#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 3.00 -0.15 4.61 0.00 -1.26 -5.05 120.51 121.66 1p97 n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1p97 n ALA 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -2.67 0.00 0.00 0.00 2.00 -1.26 -4.99 117.12 110.20 1p97 n MET 3 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 1p97 n MET 3 Cb 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 33.22 33.07 1p97 n MET 3 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1p97 n ASP 4 N -2.31 0.00 -4.57 7.83 9.92 -1.26 -4.77 116.55 121.39 1p97 n ASP 4 Ca 0.00 0.00 -0.20 0.00 -0.53 0.00 0.00 54.79 54.06 1p97 n ASP 4 Cb 0.00 0.00 -0.08 0.00 -0.64 0.00 0.00 41.12 40.40 1p97 n ASP 4 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1p97 s SER 5 N 0.00 4.22 -1.46 -2.24 0.01 -1.26 -3.79 113.70 109.18 1p97 s SER 5 Ca 0.00 -0.93 -0.10 0.00 1.31 0.00 0.00 55.95 56.23 1p97 s SER 5 Cb 0.00 -2.58 0.06 0.00 0.21 0.00 0.00 66.02 63.71 1p97 s SER 5 CO 0.00 -3.83 0.77 0.29 0.41 0.00 0.00 173.24 170.88 1p97 n LYS 6 N 8.43 -4.98 -4.47 12.44 5.02 -1.26 -4.62 118.16 128.72 1p97 n LYS 6 Ca 0.43 0.66 -0.33 0.00 -2.02 0.00 0.00 58.31 57.05 1p97 n LYS 6 Cb 0.46 -5.51 -0.15 0.00 -0.02 0.00 0.00 35.03 29.81 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 -3.17 2.75 -0.02 -0.18 2.01 -1.25 -0.66 115.64 115.12 1p97 s THR 7 Ca 0.50 -0.74 0.03 0.00 0.31 0.00 0.00 61.69 61.79 1p97 s THR 7 Cb -0.25 -2.17 -0.00 0.00 0.01 0.00 0.00 72.50 70.09 1p97 s THR 7 CO 0.62 0.51 -0.10 0.72 -0.69 0.00 0.00 174.62 175.68 1p97 s PHE 8 N 0.86 0.98 0.14 4.92 -0.71 -0.95 -4.67 117.98 118.55 1p97 s PHE 8 Ca -0.04 -0.23 -0.31 0.00 -1.04 0.00 0.00 56.93 55.31 1p97 s PHE 8 Cb -0.15 -0.68 -0.08 0.00 -1.21 0.00 0.00 43.02 40.90 1p97 s PHE 8 CO -0.00 -0.08 1.37 -1.17 -1.34 0.00 0.00 175.22 174.00 1p97 s LEU 9 N 0.06 4.38 0.10 -1.99 1.98 -1.26 -2.87 118.68 119.07 1p97 s LEU 9 Ca -0.01 2.37 0.04 0.00 -2.89 0.00 0.00 54.13 53.64 1p97 s LEU 9 Cb -0.07 -3.59 -0.03 0.00 0.66 0.00 0.00 46.19 43.15 1p97 s LEU 9 CO 0.00 -0.63 -0.12 -0.44 -1.89 0.00 0.00 176.35 173.28 1p97 s SER 10 N 0.87 1.61 -0.18 3.68 0.01 0.73 -0.70 113.70 119.72 1p97 s SER 10 Ca 0.62 -0.77 -0.20 0.00 1.31 0.00 0.00 55.95 56.91 1p97 s SER 10 Cb -0.37 -0.02 0.05 0.00 0.21 0.00 0.00 66.02 65.89 1p97 s SER 10 CO 0.33 -0.20 0.55 -0.60 0.41 0.00 0.00 173.24 173.73 1p97 s ARG 11 N -2.56 0.69 0.48 12.44 3.52 -0.15 -0.00 118.95 133.38 1p97 s ARG 11 Ca 0.05 0.64 0.02 0.00 -0.13 0.00 0.00 55.73 56.31 1p97 s ARG 11 Cb -0.05 0.33 -0.02 