#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 -3.53 -1.72 4.61 0.00 -1.26 -4.96 120.51 113.65 1p97 n ALA 2 Ca 0.00 1.49 -0.33 0.00 0.00 0.00 0.00 53.44 54.59 1p97 n ALA 2 Cb 0.00 -2.94 -0.01 0.00 0.00 0.00 0.00 19.45 16.51 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 -1.10 3.49 0.00 0.00 1.00 -1.26 -4.99 119.30 116.44 1p97 s MET 3 Ca -0.15 1.32 0.00 0.00 0.00 0.00 0.00 55.69 56.86 1p97 s MET 3 Cb 0.01 -2.05 0.00 0.00 0.00 0.00 0.00 34.83 32.79 1p97 s MET 3 CO 0.76 -0.68 0.87 -3.47 0.00 0.00 0.00 175.02 172.51 1p97 n ASP 4 N -1.55 0.00 -4.08 3.03 -0.08 -1.26 -4.88 116.55 107.74 1p97 n ASP 4 Ca 0.09 0.87 -0.07 0.00 -1.51 0.00 0.00 54.79 54.17 1p97 n ASP 4 Cb 0.52 -0.37 -0.10 0.00 2.34 0.00 0.00 41.12 43.51 1p97 n ASP 4 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1p97 s SER 5 N -2.43 0.43 -0.47 1.67 0.01 -1.26 -5.12 113.70 106.54 1p97 s SER 5 Ca 0.00 -0.99 -0.20 0.00 1.31 0.00 0.00 55.95 56.06 1p97 s SER 5 Cb 0.00 0.23 0.04 0.00 0.21 0.00 0.00 66.02 66.49 1p97 s SER 5 CO 0.00 -0.63 0.65 -0.54 0.41 0.00 0.00 173.24 173.13 1p97 s LYS 6 N -3.93 3.21 -0.14 12.44 -0.14 -1.24 -4.98 119.74 124.96 1p97 s LYS 6 Ca 0.09 -0.57 0.02 0.00 -1.36 0.00 0.00 55.97 54.15 1p97 s LYS 6 Cb 0.08 -4.01 0.01 0.00 -1.68 0.00 0.00 37.83 32.22 1p97 s LYS 6 CO -0.09 -1.11 -0.21 0.99 -0.76 0.00 0.00 175.35 174.17 1p97 s THR 7 N 2.80 2.16 -0.05 2.17 2.01 -1.25 -0.10 115.64 123.38 1p97 s THR 7 Ca 0.20 -0.95 0.04 0.00 0.31 0.00 0.00 61.69 61.29 1p97 s THR 7 Cb -0.16 -1.87 0.00 0.00 0.01 0.00 0.00 72.50 70.48 1p97 s THR 7 CO 0.16 0.55 -0.16 0.72 -0.69 0.00 0.00 174.62 175.20 1p97 s PHE 8 N 0.77 1.60 -0.44 4.92 -0.71 -0.96 -4.96 117.98 118.20 1p97 s PHE 8 Ca -0.08 -0.48 -0.29 0.00 -1.04 0.00 0.00 56.93 55.04 1p97 s PHE 8 Cb -0.16 -1.10 0.01 0.00 -1.21 0.00 0.00 43.02 40.57 1p97 s PHE 8 CO -0.01 -0.18 1.40 -1.17 -1.34 0.00 0.00 175.22 173.93 1p97 s LEU 9 N 0.16 3.56 0.17 -1.99 1.98 -1.26 -2.82 118.68 118.47 1p97 s LEU 9 Ca -0.06 0.73 0.04 0.00 -2.89 0.00 0.00 54.13 51.95 1p97 s LEU 9 Cb -0.12 -3.47 -0.04 0.00 0.66 0.00 0.00 46.19 43.23 1p97 s LEU 9 CO 0.02 -1.47 0.25 -0.55 -1.89 0.00 0.00 176.35 172.71 1p97 s SER 10 N 3.98 6.09 -0.19 3.68 0.15 0.79 -1.07 113.70 127.12 1p97 s SER 10 Ca 0.60 0.06 -0.13 0.00 0.70 0.00 0.00 55.95 57.17 1p97 s SER 10 Cb -0.13 -1.76 0.06 0.00 -1.71 0.00 0.00 66.02 62.48 1p97 s SER 10 CO 0.32 0.04 0.48 -0.60 1.20 0.00 0.00 173.24 174.68 1p97 s ARG 11 N -3.31 0.51 0.46 5.44 3.52 -0.35 0.11 118.95 125.33 1p97 s ARG 11 Ca 0.33 0.80 0.03 0.00 -0.13 0.00 0.00 55.73 56.76 1p97 s ARG 11 Cb -0.10 0.13 -0.02 0.00 -1.56 0.00 0.00 34.95 33.39 1p97 s ARG 11 CO 0.27 -0.12 0.06 -1.01 -0.81 0.00 0.00 175.30 173.69 1p97 s HIS 12 N 0.94 1.87 -0.07 5.12 3.76 0.10 -1.59 115.29 125.42 1p97 s HIS 12 Ca -0.06 -1.08 -0.05 0.00 -0.15 0.00 0.00 55.06 53.72 1p97 s HIS 12 Cb -0.06 -1.42 0.02 0.00 1.11 0.00 0.00 32.58 32.23 1p97 s HIS 12 CO -0.08 0.01 0.17 -1.12 -0.85 0.00 0.00 174.74 172.88 1p97 s SER 13 N -3.75 -0.17 0.08 1.40 0.01 -1.26 0.08 113.70 110.09 1p97 s SER 13 Ca 0.15 0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.76 1p97 s SER 13 Cb 0.03 0.32 0.00 0.00 0.21 0.00 0.00 66.02 66.58 1p97 s SER 13 CO 0.09 -0.08 0.00 0.23 0.41 0.00 0.00 173.24 173.89 1p97 n MET 14 N 3.30 0.00 0.05 12.44 2.81 -1.19 -0.19 117.12 134.34 1p97 n MET 14 Ca -0.16 0.00 0.05 0.00 -1.81 0.00 0.00 57.70 55.78 1p97 n MET 14 Cb 0.57 0.00 0.24 0.00 -0.71 0.00 0.00 33.22 33.32 1p97 n MET 14 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1p97 n ASP 15 N 2.35 0.20 -1.45 7.83 