#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p97 s ALA 2 N 0.00 3.15 -1.45 4.61 0.00 -1.26 -4.94 121.76 121.87 1p97 s ALA 2 Ca 0.00 0.49 -0.10 0.00 0.00 0.00 0.00 51.96 52.35 1p97 s ALA 2 Cb 0.00 -3.18 0.05 0.00 0.00 0.00 0.00 23.12 19.99 1p97 s ALA 2 CO 0.00 0.15 2.38 -1.33 0.00 0.00 0.00 175.76 176.96 1p97 n MET 3 N 0.17 3.54 0.00 0.00 0.00 -1.26 -4.20 117.12 115.37 1p97 n MET 3 Ca 0.04 -2.83 0.00 0.00 0.00 0.00 0.00 57.70 54.90 1p97 n MET 3 Cb 0.51 -2.97 0.00 0.00 0.00 0.00 0.00 33.22 30.77 1p97 n MET 3 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 1p97 n ASP 4 N 4.20 0.00 0.00 7.83 -0.08 -1.26 -5.04 116.55 122.19 1p97 n ASP 4 Ca 0.58 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.86 1p97 n ASP 4 Cb 0.32 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.78 1p97 n ASP 4 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1p97 n SER 5 N -0.27 -5.06 -3.19 1.67 7.64 -1.26 -4.08 113.62 109.07 1p97 n SER 5 Ca 0.00 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.66 1p97 n SER 5 Cb 0.00 -2.60 0.02 0.00 -1.01 0.00 0.00 64.21 60.62 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 -0.20 -2.05 -4.34 1.43 4.76 -1.26 -1.06 118.16 115.44 1p97 n LYS 6 Ca 0.00 1.71 -0.34 0.00 -2.87 0.00 0.00 58.31 56.82 1p97 n LYS 6 Cb 0.35 -3.47 -0.14 0.00 -1.84 0.00 0.00 35.03 29.93 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 -1.83 3.16 -0.03 -0.18 2.01 -1.26 -0.58 115.64 116.93 1p97 s THR 7 Ca 0.27 -0.60 0.03 0.00 0.31 0.00 0.00 61.69 61.70 1p97 s THR 7 Cb -0.04 -2.38 0.00 0.00 0.01 0.00 0.00 72.50 70.09 1p97 s THR 7 CO 0.75 0.48 -0.11 0.72 -0.69 0.00 0.00 174.62 175.77 1p97 s PHE 8 N 0.89 1.14 -0.41 4.92 -0.71 -0.98 -4.98 117.98 117.84 1p97 s PHE 8 Ca -0.02 -0.32 -0.28 0.00 -1.04 0.00 0.00 56.93 55.28 1p97 s PHE 8 Cb -0.15 -0.81 0.02 0.00 -1.21 0.00 0.00 43.02 40.87 1p97 s PHE 8 CO 0.00 -0.14 1.03 -1.17 -1.34 0.00 0.00 175.22 173.61 1p97 s LEU 9 N 0.26 3.85 0.39 -1.99 1.98 -1.26 -2.57 118.68 119.34 1p97 s LEU 9 Ca -0.05 0.57 0.08 0.00 -2.89 0.00 0.00 54.13 51.84 1p97 s LEU 9 Cb -0.10 -3.42 -0.03 0.00 0.66 0.00 0.00 46.19 43.30 1p97 s LEU 9 CO 0.01 -1.03 0.31 -0.94 -1.89 0.00 0.00 176.35 172.81 1p97 s SER 10 N 2.09 5.01 0.01 3.68 1.04 0.02 -1.19 113.70 124.37 1p97 s SER 10 Ca 0.43 -0.72 -0.23 0.00 0.48 0.00 0.00 55.95 55.91 1p97 s SER 10 Cb -0.10 -0.68 0.05 0.00 0.10 0.00 0.00 66.02 65.39 1p97 s SER 10 CO 0.24 -0.53 0.53 0.00 0.98 0.00 0.00 173.24 174.46 1p97 s ARG 11 N -4.04 0.99 0.45 4.02 1.70 -0.03 -1.16 118.95 120.87 1p97 s ARG 11 Ca 0.44 -0.11 0.03 0.00 -0.47 0.00 0.00 55.73 55.63 1p97 s ARG 11 Cb -0.03 0.45 -0.02 0.00 -0.57 0.00 0.00 34.95 34.79 1p97 s ARG 11 CO 0.26 -0.34 0.11 -1.01 -1.08 0.00 0.00 175.30 173.24 1p97 s HIS 12 N -1.98 1.79 -0.06 5.89 3.76 0.11 -1.03 115.29 123.76 1p97 s HIS 12 Ca -0.08 -1.24 -0.05 0.00 -0.15 0.00 0.00 55.06 53.55 1p97 s HIS 12 Cb -0.01 -1.26 0.02 0.00 1.11 0.00 0.00 32.58 32.44 1p97 s HIS 12 CO 0.02 -0.20 0.16 0.45 -0.85 0.00 0.00 174.74 174.32 1p97 s SER 13 N -3.69 -0.15 0.00 1.40 0.15 -1.26 -0.04 113.70 110.10 1p97 s SER 13 Ca 0.18 0.32 0.00 0.00 0.70 0.00 0.00 55.95 57.15 1p97 s SER 13 Cb 0.02 0.28 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 1p97 s SER 13 CO 0.12 -0.09 0.00 0.80 1.20 0.00 0.00 173.24 175.27 1p97 n MET 14 N 3.42 0.00 0.12 5.44 1.56 -1.24 -0.26 117.12 126.15 1p97 n MET 14 Ca -0.17 0.00 0.12 0.00 -0.27 0.00 0.00 57.70 57.37 1p97 n MET 14 Cb 0.57 0.00 0.47 0.00 2.15 0.00 0.00 33.22 36.41 1p97 n MET 14 CO 0.00 0.00 0.00 -0.40 -0.73 0.00 0.00 175.97 174.84 1p97 n ASP 15 N 0.46 0.61 -2.31 6.12 5.75 -1.26 -4.93 116.55 120.99 1p97 n ASP 15 Ca 0.00 0.65 -0.03 0.00 -0.01 0.00 0.00 54.79 55.39 1p97 n ASP 15 Cb 0.00 -0.78 0.00 0.00 -1.03 0.00 0.00 41.12 39.32 1p97 n ASP 15 CO 0.00 0.00 0.00 0.80 -0.11 0.00 0.00 177.20 177.89 1p97 n MET 16 N -2.17 -1.16 -0.06 0.11 0.00 0.64 -5.00 117.12 109.47 1p97 n MET 16 Ca 0.02 1.31 -0.08 0.00 -0.00 0.00 0.00 57.70 58.96 1p97 n MET 16 Cb 0.23 -3.90 -0.03 0.00 0.00 0.00 0.00 33.22 29.53 1p97 n MET 16 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 175.97 176.33 1p97 n LYS 17 N -0.72 0.41 0.00 2.12 2.85 -1.26 -3.99 118.16 117.57 1p97 n LYS 17 Ca 0.05 0.16 0.00 0.00 -1.05 0.00 0.00 58.31 57.47 1p97 n LYS 17 Cb 0.34 -1.21 0.00 0.00 -0.65 0.00 0.00 35.03 33.50 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 -4.21 0.00 0.68 5.58 3.72 -1.25 -2.05 117.46 119.93 1p97 n PHE 18 Ca -0.13 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.34 1p97 n PHE 18 Cb 0.43 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.88 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 -0.20 -0.15 114.28 112.33 1p97 n THR 19 Ca 0.00 -0.15 -0.13 0.00 -2.27 0.00 0.00 64.05 61.49 1p97 n THR 19 Cb 0.00 0.97 -0.10 0.00 -2.10 0.00 0.00 70.33 69.10 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 -2.44 -0.46 -0.03 4.78 5.04 -0.86 -4.89 117.35 118.50 1p97 s TYR 20 Ca 0.05 1.10 0.01 0.00 -2.44 0.00 0.00 57.07 55.80 1p97 s TYR 20 Cb 0.11 0.16 0.02 0.00 0.35 0.00 0.00 41.96 42.60 1p97 s TYR 20 CO 0.62 -0.23 -0.04 0.00 -1.34 0.00 0.00 175.55 174.55 1p97 s ASP 22 N 0.62 5.31 0.63 0.00 2.15 -0.33 -4.69 116.67 120.36 1p97 s ASP 22 Ca -0.08 2.24 0.40 0.00 0.43 0.00 0.00 52.55 55.55 1p97 s ASP 22 Cb -0.11 -2.58 2.12 0.00 -0.30 0.00 0.00 42.92 42.04 1p97 s ASP 22 CO -0.00 -1.51 2.27 0.44 -0.17 0.00 0.00 175.17 176.20 1p97 h ASP 23 N 0.78 0.00 0.43 -0.34 5.19 -2.00 -0.28 116.42 120.20 1p97 h ASP 23 Ca -0.49 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.92 1p97 h ASP 23 Cb 1.28 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.79 1p97 h ASP 23 CO 0.55 0.01 0.00 0.03 -3.12 0.00 0.00 179.24 176.71 1p97 h ARG 24 N 0.00 0.00 -0.54 3.56 -0.00 -1.95 -3.07 114.38 112.38 1p97 h ARG 24 Ca -0.00 0.00 0.06 0.00 -0.50 0.00 0.00 59.98 59.54 1p97 h ARG 24 Cb 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 29.97 30.06 1p97 h ARG 24 CO 0.00 0.00 0.36 0.97 0.00 0.00 0.00 179.97 181.30 1p97 h ILE 25 N 0.00 0.98 -0.87 2.04 2.10 -1.35 0.15 117.51 120.57 1p97 h ILE 25 Ca 0.00 -0.17 0.17 0.00 1.08 0.00 0.00 64.86 65.94 1p97 h ILE 25 Cb 0.21 0.45 -0.07 0.00 -1.09 0.00 0.00 36.82 36.32 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 0.49 0.76 0.00 2.19 1.35 -1.41 0.40 112.91 116.70 1p97 h THR 26 Ca 0.23 -0.18 -0.14 0.00 -0.55 0.00 0.00 66.41 65.77 1p97 h THR 26 Cb 0.29 0.19 -0.02 0.00 -1.73 0.00 0.00 68.15 66.87 1p97 h THR 26 CO -0.06 0.10 -0.92 -0.33 -0.25 0.00 0.00 175.52 174.05 1p97 h GLU 27 N 0.53 0.00 0.00 4.72 4.39 -0.96 -3.15 114.58 120.12 1p97 h GLU 27 Ca 0.45 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.96 1p97 h GLU 27 Cb 0.92 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.55 1p97 h GLU 27 CO -0.19 0.48 -1.58 1.28 -1.16 0.00 0.00 179.01 177.84 1p97 n LEU 28 N -3.11 1.91 -0.00 1.33 4.77 -0.38 -4.66 117.00 116.85 1p97 n LEU 28 Ca -0.03 0.33 0.09 0.00 -0.03 0.00 0.00 56.01 56.37 1p97 n LEU 28 Cb 0.80 -0.75 -0.12 0.00 -2.33 0.00 0.00 43.42 41.02 1p97 n LEU 28 CO 0.42 0.05 -0.25 -0.38 -1.33 0.00 0.00 177.39 175.90 1p97 n ILE 29 N -4.34 0.00 0.00 -0.08 5.41 0.12 -4.94 119.36 115.53 1p97 n ILE 29 Ca -0.29 -0.17 0.00 0.00 1.00 0.00 0.00 62.75 63.29 1p97 