1.67 0.00 0.00 0.01 0.00 0.00 72.50 70.73 1p97 s THR 85 CO 0.03 -0.31 0.91 0.00 -0.69 0.00 0.00 174.62 174.55 1p97 s GLN 86 N 1.51 4.22 0.18 4.92 1.03 -0.79 0.47 119.66 131.20 1p97 s GLN 86 Ca 0.01 1.11 0.06 0.00 0.04 0.00 0.00 55.36 56.57 1p97 s GLN 86 Cb -0.18 -3.64 -0.04 0.00 0.03 0.00 0.00 33.01 29.18 1p97 s GLN 86 CO -0.11 -0.55 0.13 0.20 -2.54 0.00 0.00 175.29 172.41 1p97 s GLY 87 N 1.28 1.67 -0.25 2.60 0.00 0.30 -1.82 107.32 111.09 1p97 s GLY 87 Ca 0.38 -1.26 -0.04 0.00 0.00 0.00 0.00 44.72 43.81 1p97 s GLY 87 CO 0.07 -1.28 0.45 -1.59 0.00 0.00 0.00 173.10 170.75 1p97 s THR 88 N -1.81 -0.72 -0.39 0.90 2.01 -0.39 -0.45 115.64 114.78 1p97 s THR 88 Ca 0.31 0.00 -0.27 0.00 0.31 0.00 0.00 61.69 62.04 1p97 s THR 88 Cb -0.10 -0.83 0.02 0.00 0.01 0.00 0.00 72.50 71.61 1p97 s THR 88 CO 0.23 -0.05 1.02 -0.69 -0.69 0.00 0.00 174.62 174.44 1p97 s VAL 89 N 2.64 4.46 -0.30 3.82 1.01 -1.23 -0.10 120.40 130.70 1p97 s VAL 89 Ca 0.10 1.29 -0.23 0.00 0.00 0.00 0.00 61.98 63.15 1p97 s VAL 89 Cb -0.14 -4.43 -0.00 0.00 0.00 0.00 0.00 36.38 31.80 1p97 s VAL 89 CO -0.16 -0.67 0.75 -0.51 0.00 0.00 0.00 175.10 174.51 1p97 s ILE 90 N 3.80 4.84 0.17 2.22 2.07 -0.44 -4.86 121.20 129.00 1p97 s ILE 90 Ca 0.42 1.16 0.02 0.00 -1.41 0.00 0.00 60.65 60.84 1p97 s ILE 90 Cb -0.11 -4.10 -0.04 0.00 0.13 0.00 0.00 42.46 38.35 1p97 s ILE 90 CO 0.22 -0.19 0.32 -0.31 -1.91 0.00 0.00 174.94 173.06 1p97 s TYR 91 N 2.85 3.48 0.41 3.50 2.02 -1.26 -0.54 117.35 127.82 1p97 s TYR 91 Ca 0.31 0.18 -0.26 0.00 -0.37 0.00 0.00 57.07 56.93 1p97 s TYR 91 Cb -0.14 -1.72 -0.09 0.00 -0.40 0.00 0.00 41.96 39.61 1p97 s TYR 91 CO 0.12 0.47 1.31 1.21 -1.57 0.00 0.00 175.55 177.09 1p97 s ASN 92 N -3.24 6.24 0.21 2.29 2.47 -0.56 -4.75 114.94 117.60 1p97 s ASN 92 Ca 0.36 2.67 0.11 0.00 0.42 0.00 0.00 52.86 56.42 1p97 s ASN 92 Cb -0.11 -2.64 0.02 0.00 -1.45 0.00 0.00 41.25 37.07 1p97 s ASN 92 CO 0.29 -0.90 1.41 1.55 -3.72 0.00 0.00 177.10 175.73 1p97 h PRO 93 N 2.60 0.00 -0.01 0.43 0.13 -1.96 0.68 132.00 133.86 1p97 h PRO 93 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1p97 h PRO 93 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1p97 h PRO 93 CO 0.62 0.75 -0.27 0.54 -0.23 0.00 0.00 178.00 179.42 1p97 n ARG 94 N -3.38 0.93 0.00 0.86 1.74 -1.26 -4.46 116.66 111.08 1p97 n ARG 94 Ca 0.00 -0.58 0.00 0.00 -0.77 0.00 0.00 57.85 56.50 1p97 n ARG 94 Cb 0.80 