9.92 -1.26 -4.84 116.55 129.31 1p97 n ASP 15 Ca 0.00 0.58 -0.10 0.00 -0.53 0.00 0.00 54.79 54.75 1p97 n ASP 15 Cb 0.00 -0.61 0.02 0.00 -0.64 0.00 0.00 41.12 39.88 1p97 n ASP 15 CO 0.00 0.00 0.00 0.80 0.13 0.00 0.00 177.20 178.13 1p97 n MET 16 N -1.76 -2.12 0.02 -1.24 0.00 0.74 -4.98 117.12 107.78 1p97 n MET 16 Ca 0.00 0.40 -0.05 0.00 -0.00 0.00 0.00 57.70 58.05 1p97 n MET 16 Cb 0.05 -4.20 -0.03 0.00 0.00 0.00 0.00 33.22 29.03 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 -0.60 -0.16 0.00 2.12 2.10 -1.82 -3.40 116.57 114.82 1p97 h LYS 17 Ca -0.23 0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.43 1p97 h LYS 17 Cb 1.16 0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 1p97 h LYS 17 CO 0.25 0.05 0.00 1.19 -2.00 0.00 0.00 179.45 178.94 1p97 n PHE 18 N -4.87 0.00 0.06 0.07 3.72 -1.20 -1.74 117.46 113.49 1p97 n PHE 18 Ca -0.04 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.38 1p97 n PHE 18 Cb 0.14 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.65 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 -3.73 4.37 -2.24 -0.62 0.40 114.28 112.46 1p97 n THR 19 Ca 0.00 -0.19 -0.13 0.00 -2.27 0.00 0.00 64.05 61.45 1p97 n THR 19 Cb 0.00 0.60 -0.10 0.00 -2.10 0.00 0.00 70.33 68.73 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 -2.00 -0.46 -0.02 4.78 5.04 -0.65 -4.75 117.35 119.29 1p97 s TYR 20 Ca -0.01 1.12 0.01 0.00 -2.44 0.00 0.00 57.07 55.75 1p97 s TYR 20 Cb 0.03 0.16 0.01 0.00 0.35 0.00 0.00 41.96 42.51 1p97 s TYR 20 CO 0.17 -0.22 -0.02 0.00 -1.34 0.00 0.00 175.55 174.13 1p97 s ASP 22 N 0.57 5.48 0.53 0.00 2.15 -0.23 -4.67 116.67 120.50 1p97 s ASP 22 Ca -0.06 2.25 0.28 0.00 0.43 0.00 0.00 52.55 55.45 1p97 s ASP 22 Cb -0.09 -2.59 1.51 0.00 -0.30 0.00 0.00 42.92 41.46 1p97 s ASP 22 CO -0.01 -1.39 2.10 0.44 -0.17 0.00 0.00 175.17 176.14 1p97 h ASP 23 N 1.00 0.00 0.11 -0.34 3.32 -2.00 -2.23 116.42 116.28 1p97 h ASP 23 Ca -0.50 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.55 1p97 h ASP 23 Cb 1.27 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.82 1p97 h ASP 23 CO 0.56 0.10 -0.01 0.03 -1.72 0.00 0.00 179.24 178.20 1p97 h ARG 24 N 0.00 0.00 -0.00 3.56 3.08 -1.94 -2.86 114.38 116.22 1p97 h ARG 24 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1p97 h ARG 24 Cb 0.30 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 1p97 h ARG 24 CO 0.01 0.01 0.00 0.97 -1.07 0.00 0.00 179.97 179.89 1p97 h ILE 25 N 0.00 0.74 -0.98 2.04 2.10 -1.72 -0.51 117.51 119.17 1p97 h ILE 25 Ca -0.00 0.00 0.17 0.00 1.08 0.00 0.00 64.86 66.11 1p97 h ILE 25 Cb 0.06 1.00 -0.10 0.00 -1.09 0.00 0.00 36.82 36.69 1p97 h ILE 25 CO 0.00 0.00 0.59 0.71 -1.08 0.00 0.00 178.15 178.37 1p97 h THR 26 N 0.00 0.75 0.00 2.19 1.35 -1.41 0.31 112.91 116.10 1p97 h THR 26 Ca 0.00 -0.27 -0.18 0.00 -0.55 0.00 0.00 66.41 65.41 1p97 h THR 26 Cb 0.00 -0.11 -0.03 0.00 -1.73 0.00 0.00 68.15 66.28 1p97 h THR 26 CO -0.00 0.15 -0.95 -0.33 -0.25 0.00 0.00 175.52 174.14 1p97 h GLU 27 N 0.80 0.00 0.00 4.72 5.08 -1.34 -3.11 114.58 120.73 1p97 h GLU 27 Ca 0.55 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.84 1p97 h GLU 27 Cb 0.78 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 1p97 h GLU 27 CO -0.36 0.67 -0.62 -0.07 -1.00 0.00 0.00 179.01 177.64 1p97 h LEU 28 N 0.00 0.00 -0.14 1.33 3.38 -0.75 -3.41 115.31 115.72 1p97 h LEU 28 Ca -0.06 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1p97 h LEU 28 Cb 1.