n ILE 29 Cb 0.65 0.72 0.00 0.00 -0.71 0.00 0.00 39.64 40.30 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 1.43 2.99 3.77 7.39 0.00 -0.13 -0.59 105.19 120.06 1p97 n GLY 30 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 1p97 n GLY 30 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1p97 s TYR 31 N -1.48 1.59 0.05 1.61 2.02 -1.26 -4.68 117.35 115.20 1p97 s TYR 31 Ca 0.00 0.57 0.01 0.00 -0.37 0.00 0.00 57.07 57.28 1p97 s TYR 31 Cb 0.00 -3.65 -0.04 0.00 -0.40 0.00 0.00 41.96 37.87 1p97 s TYR 31 CO 0.00 -2.92 0.14 -1.58 -1.57 0.00 0.00 175.55 169.62 1p97 s HIS 32 N -3.39 3.37 0.25 2.71 2.46 -1.26 -2.72 115.29 116.71 1p97 s HIS 32 Ca 0.69 0.19 -0.04 0.00 0.47 0.00 0.00 55.06 56.37 1p97 s HIS 32 Cb -0.10 -1.71 0.50 0.00 -0.13 0.00 0.00 32.58 31.14 1p97 s HIS 32 CO 0.54 0.57 1.68 -1.35 -2.47 0.00 0.00 174.74 173.71 1p97 h PRO 33 N 3.38 0.26 0.00 2.88 0.11 -1.86 0.18 132.00 136.96 1p97 h PRO 33 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1p97 h PRO 33 Cb 1.17 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1p97 h PRO 33 CO 0.70 0.18 0.00 0.39 -0.21 0.00 0.00 178.00 179.05 1p97 n GLU 34 N -5.16 0.16 -0.01 1.05 -0.58 -1.26 -1.26 120.64 113.59 1p97 n GLU 34 Ca 0.15 0.40 -0.09 0.00 -0.42 0.00 0.00 57.16 57.20 1p97 n GLU 34 Cb 0.49 -1.81 -0.07 0.00 -0.57 0.00 0.00 31.44 29.48 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 -0.10 0.00 3.49 4.39 -1.03 -3.29 114.58 118.04 1p97 h GLU 35 Ca 0.00 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 1p97 h GLU 35 Cb 0.34 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.01 1p97 h GLU 35 CO 0.00 0.40 -0.03 -0.07 -1.16 0.00 0.00 179.01 178.15 1p97 h LEU 36 N -0.93 0.00 -8.29 1.33 4.07 -1.16 -3.43 115.31 106.89 1p97 h LEU 36 Ca -0.01 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 57.88 1p97 h LEU 36 Cb 0.54 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.26 1p97 h LEU 36 CO 0.02 0.03 0.39 0.18 -1.08 0.00 0.00 178.44 177.98 1p97 n LEU 37 N -3.13 1.27 0.00 1.67 4.77 -0.39 -2.01 117.00 119.19 1p97 n LEU 37 Ca 0.01 -1.31 0.00 0.00 -0.03 0.00 0.00 56.01 54.68 1p97 n LEU 37 Cb 0.37 -1.47 0.00 0.00 -2.33 0.00 0.00 43.42 39.99 1p97 n LEU 37 CO 0.29 -2.41 0.00 0.61 -1.33 0.00 0.00 177.39 174.55 1p97 n GLY 38 N 6.58 1.38 2.88 -0.72 0.00 0.78 -4.99 105.19 111.10 1p97 n GLY 38 Ca 0.50 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.37 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 -0.35 0.26 -0.79 1.61 1.70 -0.85 -4.99 118.95 115.53 1p97 s ARG 39 Ca 0.00 -0.03 -0.35 0.00 -0.47 0.00 0.00 55.73 54.88 1p97 s ARG 39 Cb 0.00 -0.33 -0.20 0.00 -0.57 0.00 0.00 34.95 33.85 1p97 s ARG 39 CO 0.00 -0.01 2.42 0.45 -1.08 0.00 0.00 175.30 177.08 1p97 n SER 40 N 3.45 0.44 -0.30 -2.89 2.88 -1.26 -3.85 113.62 112.09 1p97 n SER 40 Ca -0.18 0.35 0.09 0.00 -1.33 0.00 0.00 58.87 57.80 1p97 n SER 40 Cb 0.56 -0.88 0.26 0.00 -0.75 0.00 0.00 64.21 63.39 1p97 n SER 40 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1p97 h ALA 41 N 10.58 1.34 0.00 -1.46 0.00 -1.54 -2.94 119.26 125.24 1p97 h ALA 41 Ca -0.07 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1p97 h ALA 41 Cb 1.31 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1p97 h ALA 41 CO 1.24 -0.19 0.32 1.88 0.00 0.00 0.00 179.25 182.50 1p97 h TYR 42 N 0.54 0.00 0.00 0.00 0.05 -1.86 0.55 116.97 116.25 1p97 h TYR 42 Ca 0.50 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.28 1p97 h TYR 42 Cb 0.81 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.55 1p97 h TYR 42 CO -0.11 0.00 0.00 0.39 -1.05 0.00 0.00 178.16 177.39 1p97 n GLU 43 N -2.71 0.42 0.00 4.88 -0.58 -1.11 -3.66 120.64 117.88 1p97 n GLU 43 Ca -0.02 0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 1p97 n GLU 43 Cb 0.36 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.73 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 -1.25 0.00 -1.01 -0.32 1.16 0.05 -5.00 117.46 111.09 1p97 n PHE 44 Ca 0.13 0.00 -0.39 0.00 -1.87 0.00 0.00 57.45 55.32 1p97 n PHE 44 Cb 0.19 0.01 -0.05 0.00 -1.61 0.00 0.00 39.48 38.02 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 1.63 -0.48 2.97 9.36 0.17 -2.55 117.16 128.26 1p97 n TYR 45 Ca 0.00 -1.72 0.00 0.00 3.32 0.00 0.00 57.90 59.50 1p97 n TYR 45 Cb 0.11 -1.61 0.00 0.00 -0.63 0.00 0.00 39.34 37.20 1p97 n TYR 45 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 1p97 n HIS 46 N 6.97 -1.33 -0.04 2.98 8.25 -1.23 -3.86 115.22 126.96 1p97 n HIS 46 Ca 0.47 0.71 -0.01 0.00 -0.26 0.00 0.00 57.72 58.63 1p97 n HIS 46 Cb 0.35 -1.76 -0.00 0.00 1.12 0.00 0.00 29.99 29.70 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 0.49 0.00 0.00 -1.41 0.00 -1.85 -3.30 119.26 113.19 1p97 h ALA 47 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1p97 h ALA 47 Cb 0.01 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1p97 h ALA 47 CO 0.00 0.10 -1.06 1.47 0.00 0.00 0.00 179.25 179.76 1p97 n LEU 48 N -3.83 0.65 -0.60 0.00 -0.00 -1.26 -4.11 117.00 107.85 1p97 n LEU 48 Ca -0.01 0.15 0.12 0.00 -0.00 0.00 0.00 56.01 56.27 1p97 n LEU 48 Cb 0.05 -0.09 0.21 0.00 -0.00 0.00 0.00 43.42 43.60 1p97 n LEU 48 CO 0.02 -0.06 0.59 0.47 -0.00 0.00 0.00 177.39 178.41 1p97 n ASP 49 N -2.28 2.06 -0.13 1.45 9.92 -1.26 -4.14 116.55 122.17 1p97 n ASP 49 Ca 0.01 -1.56 -0.10 0.00 -0.53 0.00 0.00 54.79 52.61 1p97 n ASP 49 Cb 0.49 0.16 -0.01 0.00 -0.64 0.00 0.00 41.12 41.12 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 2.94 0.55 -0.91 -2.24 0.87 -1.67 -2.46 113.55 110.63 1p97 h SER 50 Ca 0.00 -0.21 -0.02 0.00 -1.23 0.00 0.00 61.79 60.33 1p97 h SER 50 Cb 0.74 -0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 62.51 1p97 h SER 50 CO 0.00 0.62 0.51 -0.08 -0.53 0.00 0.00 176.83 177.34 1p97 h GLU 51 N 0.46 1.27 -0.97 2.24 4.81 -1.86 0.32 114.58 120.84 1p97 h GLU 51 Ca 0.12 -0.14 0.09 0.00 -0.13 0.00 0.00 59.36 59.30 1p97 h GLU 51 Cb 0.27 -0.25 -0.07 0.00 0.63 0.00 0.00 28.75 29.32 1p97 h GLU 51 CO -0.00 0.92 0.61 -0.91 -0.73 0.00 0.00 179.01 178.90 1p97 h ASN 52 N 1.27 0.94 0.77 1.04 4.21 -1.75 0.11 115.58 122.16 1p97 h ASN 52 Ca 0.32 0.03 -0.13 0.00 1.21 0.00 0.00 56.30 57.73 1p97 h ASN 52 Cb 0.01 -0.16 -0.02 0.00 -1.12 0.00 0.00 38.32 37.03 1p97 h ASN 52 CO -0.05 0.55 -0.60 0.24 -1.29 0.00 0.00 177.43 176.28 1p97 h MET 53 N 1.04 0.00 -0.35 0.81 2.86 -0.62 0.17 114.93 118.84 1p97 h MET 53 Ca 0.45 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.09 1p97 h MET 53 Cb 0.31 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 1p97 h MET 53 CO -0.22 0.60 0.23 1.15 1.06 0.00 0.00 176.91 179.73 1p97 h THR 54 N 0.00 1.09 -0.46 2.22 2.02 0.13 0.45 112.91 118.36 1p97 h THR 54 Ca -0.01 -0.16 -0.05 0.00 0.77 0.00 0.00 66.41 66.97 1p97 h THR 54 Cb 1.14 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 68.10 1p97 h THR 54 CO 0.08 0.09 0.09 0.11 0.37 0.00 0.00 175.52 176.25 1p97 h LYS 55 N 0.47 0.70 -0.79 6.66 6.56 -0.82 -0.54 116.57 128.82 1p97 h LYS 55 Ca 0.13 -0.14 -0.02 0.00 -1.06 0.00 0.00 60.65 59.56 1p97 h LYS 55 Cb -0.05 -0.11 -0.04 0.00 -0.57 0.00 0.00 32.23 31.47 1p97 h LYS 55 CO -0.03 0.65 0.42 1.03 -2.06 0.00 0.00 179.45 179.47 1p97 h SER 56 N 0.68 0.99 -0.50 0.86 0.87 -0.21 0.18 113.55 116.41 1p97 h SER 56 Ca 0.15 -0.10 -0.11 0.00 -1.23 0.00 0.00 61.79 