0.00 -1.56 0.00 0.00 34.95 33.66 1p97 s ARG 11 CO 0.01 -0.11 0.03 -1.01 -0.81 0.00 0.00 175.30 173.41 1p97 s HIS 12 N 0.01 1.89 -0.07 5.12 3.76 0.61 -1.41 115.29 125.20 1p97 s HIS 12 Ca -0.02 -1.01 -0.06 0.00 -0.15 0.00 0.00 55.06 53.82 1p97 s HIS 12 Cb -0.04 -1.52 0.03 0.00 1.11 0.00 0.00 32.58 32.16 1p97 s HIS 12 CO 0.02 0.13 0.18 0.45 -0.85 0.00 0.00 174.74 174.67 1p97 s SER 13 N -3.80 -0.19 0.00 1.40 0.15 -1.26 -0.01 113.70 109.99 1p97 s SER 13 Ca 0.12 0.38 0.00 0.00 0.70 0.00 0.00 55.95 57.14 1p97 s SER 13 Cb 0.02 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.68 1p97 s SER 13 CO 0.06 -0.09 0.00 0.23 1.20 0.00 0.00 173.24 174.64 1p97 n MET 14 N 3.39 0.00 0.17 5.44 2.81 -1.22 -0.45 117.12 127.26 1p97 n MET 14 Ca -0.17 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 55.84 1p97 n MET 14 Cb 0.57 0.00 0.61 0.00 -0.71 0.00 0.00 33.22 33.69 1p97 n MET 14 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 1p97 h ASP 15 N 0.00 0.00 -4.05 7.83 3.32 -1.96 -3.46 116.42 118.10 1p97 h ASP 15 Ca 0.00 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.80 1p97 h ASP 15 Cb 0.00 0.00 0.09 0.00 0.22 0.00 0.00 39.33 39.64 1p97 h ASP 15 CO 0.00 0.00 -0.43 0.80 -1.72 0.00 0.00 179.24 177.89 1p97 n MET 16 N -2.32 -5.03 -0.05 3.56 0.00 0.41 -4.98 117.12 108.71 1p97 n MET 16 Ca -0.01 0.52 -0.00 0.00 -0.00 0.00 0.00 57.70 58.21 1p97 n MET 16 Cb 0.08 -4.63 -0.00 0.00 0.00 0.00 0.00 33.22 28.67 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 -1.70 0.00 0.00 2.12 2.10 -1.80 -3.42 116.57 113.86 1p97 h LYS 17 Ca -0.36 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.29 1p97 h LYS 17 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1p97 h LYS 17 CO 0.35 0.00 0.00 1.19 -2.00 0.00 0.00 179.45 178.99 1p97 n PHE 18 N -4.71 0.00 0.22 0.07 3.72 -1.25 -3.45 117.46 112.07 1p97 n PHE 18 Ca -0.00 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.42 1p97 n PHE 18 Cb 0.00 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.51 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 -3.72 4.37 -2.24 -0.50 0.15 114.28 112.34 1p97 n THR 19 Ca 0.00 -0.35 -0.13 0.00 -2.27 0.00 0.00 64.05 61.31 1p97 n THR 19 Cb 0.00 0.93 -0.10 0.00 -2.10 0.00 0.00 70.33 69.06 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 -1.60 -0.48 -0.01 4.78 5.04 -0.71 -4.87 117.35 119.49 1p97 s TYR 20 Ca 0.02 1.16 0.01 0.00 -2.44 0.00 0.00 57.07 55.81 1p97 s TYR 20 Cb 0.04 0.17 0.01 0.00 0.35 0.00 0.00 41.96 42.54 1p97 s TYR 20 CO 0.22 -0.24 -0.01 0.00 -1.34 0.00 0.00 175.55 174.18 