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.76 1p97 n ARG 94 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1p97 n ASN 95 N -0.53 0.00 -0.90 0.55 4.13 -1.23 -5.02 115.26 112.26 1p97 n ASN 95 Ca 0.12 0.00 -0.10 0.00 1.68 0.00 0.00 54.58 56.28 1p97 n ASN 95 Cb 0.36 0.00 -0.04 0.00 -1.54 0.00 0.00 39.78 38.56 1p97 n ASN 95 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1p97 n LEU 96 N -0.32 -0.43 -4.88 3.41 7.99 0.24 -4.89 117.00 118.12 1p97 n LEU 96 Ca 0.00 0.25 -0.30 0.00 -0.01 0.00 0.00 56.01 55.94 1p97 n LEU 96 Cb 0.00 -2.21 -0.00 0.00 -0.11 0.00 0.00 43.42 41.10 1p97 n LEU 96 CO 0.00 -0.81 0.64 0.00 -1.51 0.00 0.00 177.39 175.70 1p97 s GLN 97 N -2.66 3.64 -0.62 3.23 1.03 -1.26 -4.61 119.66 118.40 1p97 s GLN 97 Ca 0.00 0.63 -0.26 0.00 0.04 0.00 0.00 55.36 55.77 1p97 s GLN 97 Cb 0.00 -2.17 -0.09 0.00 0.03 0.00 0.00 33.01 30.77 1p97 s GLN 97 CO 0.00 -0.42 2.39 -1.25 -2.54 0.00 0.00 175.29 173.46 1p97 s PRO 98 N -4.87 1.92 -0.00 9.60 0.04 -1.26 -1.50 135.00 138.92 1p97 s PRO 98 Ca 0.54 0.98 -0.25 0.00 0.04 0.00 0.00 61.00 62.31 1p97 s PRO 98 Cb -0.11 -4.67 -0.18 0.00 0.04 0.00 0.00 34.50 29.58 1p97 s PRO 98 CO 0.48 -3.74 1.28 0.37 0.04 0.00 0.00 177.00 175.43 1p97 h GLN 99 N 16.55 -0.12 -2.83 4.56 5.75 -1.11 -3.36 115.11 134.55 1p97 h GLN 99 Ca -0.14 0.01 0.06 0.00 -0.15 0.00 0.00 58.65 58.43 1p97 h GLN 99 Cb 1.15 0.03 -0.02 0.00 1.07 0.00 0.00 27.48 29.71 1p97 h GLN 99 CO 1.10 0.27 0.35 0.00 -2.65 0.00 0.00 178.83 177.90 1p97 s ILE 101 N -2.72 2.03 -0.39 0.00 -1.09 0.13 -1.33 121.20 117.84 1p97 s ILE 101 Ca 0.15 -0.98 -0.12 0.00 -2.23 0.00 0.00 60.65 57.48 1p97 s ILE 101 Cb -0.04 -1.78 0.03 0.00 -1.58 0.00 0.00 42.46 39.09 1p97 s ILE 101 CO 0.08 0.55 0.23 -0.04 -1.23 0.00 0.00 174.94 174.53 1p97 s MET 102 N 0.62 2.85 -0.24 2.79 -1.94 0.85 -0.87 119.30 123.35 1p97 s MET 102 Ca -0.12 -1.08 -0.01 0.00 -1.71 0.00 0.00 55.69 52.76 1p97 s MET 102 Cb -0.17 -3.80 0.03 0.00 2.01 0.00 0.00 34.83 32.90 1p97 s MET 102 CO 0.03 -0.73 -0.08 0.00 -0.01 0.00 0.00 175.02 174.23 1p97 s VAL 104 N 1.31 5.14 -0.15 0.00 1.01 -0.76 -1.07 120.40 125.88 1p97 s VAL 104 Ca 0.00 0.21 -0.06 0.00 0.00 0.00 0.00 61.98 62.13 1p97 s VAL 104 Cb -0.16 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 1p97 s VAL 104 CO -0.05 -0.06 0.06 0.20 0.00 0.00 0.00 175.10 175.25 1p97 s ASN 105 N 1.72 5.67 -0.27 3.32 0.01 -1.05 -1.88 114.94 122.45 1p97 