60.49 1p97 h SER 56 Cb 0.29 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 1p97 h SER 56 CO 0.00 0.81 -0.13 -0.74 -0.53 0.00 0.00 176.83 176.24 1p97 h HIS 57 N 1.09 1.09 0.00 2.24 -0.00 0.52 0.55 115.15 120.65 1p97 h HIS 57 Ca 0.28 -0.24 -0.07 0.00 -0.00 0.00 0.00 60.37 60.34 1p97 h HIS 57 Cb 0.05 -0.27 -0.01 0.00 -0.00 0.00 0.00 27.41 27.18 1p97 h HIS 57 CO 0.00 1.04 -0.33 -0.56 -0.00 0.00 0.00 177.93 178.09 1p97 h GLN 58 N 0.83 0.00 0.00 5.26 3.07 -0.81 -1.51 115.11 121.96 1p97 h GLN 58 Ca 0.13 0.00 -0.04 0.00 0.09 0.00 0.00 58.65 58.82 1p97 h GLN 58 Cb 0.70 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.25 1p97 h GLN 58 CO 0.05 0.33 -0.27 -0.97 0.09 0.00 0.00 178.83 178.07 1p97 h ASN 59 N 0.00 0.00 -0.49 0.06 -1.24 -0.38 -3.36 115.58 110.17 1p97 h ASN 59 Ca -0.00 -0.63 0.02 0.00 0.71 0.00 0.00 56.30 56.40 1p97 h ASN 59 Cb 0.87 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.90 1p97 h ASN 59 CO 0.04 0.97 0.33 0.25 -1.29 0.00 0.00 177.43 177.73 1p97 h LEU 60 N -1.00 0.50 0.04 0.34 5.85 0.10 -0.50 115.31 120.65 1p97 h LEU 60 Ca -0.06 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.67 1p97 h LEU 60 Cb 0.81 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.67 1p97 h LEU 60 CO -0.04 0.35 -0.41 0.00 -0.34 0.00 0.00 178.44 178.00 1p97 h THR 62 N -0.59 1.42 0.00 0.00 2.02 -1.69 -3.35 112.91 110.71 1p97 h THR 62 Ca 0.04 -3.11 -0.13 0.00 0.77 0.00 0.00 66.41 63.97 1p97 h THR 62 Cb 0.65 2.78 -0.02 0.00 -1.74 0.00 0.00 68.15 69.82 1p97 h THR 62 CO -0.29 0.85 -0.63 0.11 0.37 0.00 0.00 175.52 175.93 1p97 h LYS 63 N 0.03 0.00 0.00 6.66 1.79 -0.90 -3.47 116.57 120.68 1p97 h LYS 63 Ca -0.13 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.34 1p97 h LYS 63 Cb 1.90 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.55 1p97 h LYS 63 CO 0.14 0.63 0.00 0.41 -1.08 0.00 0.00 179.45 179.56 1p97 n GLY 64 N 0.65 2.95 3.59 3.86 0.00 0.61 -4.93 105.19 111.92 1p97 n GLY 64 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 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 0.86 0.02 1.61 0.74 -1.26 -1.38 119.66 120.26 1p97 s GLN 65 Ca 0.00 0.65 -0.21 0.00 0.05 0.00 0.00 55.36 55.85 1p97 s GLN 65 Cb 0.00 0.41 0.04 0.00 1.10 0.00 0.00 33.01 34.57 1p97 s GLN 65 CO 0.00 -0.18 0.47 0.54 -0.55 0.00 0.00 175.29 175.57 1p97 s VAL 66 N -0.27 0.04 -0.37 1.34 0.11 0.29 -4.71 120.40 116.83 1p97 s VAL 66 Ca -0.03 -0.32 0.01 0.00 -2.93 0.00 0.00 61.98 58.70 1p97 s VAL 66 Cb -0.03 -0.90 0.12 0.00 -1.53 0.00 0.00 36.38 34.03 1p97 s VAL 66 CO 0.03 -0.18 0.16 -0.69 -3.33 0.00 0.00 175.10 171.09 1p97 s VAL 67 N -2.03 1.25 0.51 2.04 1.01 -1.26 0.11 120.40 122.04 1p97 s VAL 67 Ca -0.08 -2.02 -0.11 0.00 0.00 0.00 0.00 61.98 59.77 1p97 s VAL 67 Cb -0.01 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.40 1p97 s VAL 67 CO 0.01 -0.77 0.90 -0.44 0.00 0.00 0.00 175.10 174.80 1p97 s SER 68 N 0.97 6.41 0.00 3.32 0.01 0.71 -4.97 113.70 120.14 1p97 s SER 68 Ca 0.13 1.28 0.00 0.00 1.31 0.00 0.00 55.95 58.68 1p97 s SER 68 Cb -0.21 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.63 1p97 s SER 68 CO -0.12 -0.62 0.00 0.61 0.41 0.00 0.00 173.24 173.52 1p97 n GLY 69 N -1.99 3.79 3.41 3.44 0.00 -1.26 -2.10 105.19 110.48 1p97 n GLY 69 Ca 0.04 -2.09 -0.53 0.00 0.00 0.00 0.00 46.02 43.44 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 -0.24 0.86 -4.62 1.61 6.02 -1.21 -4.18 117.38 115.62 1p97 n GLN 70 Ca 0.00 0.24 -0.28 0.00 -0.01 0.00 0.00 57.00 56.94 1p97 n GLN 70 Cb 0.00 -2.26 -0.09 0.00 1.02 0.00 0.00 30.24 28.91 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 6.92 2.06 -0.32 1.08 -0.85 0.64 -4.85 117.35 122.04 1p97 s TYR 71 Ca 1.11 -0.93 -0.09 0.00 -0.52 0.00 0.00 57.07 56.64 1p97 s TYR 71 Cb -0.99 -1.53 0.00 0.00 0.38 0.00 0.00 41.96 39.82 1p97 s TYR 71 CO 0.53 0.16 0.15 1.03 -1.52 0.00 0.00 175.55 175.91 1p97 s ARG 72 N -3.80 3.20 -0.11 -3.49 0.52 -1.26 -1.11 118.95 112.90 1p97 s ARG 72 Ca 0.23 -0.81 -0.12 0.00 -0.52 0.00 0.00 55.73 54.51 1p97 s ARG 72 Cb 0.05 -3.57 -0.05 0.00 0.52 0.00 0.00 34.95 31.90 1p97 s ARG 72 CO 0.12 -0.48 0.26 1.41 0.02 0.00 0.00 175.30 176.63 1p97 s MET 73 N 1.59 3.92 -0.04 3.54 1.75 0.77 -3.49 119.30 127.35 1p97 s MET 73 Ca 0.04 0.07 -0.30 0.00 -1.25 0.00 0.00 55.69 54.25 1p97 s MET 73 Cb -0.17 -3.31 -0.05 0.00 2.84 0.00 0.00 34.83 34.14 1p97 s MET 73 CO 0.06 0.52 1.47 -1.17 -0.65 0.00 0.00 175.02 175.24 1p97 s LEU 74 N -0.36 4.30 0.29 4.11 2.96 -1.06 -1.56 118.68 127.36 1p97 s LEU 74 Ca 0.17 2.10 -0.19 0.00 -0.22 0.00 0.00 54.13 56.00 1p97 s LEU 74 Cb -0.13 -3.55 -0.09 0.00 0.50 0.00 0.00 46.19 42.92 1p97 s LEU 74 CO 0.06 -0.80 0.77 0.00 -1.32 0.00 0.00 176.35 175.06 1p97 s ALA 75 N 3.06 3.33 0.22 5.97 0.00 0.64 -4.93 121.76 130.03 1p97 s ALA 75 Ca 0.66 0.17 -0.12 0.00 0.00 0.00 0.00 51.96 52.67 1p97 s ALA 75 Cb -0.31 -2.86 0.28 0.00 0.00 0.00 0.00 23.12 20.23 1p97 s ALA 75 CO 0.26 0.30 1.63 -0.22 0.00 0.00 0.00 175.76 177.73 1p97 h LYS 76 N 2.81 0.03 -0.89 0.00 3.64 -1.18 -1.43 116.57 119.55 1p97 h LYS 76 Ca -0.48 -0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 58.66 1p97 h LYS 76 Cb 1.18 -0.01 -0.15 0.00 -0.41 0.00 0.00 32.23 32.85 1p97 h LYS 76 CO 0.65 0.02 0.31 -2.39 -2.27 0.00 0.00 179.45 175.77 1p97 n HIS 77 N -5.39 1.98 -1.08 1.91 1.44 -1.26 -4.93 115.22 107.88 1p97 n HIS 77 Ca 0.09 -1.14 0.00 0.00 -2.01 0.00 0.00 57.72 54.66 1p97 n HIS 77 Cb 0.36 -0.63 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 -0.29 -4.24 0.00 -1.39 0.00 -0.54 -5.12 105.19 93.61 1p97 n GLY 78 Ca 0.35 -0.56 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 0.67 2.33 2.70 -0.02 0.00 -1.24 -4.80 105.19 104.83 1p97 n GLY 79 Ca 0.00 -0.86 -0.24 0.00 0.00 0.00 0.00 46.02 44.92 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 0.53 -0.10 1.61 2.02 0.11 -0.26 117.35 119.25 1p97 s TYR 80 Ca 0.00 -0.31 -0.01 0.00 -0.37 0.00 0.00 57.07 56.38 1p97 s TYR 80 Cb 0.00 -0.77 -0.03 0.00 -0.40 0.00 0.00 41.96 40.76 1p97 s TYR 80 CO 0.00 -0.43 -0.03 0.14 -1.57 0.00 0.00 175.55 173.66 1p97 s VAL 81 N 2.02 4.00 -0.17 0.71 -7.23 -0.60 0.30 120.40 119.43 1p97 s VAL 81 Ca 0.03 -0.35 -0.21 0.00 -1.81 0.00 0.00 61.98 59.63 1p97 s VAL 81 Cb -0.14 -2.69 -0.03 0.00 0.56 0.00 0.00 36.38 34.08 1p97 s VAL 81 CO -0.07 0.57 0.64 0.26 -0.31 0.00 0.00 175.10 176.20 1p97 s TRP 82 N -0.51 3.43 0.04 2.82 0.52 -1.25 -0.16 118.94 123.83 1p97 s TRP 82 Ca 0.08 1.00 0.02 0.00 0.02 0.00 0.00 56.10 57.23 1p97 s TRP 82 Cb -0.12 -2.79 -0.02 0.00 -1.15 0.00 0.00 33.47 29.39 1p97 s TRP 82 CO 0.02 -0.10 -0.08 -0.51 0.02 0.00 0.00 176.95 176.30 1p97 s LEU 83 N 1.62 2.22 -0.07 2.99 1.02 -0.27 -0.41 118.68 125.78 1p97 s LEU 83 Ca 0.31 -0.49 0.01 0.00 0.02 0.00 0.00 54.13 53.97 1p97 s LEU 83 Cb -0.16 -0.18 -0.03 0.00 0.02 0.00 0.00 46.19 45.84 1p97 s LEU 83 CO 0.12 -0.17 -0.07 -0.70 0.02 0.00 0.00 176.35 175.55 1p97 s GLU 84 N -1.39 2.77 -0.09 1.70 2.12 -0.43 -0.26 118.70 123.11 1p97 s GLU 84 Ca -0.08 -0.55 -0.00 0.00 0.36 0.00 0.00 54.97 54.69 1p97 s GLU 84 Cb -0.09 -2.59 0.02 0.00 0.26 0.00 0.00 34.13 31.73 1p97 s GLU 84 CO 0.00 0.65 -0.06 0.99 -0.54 0.00 0.00 175.26 176.30 1p97 s THR 85 N -0.77 0.80 -0.27 -1.70 2.01 -0.89 -0.22 115.64 114.62 1p97 s THR 85 Ca 0.12 -0.18 -0.22 0.00 