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.38 1p97 h LEU 28 CO 0.09 0.94 -0.54 -0.38 0.09 0.00 0.00 178.44 178.65 1p97 n ILE 29 N -4.59 0.00 0.00 1.22 2.08 0.92 -4.96 119.36 114.03 1p97 n ILE 29 Ca -0.13 -0.23 0.00 0.00 0.56 0.00 0.00 62.75 62.95 1p97 n ILE 29 Cb 0.36 1.03 0.00 0.00 -0.75 0.00 0.00 39.64 40.28 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 1.25 3.13 1.75 7.39 0.00 -0.74 -0.55 105.19 117.41 1p97 n GLY 30 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.52 -3.97 -4.18 1.61 4.01 -1.26 -4.79 117.16 107.06 1p97 n TYR 31 Ca 0.00 -0.53 -0.29 0.00 -0.16 0.00 0.00 57.90 56.91 1p97 n TYR 31 Cb 0.00 -0.47 -0.09 0.00 -0.31 0.00 0.00 39.34 38.47 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 -2.30 2.85 0.32 -0.72 2.46 -1.26 -3.01 115.29 113.63 1p97 s HIS 32 Ca 0.34 -0.10 0.10 0.00 0.47 0.00 0.00 55.06 55.87 1p97 s HIS 32 Cb -0.01 -1.47 0.94 0.00 -0.13 0.00 0.00 32.58 31.92 1p97 s HIS 32 CO 0.24 0.46 1.65 -1.35 -2.47 0.00 0.00 174.74 173.27 1p97 h PRO 33 N 3.41 0.24 0.00 2.88 0.11 -1.84 0.35 132.00 137.15 1p97 h PRO 33 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1p97 h PRO 33 Cb 1.17 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1p97 h PRO 33 CO 0.56 0.16 0.00 1.05 -0.21 0.00 0.00 178.00 179.56 1p97 h GLU 34 N 0.25 0.00 0.09 1.05 4.11 -1.90 0.57 114.58 118.75 1p97 h GLU 34 Ca 0.67 0.00 -0.26 0.00 0.07 0.00 0.00 59.36 59.84 1p97 h GLU 34 Cb 1.47 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.72 1p97 h GLU 34 CO -0.65 0.00 -1.15 0.93 0.07 0.00 0.00 179.01 178.21 1p97 h GLU 35 N 0.00 0.25 0.11 1.06 4.39 -0.71 -3.34 114.58 116.33 1p97 h GLU 35 Ca 0.00 -0.39 -0.29 0.00 0.34 0.00 0.00 59.36 59.01 1p97 h GLU 35 Cb 0.62 0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.40 1p97 h GLU 35 CO 0.00 1.16 -1.53 -0.07 -1.16 0.00 0.00 179.01 177.41 1p97 h LEU 36 N 0.08 0.35 -8.44 1.33 4.07 -1.05 -3.44 115.31 108.21 1p97 h LEU 36 Ca -0.11 -0.84 -0.30 0.00 0.08 0.00 0.00 57.88 56.71 1p97 h LEU 36 Cb 1.87 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 43.49 1p97 h LEU 36 CO 0.19 1.66 0.95 -1.48 -1.08 0.00 0.00 178.44 178.68 1p97 s LEU 37 N -7.47 3.18 0.00 1.67 0.05 0.16 -1.49 118.68 114.78 1p97 s LEU 37 Ca -0.21 0.36 0.00 0.00 0.05 0.00 0.00 54.13 54.32 1p97 s LEU 37 Cb 0.05 -2.53 0.00 0.00 -2.05 0.00 0.00 46.19 41.66 1p97 s LEU 37 CO 0.75 -3.09 0.00 0.61 -0.55 0.00 0.00 176.35 174.07 1p97 n GLY 38 N 6.33 1.93 3.12 -3.48 0.00 0.16 -4.89 105.19 108.36 1p97 n GLY 38 Ca 0.37 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.31 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 0.73 -0.26 1.61 1.70 -0.55 -5.05 118.95 117.12 1p97 s ARG 39 Ca 0.00 -1.30 -0.29 0.00 -0.47 0.00 0.00 55.73 53.67 1p97 s ARG 39 Cb 0.00 0.16 -0.00 0.00 -0.57 0.00 0.00 34.95 34.54 1p97 s ARG 39 CO 0.00 -0.14 1.28 0.45 -1.08 0.00 0.00 175.30 175.80 1p97 s SER 40 N -2.97 6.76 0.15 -2.89 0.15 -1.26 -3.27 113.70 110.36 1p97 s SER 40 Ca 0.12 1.33 -0.27 0.00 0.70 0.00 0.00 55.95 57.83 1p97 s SER 40 Cb 0.08 -2.54 -0.02 0.00 -1.71 0.00 0.00 66.02 61.83 1p97 s SER 40 CO -0.06 -0.98 1.58 0.00 1.20 0.00 0.00 173.24 174.98 1p97 h ALA 41 N 8.92 -0.46 0.00 5.45 0.00 -1.56 -2.94 119.26 128.67 1p97 h ALA 41 Ca -0.26 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1p97 h ALA 41 Cb 1.10 0.81 0.00 0.00 0.00 0.00 0.00 17.79 19.69 1p97 h ALA 41 CO 1.02 -0.87 0.26 0.66 0.00 0.00 0.00 179.25 180.32 1p97 n TYR 42 N -5.42 0.12 0.79 0.00 4.01 -1.26 0.42 117.16 115.82 1p97 n TYR 42 Ca -0.02 0.06 0.12 0.00 -0.16 0.00 0.00 57.90 57.91 1p97 n TYR 42 Cb 0.35 -0.38 0.51 0.00 -0.31 0.00 0.00 39.34 39.51 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 -1.50 0.07 0.00 -0.72 -0.58 -1.11 -4.06 120.64 112.74 1p97 n