s ASN 105 Ca 0.14 0.16 0.03 0.00 -0.71 0.00 0.00 52.86 52.47 1p97 s ASN 105 Cb -0.16 -1.87 0.07 0.00 0.41 0.00 0.00 41.25 39.69 1p97 s ASN 105 CO 0.12 0.26 -0.07 -0.31 -1.51 0.00 0.00 177.10 175.59 1p97 s TYR 106 N -0.15 3.20 0.17 2.20 2.02 0.63 -2.26 117.35 123.16 1p97 s TYR 106 Ca 0.07 -2.36 -0.30 0.00 -0.37 0.00 0.00 57.07 54.11 1p97 s TYR 106 Cb -0.12 -2.06 -0.08 0.00 -0.40 0.00 0.00 41.96 39.30 1p97 s TYR 106 CO 0.01 -0.88 1.20 0.08 -1.57 0.00 0.00 175.55 174.40 1p97 s VAL 107 N 1.12 3.61 0.02 0.71 1.01 -1.10 -1.43 120.40 124.34 1p97 s VAL 107 Ca -0.04 1.32 0.00 0.00 0.00 0.00 0.00 61.98 63.26 1p97 s VAL 107 Cb -0.20 -3.85 0.00 0.00 0.00 0.00 0.00 36.38 32.34 1p97 s VAL 107 CO -0.06 0.20 0.00 0.18 0.00 0.00 0.00 175.10 175.42 1p97 n LEU 108 N 2.71 0.14 -4.97 3.92 4.77 0.36 -3.63 117.00 120.30 1p97 n LEU 108 Ca 0.05 0.02 -0.21 0.00 -0.03 0.00 0.00 56.01 55.84 1p97 n LEU 108 Cb 0.45 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.52 1p97 n LEU 108 CO 0.56 -0.54 0.28 -0.44 -1.33 0.00 0.00 177.39 175.92 1p97 s SER 109 N -5.04 5.61 1.00 -1.43 0.01 -1.18 -4.78 113.70 107.89 1p97 s SER 109 Ca 0.00 0.05 -0.08 0.00 1.31 0.00 0.00 55.95 57.23 1p97 s SER 109 Cb 0.00 -1.15 0.11 0.00 0.21 0.00 0.00 66.02 65.18 1p97 s SER 109 CO 0.00 -0.86 0.63 -1.84 0.41 0.00 0.00 173.24 171.59 1p97 n GLU 110 N -2.12 -0.63 -1.94 12.44 0.28 -1.26 -4.02 120.64 123.40 1p97 n GLU 110 Ca 0.04 -0.97 -0.43 0.00 -0.16 0.00 0.00 57.16 55.64 1p97 n GLU 110 Cb 0.59 -0.65 -0.03 0.00 1.43 0.00 0.00 31.44 32.78 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 -2.38 3.44 -0.28 3.84 1.01 -1.26 -4.37 121.20 121.20 1p97 s ILE 111 Ca 0.36 0.50 -0.00 0.00 0.00 0.00 0.00 60.65 61.51 1p97 s ILE 111 Cb -0.01 -3.45 0.05 0.00 0.01 0.00 0.00 42.46 39.06 1p97 s ILE 111 CO 0.25 -0.19 -0.04 -0.70 0.00 0.00 0.00 174.94 174.26 1p97 s GLU 112 N 4.97 2.40 -0.78 2.79 -6.30 1.00 -4.97 118.70 117.81 1p97 s GLU 112 Ca 0.80 -1.27 -0.09 0.00 -2.50 0.00 0.00 54.97 51.91 1p97 s GLU 112 Cb -0.29 -3.07 0.20 0.00 0.00 0.00 0.00 34.13 30.97 1p97 s GLU 112 CO 0.33 -0.59 0.67 0.15 0.02 0.00 0.00 175.26 175.84 1p97 s LYS 113 N 1.21 3.24 0.00 4.30 1.02 -1.26 -3.39 119.74 124.86 1p97 s LYS 113 Ca -0.06 -2.60 0.00 0.00 0.02 0.00 0.00 55.97 53.33 1p97 s LYS 113 Cb -0.20 -4.15 0.00 0.00 -0.52 0.00 0.00 37.83 32.97 1p97 s LYS 113 CO -0.03 -1.24 0.05 0.09 -0.92 0.00 0.00 175.35 173.30