0.31 0.00 0.00 61.69 61.72 1p97 s THR 85 Cb -0.11 -0.85 -0.01 0.00 0.01 0.00 0.00 72.50 71.54 1p97 s THR 85 CO 0.01 0.32 0.70 0.00 -0.69 0.00 0.00 174.62 174.96 1p97 s GLN 86 N 1.55 4.08 0.12 4.92 1.03 -0.63 -0.21 119.66 130.52 1p97 s GLN 86 Ca 0.01 0.61 0.05 0.00 0.04 0.00 0.00 55.36 56.07 1p97 s GLN 86 Cb -0.13 -3.67 -0.04 0.00 0.03 0.00 0.00 33.01 29.20 1p97 s GLN 86 CO -0.05 -0.49 0.05 0.20 -2.54 0.00 0.00 175.29 172.45 1p97 s GLY 87 N 1.48 1.86 -0.16 2.60 0.00 0.31 -1.67 107.32 111.75 1p97 s GLY 87 Ca 0.29 -1.16 -0.16 0.00 0.00 0.00 0.00 44.72 43.69 1p97 s GLY 87 CO 0.09 -1.15 0.45 -1.59 0.00 0.00 0.00 173.10 170.90 1p97 s THR 88 N -1.50 0.00 -0.31 0.90 2.01 -0.62 -0.55 115.64 115.58 1p97 s THR 88 Ca 0.28 -0.03 -0.09 0.00 0.31 0.00 0.00 61.69 62.16 1p97 s THR 88 Cb -0.11 -0.64 -0.01 0.00 0.01 0.00 0.00 72.50 71.76 1p97 s THR 88 CO 0.20 -0.02 0.14 -0.69 -0.69 0.00 0.00 174.62 173.57 1p97 s VAL 89 N 0.11 4.50 -0.38 3.82 1.01 -0.48 -0.07 120.40 128.91 1p97 s VAL 89 Ca -0.01 -0.45 -0.22 0.00 0.00 0.00 0.00 61.98 61.29 1p97 s VAL 89 Cb -0.03 -3.30 0.01 0.00 0.00 0.00 0.00 36.38 33.06 1p97 s VAL 89 CO 0.01 0.07 0.73 -0.51 0.00 0.00 0.00 175.10 175.41 1p97 s ILE 90 N 1.60 4.77 0.34 2.22 2.07 -0.69 -4.85 121.20 126.66 1p97 s ILE 90 Ca 0.04 0.68 -0.08 0.00 -1.41 0.00 0.00 60.65 59.89 1p97 s ILE 90 Cb -0.17 -4.18 -0.06 0.00 0.13 0.00 0.00 42.46 38.18 1p97 s ILE 90 CO 0.06 -0.45 0.65 -0.31 -1.91 0.00 0.00 174.94 172.98 1p97 s TYR 91 N 2.99 3.47 0.22 3.50 1.51 -1.26 -0.03 117.35 127.75 1p97 s TYR 91 Ca 0.28 0.85 -0.30 0.00 -1.01 0.00 0.00 57.07 56.89 1p97 s TYR 91 Cb -0.13 -2.27 -0.09 0.00 -0.11 0.00 0.00 41.96 39.35 1p97 s TYR 91 CO 0.17 0.05 1.36 -0.80 -1.11 0.00 0.00 175.55 175.22 1p97 s ASN 92 N -3.09 6.80 0.07 2.29 -0.87 0.02 -4.56 114.94 115.61 1p97 s ASN 92 Ca 0.48 2.51 -0.18 0.00 -1.57 0.00 0.00 52.86 54.10 1p97 s ASN 92 Cb -0.11 -2.62 -0.11 0.00 -0.02 0.00 0.00 41.25 38.40 1p97 s ASN 92 CO 0.30 -0.59 1.41 1.55 -2.57 0.00 0.00 177.10 177.20 1p97 h PRO 93 N 5.19 0.51 0.00 -0.60 0.13 -1.94 0.51 132.00 135.81 1p97 h PRO 93 Ca -0.45 -0.24 -0.09 0.00 -0.87 0.00 0.00 66.00 64.34 1p97 h PRO 93 Cb 1.22 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 1p97 h PRO 93 CO 0.77 0.81 -1.40 0.54 -0.23 0.00 0.00 178.00 178.49 1p97 n ARG 94 N -4.46 0.62 -0.00 0.86 5.12 -1.26 -4.17 116.66 113.37 1p97 n ARG 94 Ca -0.05 0.12 0.10 0.00 -1.93 0.00 0.00 57.85 56.09 1p97 n ARG 94 Cb 0.38 -1.76 -0.16 0.00 -1.16 0.00 0.00 32.46 29.76 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 -2.72 0.07 0.00 0.55 5.15 -1.24 -4.97 115.26 112.11 1p97 n ASN 95 Ca -0.07 0.03 0.00 0.00 -0.60 0.00 0.00 54.58 53.94 1p97 n ASN 95 Cb 0.71 1.83 0.00 0.00 -0.53 0.00 0.00 39.78 41.79 1p97 n ASN 95 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1p97 n LEU 96 N -2.31 0.02 -4.86 1.20 7.99 0.18 -4.90 117.00 114.31 1p97 n LEU 96 Ca -0.05 0.00 -0.31 0.00 -0.01 0.00 0.00 56.01 55.64 1p97 n LEU 96 Cb 0.59 -0.48 0.02 0.00 -0.11 0.00 0.00 43.42 43.44 1p97 n LEU 96 CO 0.45 -0.01 0.72 0.00 -1.51 0.00 0.00 177.39 177.05 1p97 s GLN 97 N -0.02 3.39 -0.52 3.23 1.03 -1.26 -4.47 119.66 121.03 1p97 s GLN 97 Ca 0.00 0.76 -0.28 0.00 0.04 0.00 0.00 55.36 55.88 1p97 s GLN 97 Cb 0.00 -2.06 -0.10 0.00 0.03 0.00 0.00 33.01 30.89 1p97 s GLN 97 CO 0.00 -0.73 2.41 -0.35 -2.54 0.00 0.00 175.29 174.08 1p97 n PRO 98 N -2.86 0.99 0.07 9.60 -0.04 -1.26 -0.80 135.00 140.70 1p97 n PRO 98 Ca 0.06 0.11 -0.13 0.00 -0.04 0.00 0.00 63.50 63.50 1p97 n PRO 98 Cb 0.54 -2.96 -0.08 0.00 -0.04 0.00 0.00 33.50 30.97 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 