GLU 43 Ca -0.00 0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.86 1p97 n GLU 43 Cb 0.26 -1.59 0.00 0.00 -0.57 0.00 0.00 31.44 29.54 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 -1.71 0.00 -1.24 -0.32 -1.74 0.26 -4.99 117.46 107.71 1p97 n PHE 44 Ca 0.06 0.00 -0.42 0.00 -0.56 0.00 0.00 57.45 56.52 1p97 n PHE 44 Cb 0.32 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.27 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 1.98 -0.30 2.97 9.36 0.17 -2.42 117.16 128.92 1p97 n TYR 45 Ca 0.00 -1.81 0.00 0.00 3.32 0.00 0.00 57.90 59.41 1p97 n TYR 45 Cb 0.03 -1.80 0.00 0.00 -0.63 0.00 0.00 39.34 36.94 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 7.98 -0.76 -0.04 2.98 8.25 -1.24 -4.22 115.22 128.17 1p97 n HIS 46 Ca 0.49 0.40 -0.01 0.00 -0.26 0.00 0.00 57.72 58.34 1p97 n HIS 46 Cb 0.41 -1.85 -0.00 0.00 1.12 0.00 0.00 29.99 29.66 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 0.48 0.00 0.00 -1.41 0.00 -1.83 -3.21 119.26 113.29 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 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1p97 h ALA 47 CO 0.00 0.13 -0.87 1.47 0.00 0.00 0.00 179.25 179.98 1p97 n LEU 48 N -4.05 0.74 -0.55 0.00 -0.00 -1.26 -3.95 117.00 107.93 1p97 n LEU 48 Ca -0.02 0.22 0.13 0.00 -0.00 0.00 0.00 56.01 56.34 1p97 n LEU 48 Cb 0.07 -0.11 0.26 0.00 -0.00 0.00 0.00 43.42 43.63 1p97 n LEU 48 CO 0.03 -0.09 0.62 0.47 -0.00 0.00 0.00 177.39 178.42 1p97 n ASP 49 N -2.32 1.90 -0.17 1.45 9.92 -1.26 -4.16 116.55 121.91 1p97 n ASP 49 Ca 0.02 -1.49 -0.04 0.00 -0.53 0.00 0.00 54.79 52.74 1p97 n ASP 49 Cb 0.49 0.14 0.05 0.00 -0.64 0.00 0.00 41.12 41.16 1p97 n ASP 49 CO 0.00 0.00 0.00 0.77 0.13 0.00 0.00 177.20 178.10 1p97 h SER 50 N 2.71 0.40 -0.41 -2.24 4.64 -1.68 -1.77 113.55 115.21 1p97 h SER 50 Ca 0.00 0.02 0.03 0.00 -0.47 0.00 0.00 61.79 61.38 1p97 h SER 50 Cb 0.69 -0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 62.69 1p97 h SER 50 CO 0.00 0.27 0.20 -0.08 -0.87 0.00 0.00 176.83 176.35 1p97 h GLU 51 N 0.53 0.39 -0.98 4.77 4.22 -1.85 0.60 114.58 122.26 1p97 h GLU 51 Ca 0.22 -0.02 0.02 0.00 0.08 0.00 0.00 59.36 59.66 1p97 h GLU 51 Cb 0.12 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.23 1p97 h GLU 51 CO -0.15 0.26 0.64 -0.91 -2.18 0.00 0.00 179.01 176.68 1p97 h ASN 52 N 0.40 1.10 0.96 1.04 4.21 -1.75 -0.52 115.58 121.02 1p97 h ASN 52 Ca 0.18 -0.02 -0.10 0.00 1.21 0.00 0.00 56.30 57.57 1p97 h ASN 52 Cb 0.09 -0.26 -0.01 0.00 -1.12 0.00 0.00 38.32 37.01 1p97 h ASN 52 CO -0.13 0.78 -0.45 -0.03 -1.29 0.00 0.00 177.43 176.31 1p97 h MET 53 N 1.29 0.00 -0.37 0.81 4.05 -0.40 -1.17 114.93 119.15 1p97 h MET 53 Ca 0.37 0.00 -0.08 0.00 -0.28 0.00 0.00 59.70 59.71 1p97 h MET 53 Cb -0.09 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 30.70 1p97 h MET 53 CO -0.10 0.45 -0.09 1.15 0.23 0.00 0.00 176.91 178.56 1p97 h THR 54 N 0.00 1.28 -0.06 -0.77 2.02 0.14 0.24 112.91 115.77 1p97 h THR 54 Ca -0.00 -1.16 -0.10 0.00 0.77 0.00 0.00 66.41 65.91 1p97 h THR 54 Cb 1.06 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 1p97 h THR 54 CO 0.06 0.38 -0.44 0.11 0.37 0.00 0.00 175.52 176.00 1p97 h LYS 55 N 0.50 0.14 -0.23 6.66 6.56 -1.03 -1.34 116.57 127.82 1p97 h LYS 55 Ca 0.09 -0.07 -0.09 0.00 -1.06 0.00 0.00 60.65 59.53 1p97 h LYS 55 Cb 0.60 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.25 1p97 h LYS 55 CO 0.04 0.56 -0.24 0.77 -2.06 0.00 0.00 179.45 178.52 1p97 h SER 56 N 0.11 0.43 -0.69 0.86 0.02 -0.88 0.17 113.55 113.58 1p97 h SER 56 Ca 0.01 -0.14 -0.06 0.00 -0.84 0.00 0.00 61.79 60.76 1p97 h SER 56 Cb 0.83 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.23 1p97 h SER 56 CO 0.06 0.67 0.21 -0.74 -1.14 0.00 0.00 176.83 175.89 1p97 h HIS 57 N 0.39 1.13 0.00 3.45 -0.00 0.20 0.50 115.15 120.82 1p97 h HIS 57 Ca 0.06 -0.11 -0.09 0.00 -0.00 0.00 0.00 60.37 60.22 1p97 h HIS 57 Cb 0.63 -0.33 -0.01 0.00 -0.00 0.00 0.00 27.41 27.70 1p97 h HIS 57 CO 0.02 0.90 -0.43 1.96 -0.00 0.00 0.00 177.93 180.37 1p97 h GLN 58 N 1.04 0.00 0.03 5.26 1.08 -0.68 -3.08 115.11 118.76 1p97 h GLN 58 Ca 0.23 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.33 1p97 h GLN 58 Cb 0.31 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.74 1p97 h GLN 58 CO -0.01 0.43 -0.46 -0.97 -0.95 0.00 0.00 178.83 176.88 1p97 h ASN 59 N 0.00 0.09 -0.53 1.46 -0.00 -0.07 -3.33 115.58 113.21 1p97 h ASN 59 Ca -0.00 -0.89 0.08 0.00 -0.00 0.00 0.00 56.30 55.49 1p97 h ASN 59 Cb 0.97 -0.03 -0.03 0.00 -0.00 0.00 0.00 38.32 39.23 1p97 h ASN 59 CO 0.06 1.20 0.36 0.25 -0.00 0.00 0.00 177.43 179.29 1p97 h LEU 60 N -0.86 0.34 0.39 0.34 5.85 -0.09 -1.05 115.31 120.23 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 1.21 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.14 1p97 h LEU 60 CO -0.02 0.21 -0.40 0.00 -0.34 0.00 0.00 178.44 177.90 1p97 h THR 62 N -0.82 1.37 0.00 0.00 2.02 -1.67 -3.32 112.91 110.50 1p97 h THR 62 Ca -0.03 -1.94 -0.06 0.00 0.77 0.00 0.00 66.41 65.15 1p97 h THR 62 Cb 0.73 2.32 -0.01 0.00 -1.74 0.00 0.00 68.15 69.45 1p97 h THR 62 CO -0.07 0.58 -0.27 0.11 0.37 0.00 0.00 175.52 176.24 1p97 h LYS 63 N 0.10 0.00 0.00 6.66 1.79 -1.16 -3.45 116.57 120.50 1p97 h LYS 63 Ca -0.05 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 1p97 h LYS 63 Cb 1.25 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.90 1p97 h LYS 63 CO 0.12 0.27 0.00 0.41 -1.08 0.00 0.00 179.45 179.17 1p97 n GLY 64 N -0.47 1.84 3.64 3.86 0.00 -0.01 -4.90 105.19 109.16 1p97 n GLY 64 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.07 0.62 0.05 1.61 0.74 -1.25 -1.08 119.66 120.28 1p97 s GLN 65 Ca 0.00 1.03 0.04 0.00 0.05 0.00 0.00 55.36 56.48 1p97 s GLN 65 Cb 0.00 0.15 -0.02 0.00 1.10 0.00 0.00 33.01 34.23 1p97 s GLN 65 CO 0.00 -0.12 -0.11 0.54 -0.55 0.00 0.00 175.29 175.04 1p97 s VAL 66 N 1.41 0.87 0.12 1.34 0.11 0.38 -4.75 120.40 119.87 1p97 s VAL 66 Ca -0.08 -1.06 0.10 0.00 -2.93 0.00 0.00 61.98 58.00 1p97 s VAL 66 Cb -0.05 -0.84 -0.04 0.00 -1.53 0.00 0.00 36.38 33.92 1p97 s VAL 66 CO -0.16 -0.19 -0.21 -0.69 -3.33 0.00 0.00 175.10 170.52 1p97 s VAL 67 N -1.10 2.62 -0.27 2.04 1.01 -1.26 0.65 120.40 124.10 1p97 s VAL 67 Ca -0.03 -1.60 -0.24 0.00 0.00 0.00 0.00 61.98 60.11 1p97 s VAL 67 Cb -0.09 -2.19 0.07 0.00 0.00 0.00 0.00 36.38 34.18 1p97 s VAL 67 CO 0.01 0.10 0.72 -0.55 0.00 0.00 0.00 175.10 175.38 1p97 s SER 68 N -2.11 -0.77 0.00 3.32 0.15 -0.40 -4.97 113.70 108.92 1p97 s SER 68 Ca 0.16 1.45 0.00 0.00 0.70 0.00 0.00 55.95 58.27 1p97 s SER 68 Cb -0.10 1.45 0.00 0.00 -1.71 0.00 0.00 66.02 65.66 1p97 s SER 68 CO 0.09 -0.25 0.00 0.61 1.20 0.00 0.00 173.24 174.89 1p97 n GLY 69 N 2.91 1.92 3.48 9.45 0.00 -1.26 -0.41 105.19 121.28 1p97 n GLY 69 Ca -0.15 -2.02 -0.52 0.00 0.00 0.00 0.00 46.02 43.33 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 1.11 -4.58 1.61 6.02 -1.19 -4.14 117.38 116.22 1p97 n GLN 70 Ca 0.00 0.33 -0.27 0.00 -0.01 0.00 0.00 57.00 57.05 1p97 n GLN 70 Cb 0.00 -2.40 -0.09 0.00 1.02 0.00 0.00 30.24 28.77 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 6.68 1.95 -0.28 1.08 -0.85 0.47 -4.85 117.35 121.56 1p97 s TYR 71 Ca 1.08 -1.04 -0.12 0.00 -0.52 0.00 0.00 57.07 56.47 1p97 s TYR 71 Cb -0.89 -1.39 -0.05 0.00 0.38 0.00 0.00 41.96 40.01 1p97 s TYR 71 CO 0.52 0.02 0.23 1.03 -1.52 0.00 0.00 175.55 175.82 1p97 s ARG 72 N -3.80 3.96 -0.12 -3.49 0.52 -1.26 -1.34 118.95 113.42 1p97 s ARG 72 Ca 0.24 -0.24 -0.04 0.00 -0.52 0.00 0.00 55.73 55.17 1p97 s ARG 72 Cb 0.05 -3.66 -0.03 0.00 0.52 0.00 0.00 34.95 31.82 1p97 s ARG 72 CO 0.12 -0.20 0.02 1.41 0.02 0.00 0.00 175.30 176.67 1p97 s MET 73 N 1.83 3.37 -0.07 3.54 1.75 0.53 -3.63 119.30 126.62 1p97 s MET 73 Ca 0.09 -0.38 -0.30 0.00 -1.25 0.00 0.00 55.69 53.85 1p97 s MET 73 Cb -0.16 -2.95 -0.04 0.00 2.84 0.00 0.00 34.83 34.52 1p97 s MET 73 CO 0.11 0.54 1.40 -1.17 -0.65 0.00 0.00 175.02 175.25 1p97 s LEU 74 N -0.41 4.27 0.36 4.11 2.96 -1.02 -1.75 118.68 127.20 1p97 s LEU 74 Ca 0.08 1.99 -0.18 0.00 -0.22 0.00 0.00 54.13 55.80 1p97 s LEU 74 Cb -0.12 -3.55 -0.10 0.00 0.50 0.00 0.00 46.19 42.92 1p97 s LEU 74 CO 0.02 -0.77 0.82 0.00 -1.32 0.00 0.00 176.35 175.11 1p97 s ALA 75 N 3.08 3.22 0.24 5.97 0.00 0.61 -4.92 121.76 129.95 1p97 s ALA 75 Ca 0.63 0.20 -0.09 0.00 0.00 0.00 0.00 51.96 52.69 1p97 s ALA 75 Cb -0.28 -2.93 0.37 0.00 0.00 0.00 0.00 23.12 20.28 1p97 s ALA 75 CO 0.23 0.25 1.63 -0.22 0.00 0.00 0.00 175.76 177.65 1p97 h LYS 76 N 2.22 0.06 -0.83 0.00 3.64 -1.16 -1.92 116.57 118.59 1p97 h LYS 76 Ca -0.48 -0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 58.64 1p97 h LYS 76 Cb 1.18 -0.01 -0.15 0.00 -0.41 0.00 0.00 32.23 32.83 1p97 h LYS 76 CO 0.64 0.04 0.32 -2.39 -2.27 0.00 0.00 179.45 175.79 1p97 n HIS 77 N -5.38 2.35 -0.91 1.91 1.44 -1.26 -4.93 115.22 108.44 1p97 n HIS 77 Ca 0.12 -1.23 0.00 0.00 -2.01 0.00 0.00 57.72 54.60 1p97 n HIS 77 Cb 0.43 -0.69 0.00 0.00 0.12 0.00 0.00 29.99 29.84 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 -0.28 -3.45 0.00 -1.39 0.00 -0.72 -5.13 105.19 94.22 1p97 n GLY 78 Ca 0.41 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.81 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 0.19 2.23 2.73 -0.02 0.00 -1.24 -4.82 105.19 104.25 1p97 n GLY 79 Ca 0.00 -0.77 -0.23 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.00 0.54 -0.05 1.61 2.02 -0.85 -0.28 117.35 118.34 1p97 s TYR 80 Ca 0.00 -0.19 0.03 0.00 -0.37 0.00 0.00 57.07 56.54 1p97 s TYR 80 Cb 0.00 -0.75 -0.03 0.00 -0.40 0.00 0.00 41.96 40.78 1p97 s TYR 80 CO 0.00 -0.36 -0.12 0.14 -1.57 0.00 0.00 175.55 173.64 1p97 s VAL 81 N 2.01 3.24 -0.22 0.71 -7.23 -0.72 0.29 120.40 118.49 1p97 s VAL 81 Ca 0.04 -0.68 -0.20 0.00 -1.81 0.00 0.00 61.98 59.33 1p97 s VAL 81 Cb -0.13 -2.30 -0.03 0.00 0.56 0.00 0.00 36.38 34.49 1p97 s VAL 81 CO -0.06 0.57 0.59 0.26 -0.31 0.00 0.00 175.10 176.16 1p97 s TRP 82 N -0.77 3.34 0.09 2.82 0.52 -1.25 -0.35 118.94 123.34 1p97 s TRP 82 Ca 0.12 0.84 0.03 0.00 0.02 0.00 0.00 56.10 57.11 1p97 s TRP 82 Cb -0.11 -2.77 -0.04 0.00 -1.15 0.00 0.00 33.47 29.41 1p97 s TRP 82 CO 0.01 -0.20 -0.09 -0.51 0.02 0.00 0.00 176.95 176.19 1p97 s LEU 83 N 2.01 2.41 0.16 2.99 1.02 -0.45 -1.25 118.68 125.57 1p97 s LEU 83 Ca 0.26 -0.82 0.08 0.00 0.02 0.00 0.00 54.13 53.67 1p97 s LEU 83 Cb -0.16 -0.21 -0.04 0.00 0.02 0.00 0.00 46.19 45.80 1p97 s LEU 83 CO 0.10 -0.31 -0.08 -1.61 0.02 0.00 0.00 176.35 174.46 1p97 s GLU 84 N -2.88 2.13 -0.11 1.70 2.02 -0.34 -0.39 118.70 120.83 1p97 s GLU 84 Ca 0.04 -1.18 -0.01 0.00 0.02 0.00 0.00 54.97 53.85 1p97 s GLU 84 Cb -0.02 -2.23 0.03 0.00 0.10 0.00 0.00 34.13 32.01 1p97 s GLU 84 CO -0.01 0.46 -0.05 0.99 0.02 0.00 0.00 175.26 176.66 1p97 s THR 85 N -1.58 0.85 -0.39 3.63 2.01 0.46 -0.54 115.64 120.07 1p97 s THR 85 Ca 0.24 -0.22 -0.19 0.00 0.31 0.00 0.00 61.69 61.83 