16.75 -0.10 0.00 0.54 5.75 -0.69 -3.29 115.11 134.07 1p97 h GLN 99 Ca -0.23 0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.24 1p97 h GLN 99 Cb 1.28 0.02 0.01 0.00 1.07 0.00 0.00 27.48 29.86 1p97 h GLN 99 CO 1.15 0.03 0.21 0.00 -2.65 0.00 0.00 178.83 177.58 1p97 s ILE 101 N -2.31 1.58 -0.29 0.00 1.09 0.94 -1.70 121.20 120.52 1p97 s ILE 101 Ca 0.13 -0.81 -0.08 0.00 -1.10 0.00 0.00 60.65 58.79 1p97 s ILE 101 Cb -0.04 -1.35 -0.00 0.00 -1.06 0.00 0.00 42.46 40.01 1p97 s ILE 101 CO 0.09 0.45 0.10 -0.04 -0.10 0.00 0.00 174.94 175.44 1p97 s MET 102 N -0.04 3.25 -0.26 2.79 -1.94 0.89 0.05 119.30 124.03 1p97 s MET 102 Ca -0.03 -0.76 -0.00 0.00 -1.71 0.00 0.00 55.69 53.19 1p97 s MET 102 Cb -0.12 -3.41 0.04 0.00 2.01 0.00 0.00 34.83 33.35 1p97 s MET 102 CO 0.02 -0.39 -0.06 0.00 -0.01 0.00 0.00 175.02 174.58 1p97 s VAL 104 N 1.24 5.00 -0.10 0.00 1.01 -0.67 -0.80 120.40 126.09 1p97 s VAL 104 Ca -0.04 0.56 -0.03 0.00 0.00 0.00 0.00 61.98 62.48 1p97 s VAL 104 Cb -0.18 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 1p97 s VAL 104 CO -0.04 -0.14 0.03 0.20 0.00 0.00 0.00 175.10 175.14 1p97 s ASN 105 N 1.70 5.44 -0.30 3.32 0.01 -1.06 -1.60 114.94 122.45 1p97 s ASN 105 Ca 0.21 0.18 0.02 0.00 -0.71 0.00 0.00 52.86 52.56 1p97 s ASN 105 Cb -0.15 -1.62 0.08 0.00 0.41 0.00 0.00 41.25 39.97 1p97 s ASN 105 CO 0.12 0.36 0.01 -0.31 -1.51 0.00 0.00 177.10 175.77 1p97 s TYR 106 N -0.77 3.00 -0.37 2.20 2.02 0.70 -2.33 117.35 121.79 1p97 s TYR 106 Ca 0.12 -2.38 -0.29 0.00 -0.37 0.00 0.00 57.07 54.15 1p97 s TYR 106 Cb -0.12 -2.24 0.00 0.00 -0.40 0.00 0.00 41.96 39.20 1p97 s TYR 106 CO 0.02 -0.89 1.47 0.08 -1.57 0.00 0.00 175.55 174.67 1p97 s VAL 107 N 1.18 3.85 -0.10 0.71 1.01 0.26 -1.32 120.40 125.99 1p97 s VAL 107 Ca 0.04 0.89 -0.07 0.00 0.00 0.00 0.00 61.98 62.84 1p97 s VAL 107 Cb -0.19 -4.08 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 1p97 s VAL 107 CO -0.10 -0.64 -0.13 0.18 0.00 0.00 0.00 175.10 174.40 1p97 n LEU 108 N 8.87 1.24 0.00 3.92 4.77 0.45 -4.09 117.00 132.16 1p97 n LEU 108 Ca 0.17 0.48 -0.16 0.00 -0.03 0.00 0.00 56.01 56.47 1p97 n LEU 108 Cb 0.47 -0.74 0.07 0.00 -2.33 0.00 0.00 43.42 40.90 1p97 n LEU 108 CO 0.69 -0.47 0.36 -1.54 -1.33 0.00 0.00 177.39 175.10 1p97 n SER 109 N -3.85 1.24 -3.26 -1.43 3.41 -1.22 -5.02 113.62 103.49 1p97 n SER 109 Ca -0.05 -1.98 -0.12 0.00 -0.26 0.00 0.00 58.87 56.46 1p97 n SER 109 Cb 0.20 -0.42 0.07 0.00 -0.26 0.00 0.00 64.21 63.79 1p97 n SER 109 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1p97 n GLU 110 N -2.22 0.14 -2.17 4.33 -0.58 -1.26 -4.50 120.64 114.38 1p97 n GLU 110 Ca 0.12 -1.34 -0.43 0.00 -0.42 0.00 0.00 57.16 55.09 1p97 n GLU 110 Cb 0.45 -0.38 -0.02 0.00 -0.57 0.00 0.00 31.44 30.91 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 -1.57 3.74 -0.30 -3.67 1.01 -1.26 -4.39 121.20 114.77 1p97 s ILE 111 Ca 0.34 0.81 -0.16 0.00 0.00 0.00 0.00 60.65 61.63 1p97 s ILE 111 Cb -0.02 -3.84 -0.02 0.00 0.01 0.00 0.00 42.46 38.58 1p97 s ILE 111 CO 0.23 -0.43 0.44 -0.70 0.00 0.00 0.00 174.94 174.48 1p97 s GLU 112 N 4.87 3.88 -0.26 2.79 2.12 0.15 -4.86 118.70 127.39 1p97 s GLU 112 Ca 0.69 0.01 0.02 0.00 0.36 0.00 0.00 54.97 56.05 1p97 s GLU 112 Cb -0.21 -3.71 0.05 0.00 0.26 0.00 0.00 34.13 30.52 1p97 s GLU 112 CO 0.30 -0.42 -0.11 0.15 -0.54 0.00 0.00 175.26 174.65 1p97 s LYS 113 N 2.21 2.37 0.00 4.30 1.02 -1.26 -0.72 119.74 127.66 1p97 s LYS 113 Ca 0.17 -1.27 0.00 0.00 0.02 0.00 0.00 55.97 54.89 1p97 s LYS 113 Cb -0.16 -2.89 0.00 0.00 -0.52 0.00 0.00 37.83 34.26 1p97 s LYS 113 CO 0.11 -0.53 0.00 -1.71 -0.92 0.00 0.00 175.35 172.30