1p97 s THR 85 Cb -0.09 -0.93 0.01 0.00 0.01 0.00 0.00 72.50 71.49 1p97 s THR 85 CO 0.15 0.30 0.58 -1.58 -0.69 0.00 0.00 174.62 173.38 1p97 s GLN 86 N 1.78 3.48 0.24 4.92 2.00 0.49 -1.27 119.66 131.30 1p97 s GLN 86 Ca 0.04 -0.23 0.09 0.00 -2.00 0.00 0.00 55.36 53.26 1p97 s GLN 86 Cb -0.13 -3.87 -0.04 0.00 0.80 0.00 0.00 33.01 29.77 1p97 s GLN 86 CO -0.07 -0.80 0.02 0.20 -0.50 0.00 0.00 175.29 174.14 1p97 s GLY 87 N 1.85 1.64 -0.15 2.59 0.00 0.21 -0.28 107.32 113.18 1p97 s GLY 87 Ca 0.21 -1.54 -0.17 0.00 0.00 0.00 0.00 44.72 43.22 1p97 s GLY 87 CO 0.16 -1.59 0.46 -1.59 0.00 0.00 0.00 173.10 170.54 1p97 s THR 88 N -2.12 0.01 -0.35 0.90 2.01 -0.44 -0.47 115.64 115.18 1p97 s THR 88 Ca 0.30 -0.06 -0.12 0.00 0.31 0.00 0.00 61.69 62.12 1p97 s THR 88 Cb -0.07 -0.67 -0.01 0.00 0.01 0.00 0.00 72.50 71.76 1p97 s THR 88 CO 0.20 -0.03 0.23 -0.69 -0.69 0.00 0.00 174.62 173.64 1p97 s VAL 89 N -0.04 5.11 -0.41 3.82 1.01 -0.24 0.05 120.40 129.70 1p97 s VAL 89 Ca -0.02 -0.36 -0.24 0.00 0.00 0.00 0.00 61.98 61.36 1p97 s VAL 89 Cb -0.03 -3.66 0.02 0.00 0.00 0.00 0.00 36.38 32.70 1p97 s VAL 89 CO 0.02 -0.05 0.82 -0.51 0.00 0.00 0.00 175.10 175.38 1p97 s ILE 90 N 1.69 4.65 0.41 2.22 2.07 0.50 -4.86 121.20 127.86 1p97 s ILE 90 Ca 0.05 0.72 -0.10 0.00 -1.41 0.00 0.00 60.65 59.91 1p97 s ILE 90 Cb -0.18 -4.30 -0.06 0.00 0.13 0.00 0.00 42.46 38.05 1p97 s ILE 90 CO 0.09 -0.61 0.76 -0.31 -1.91 0.00 0.00 174.94 172.96 1p97 s TYR 91 N 3.31 3.48 0.21 3.50 1.51 -1.26 -1.32 117.35 126.78 1p97 s TYR 91 Ca 0.32 1.02 -0.30 0.00 -1.01 0.00 0.00 57.07 57.10 1p97 s TYR 91 Cb -0.12 -2.43 -0.09 0.00 -0.11 0.00 0.00 41.96 39.21 1p97 s TYR 91 CO 0.21 -0.11 1.38 1.21 -1.11 0.00 0.00 175.55 177.13 1p97 s ASN 92 N -3.21 6.77 0.47 2.29 2.47 -0.78 -4.77 114.94 118.19 1p97 s ASN 92 Ca 0.51 2.52 0.26 0.00 0.42 0.00 0.00 52.86 56.57 1p97 s ASN 92 Cb -0.10 -2.61 0.92 0.00 -1.45 0.00 0.00 41.25 38.00 1p97 s ASN 92 CO 0.32 -0.62 1.82 1.55 -3.72 0.00 0.00 177.10 176.44 1p97 h PRO 93 N 5.40 0.00 0.00 0.43 0.13 -1.96 0.92 132.00 136.93 1p97 h PRO 93 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1p97 h PRO 93 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1p97 h PRO 93 CO 0.79 0.14 -0.88 0.54 -0.23 0.00 0.00 178.00 178.36 1p97 n ARG 94 N -3.24 0.29 0.00 0.86 5.12 -1.26 -4.60 116.66 113.83 1p97 n ARG 94 Ca 0.01 0.03 0.00 0.00 -1.93 0.00 0.00 57.85 55.96 1p97 n ARG 94 Cb 0.43 -1.63 0.00 0.00 -1.16 0.00 0.00 32.46 30.10 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 -2.02 0.00 -1.16 0.55 2.85 -1.19 -5.02 115.26 109.26 1p97 n ASN 95 Ca 0.02 0.00 -0.13 0.00 -0.11 0.00 0.00 54.58 54.37 1p97 n ASN 95 Cb 0.44 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 41.40 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 -0.06 -0.77 -4.85 1.20 7.99 0.32 -4.89 117.00 115.94 1p97 n LEU 96 Ca 0.00 0.32 -0.30 0.00 -0.01 0.00 0.00 56.01 56.01 1p97 n LEU 96 Cb 0.00 -2.28 0.05 0.00 -0.11 0.00 0.00 43.42 41.08 1p97 n LEU 96 CO 0.00 -0.83 0.73 0.00 -1.51 0.00 0.00 177.39 175.77 1p97 s GLN 97 N -2.99 2.88 -0.71 3.23 1.03 -1.26 -4.58 119.66 117.26 1p97 s GLN 97 Ca 0.00 0.67 -0.25 0.00 0.04 0.00 0.00 55.36 55.82 1p97 s GLN 97 Cb 0.00 -2.01 -0.13 0.00 0.03 0.00 0.00 33.01 30.91 1p97 s GLN 97 CO 0.00 -1.06 2.41 -0.35 -2.54 0.00 0.00 175.29 173.75 1p97 n PRO 98 N -3.06 0.68 -0.03 9.60 -0.04 -1.26 -1.87 135.00 139.01 1p97 n PRO 98 Ca 0.07 -0.51 -0.14 0.00 -0.04 0.00 0.00 63.50 62.88 1p97 n PRO 98 Cb 0.55 -3.44 -0.11 0.00 -0.04 0.00 0.00 33.50 30.47 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 14.93 0.06 -3.09 0.54 5.75 -1.50 -3.15 115.11 128.66 1p97 h GLN 99 Ca -0.08 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.33 1p97 h GLN 99 Cb 1.10 0.01 -0.13 0.00 1.07 0.00 0.00 27.48 29.54 1p97 h GLN 99 CO 1.09 0.75 0.11 0.00 -2.65 0.00 0.00 178.83 178.13 1p97 s ILE 101 N -3.62 3.74 -0.44 0.00 1.09 0.11 -0.37 121.20 121.70 1p97 s ILE 101 Ca 0.01 -0.41 -0.12 0.00 -1.10 0.00 0.00 60.65 59.03 1p97 s ILE 101 Cb -0.00 -2.64 0.08 0.00 -1.06 0.00 0.00 42.46 38.83 1p97 s ILE 101 CO -0.11 0.48 0.32 -0.04 -0.10 0.00 0.00 174.94 175.49 1p97 s MET 102 N 0.59 2.77 -0.31 2.79 -1.94 0.11 -0.72 119.30 122.59 1p97 s MET 102 Ca -0.03 -1.42 -0.10 0.00 -1.71 0.00 0.00 55.69 52.43 1p97 s MET 102 Cb -0.14 -3.94 -0.02 0.00 2.01 0.00 0.00 34.83 32.74 1p97 s MET 102 CO 0.03 -0.99 0.17 0.00 -0.01 0.00 0.00 175.02 174.22 1p97 s VAL 104 N 1.66 5.08 -0.06 0.00 1.01 0.62 -0.15 120.40 128.55 1p97 s VAL 104 Ca 0.05 0.04 0.03 0.00 0.00 0.00 0.00 61.98 62.10 1p97 s VAL 104 Cb -0.17 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 1p97 s VAL 104 CO 0.08 -0.25 -0.12 0.20 0.00 0.00 0.00 175.10 175.00 1p97 s ASN 105 N 1.78 4.19 -0.27 3.32 0.01 -1.13 -0.38 114.94 122.47 1p97 s ASN 105 Ca 0.15 -0.15 0.02 0.00 -0.71 0.00 0.00 52.86 52.17 1p97 s ASN 105 Cb -0.16 -0.96 0.07 0.00 0.41 0.00 0.00 41.25 40.61 1p97 s ASN 105 CO 0.13 0.34 -0.05 -0.31 -1.51 0.00 0.00 177.10 175.70 1p97 s TYR 106 N -0.72 3.09 -0.38 2.20 1.51 0.30 -2.27 117.35 121.08 1p97 s TYR 106 Ca 0.11 -2.30 -0.29 0.00 -1.01 0.00 0.00 57.07 53.58 1p97 s TYR 106 Cb -0.11 -2.04 0.02 0.00 -0.11 0.00 0.00 41.96 39.72 1p97 s TYR 106 CO 0.01 -0.87 1.15 0.08 -1.11 0.00 0.00 175.55 174.82 1p97 s VAL 107 N 1.15 4.30 -0.03 0.71 1.01 0.86 -1.19 120.40 127.21 1p97 s VAL 107 Ca -0.03 1.43 -0.04 0.00 0.00 0.00 0.00 61.98 63.34 1p97 s VAL 107 Cb -0.19 -4.44 -0.01 0.00 0.00 0.00 0.00 36.38 31.74 1p97 s VAL 107 CO -0.07 -0.70 -0.08 0.18 0.00 0.00 0.00 175.10 174.44 1p97 n LEU 108 N 7.47 0.47 -4.88 3.92 4.77 -0.38 -3.68 117.00 124.69 1p97 n LEU 108 Ca 0.13 0.08 -0.30 0.00 -0.03 0.00 0.00 56.01 55.88 1p97 n LEU 108 Cb 0.48 -0.48 0.03 0.00 -2.33 0.00 0.00 43.42 41.11 1p97 n LEU 108 CO 0.65 -0.46 0.71 -0.44 -1.33 0.00 0.00 177.39 176.52 1p97 s SER 109 N -4.63 5.78 0.91 -1.43 0.01 -1.18 -5.01 113.70 108.15 1p97 s SER 109 Ca -0.06 1.19 -0.09 0.00 1.31 0.00 0.00 55.95 58.29 1p97 s SER 109 Cb 0.01 -2.12 0.15 0.00 0.21 0.00 0.00 66.02 64.27 1p97 s SER 109 CO 0.09 -1.11 0.94 -1.84 0.41 0.00 0.00 173.24 171.73 1p97 n GLU 110 N -2.84 -0.70 -1.94 12.44 0.28 -1.26 -4.04 120.64 122.57 1p97 n GLU 110 Ca 0.06 -1.69 -0.43 0.00 -0.16 0.00 0.00 57.16 54.94 1p97 n GLU 110 Cb 0.56 -0.89 -0.03 0.00 1.43 0.00 0.00 31.44 32.51 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 -2.95 3.44 -0.02 3.84 1.01 -1.26 -4.33 121.20 120.93 1p97 s ILE 111 Ca 0.55 0.48 -0.25 0.00 0.00 0.00 0.00 60.65 61.44 1p97 s ILE 111 Cb -0.02 -3.49 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 1p97 s ILE 111 CO 0.38 -0.25 0.75 -0.70 0.00 0.00 0.00 174.94 175.12 1p97 s GLU 112 N 5.23 4.46 -0.10 2.79 2.12 0.14 -4.91 118.70 128.44 1p97 s GLU 112 Ca 0.81 0.99 0.03 0.00 0.36 0.00 0.00 54.97 57.16 1p97 s GLU 112 Cb -0.27 -3.42 0.00 0.00 0.26 0.00 0.00 34.13 30.70 1p97 s GLU 112 CO 0.33 0.13 -0.21 0.15 -0.54 0.00 0.00 175.26 175.12 1p97 s LYS 113 N 0.53 2.76 0.00 4.30 1.02 -1.26 -2.02 119.74 125.07 1p97 s LYS 113 Ca 0.39 -0.78 0.00 0.00 0.02 0.00 0.00 55.97 55.61 1p97 s LYS 113 Cb -0.19 -2.14 0.00 0.00 -0.52 0.00 0.00 37.83 34.98 1p97 s LYS 113 CO 0.21 0.11 0.00 0.09 -0.92 0.00 0.00 175.35 174.84