1p97 s ASP 22 N 0.44 4.68 0.41 0.00 -1.08 0.12 -4.69 116.67 116.54 1p97 s ASP 22 Ca -0.04 2.06 0.10 0.00 -0.52 0.00 0.00 52.55 54.15 1p97 s ASP 22 Cb -0.07 -2.56 0.85 0.00 -1.46 0.00 0.00 42.92 39.69 1p97 s ASP 22 CO -0.01 -1.92 1.97 -0.78 0.52 0.00 0.00 175.17 174.95 1p97 h ASP 23 N -0.33 0.25 -0.09 -0.34 3.58 -2.00 -2.63 116.42 114.86 1p97 h ASP 23 Ca -0.46 -0.04 0.03 0.00 0.42 0.00 0.00 57.03 56.98 1p97 h ASP 23 Cb 1.26 -0.06 -0.00 0.00 1.72 0.00 0.00 39.33 42.24 1p97 h ASP 23 CO 0.52 0.33 0.22 0.03 -2.88 0.00 0.00 179.24 177.46 1p97 h ARG 24 N 0.26 0.00 0.00 0.28 2.47 -1.93 -1.97 114.38 113.49 1p97 h ARG 24 Ca 0.06 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.77 1p97 h ARG 24 Cb 0.25 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.57 1p97 h ARG 24 CO 0.01 0.00 -0.06 0.97 0.56 0.00 0.00 179.97 181.44 1p97 h ILE 25 N 0.00 0.84 -0.48 2.04 2.10 -1.77 0.74 117.51 120.98 1p97 h ILE 25 Ca 0.04 -0.24 0.06 0.00 1.08 0.00 0.00 64.86 65.81 1p97 h ILE 25 Cb 0.48 1.14 -0.03 0.00 -1.09 0.00 0.00 36.82 37.32 1p97 h ILE 25 CO -0.00 0.06 0.33 0.71 -1.08 0.00 0.00 178.15 178.17 1p97 h THR 26 N 0.00 0.96 0.00 2.19 1.35 -1.04 0.31 112.91 116.68 1p97 h THR 26 Ca -0.00 -0.14 -0.01 0.00 -0.55 0.00 0.00 66.41 65.71 1p97 h THR 26 Cb 0.13 0.53 -0.00 0.00 -1.73 0.00 0.00 68.15 67.07 1p97 h THR 26 CO 0.01 0.07 -0.84 -0.33 -0.25 0.00 0.00 175.52 174.18 1p97 h GLU 27 N 0.40 0.00 0.00 4.72 4.39 -1.08 -3.08 114.58 119.94 1p97 h GLU 27 Ca 0.21 0.00 -0.41 0.00 0.34 0.00 0.00 59.36 59.51 1p97 h GLU 27 Cb 0.32 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.91 1p97 h GLU 27 CO -0.05 0.03 -2.29 1.28 -1.16 0.00 0.00 179.01 176.82 1p97 n LEU 28 N -2.78 1.95 -0.07 1.33 4.77 -0.55 -4.66 117.00 116.99 1p97 n LEU 28 Ca 0.00 0.35 0.05 0.00 -0.03 0.00 0.00 56.01 56.39 1p97 n LEU 28 Cb 0.57 -0.83 -0.05 0.00 -2.33 0.00 0.00 43.42 40.78 1p97 n LEU 28 CO 0.39 0.48 0.04 -0.38 -1.33 0.00 0.00 177.39 176.58 1p97 n ILE 29 N -4.29 0.00 0.00 -0.08 2.08 0.98 -4.98 119.36 113.07 1p97 n ILE 29 Ca -0.49 -0.27 0.00 0.00 0.56 0.00 0.00 62.75 62.54 1p97 n ILE 29 Cb 0.83 1.03 0.00 0.00 -0.75 0.00 0.00 39.64 40.76 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 1.19 2.94 3.79 7.39 0.00 -0.89 -1.24 105.19 118.36 1p97 n GLY 30 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.06 2.66 0.06 1.61 2.02 -1.26 -4.77 117.35 116.62 1p97 s TYR 31 Ca 0.00 1.04 0.00 0.00 -0.37 0.00 0.00 57.07 57.74 1p97 s TYR 31 Cb 0.00 -3.23 -0.04 0.00 -0.40 0.00 0.00 41.96 38.29 1p97 s TYR 31 CO 0.00 -2.06 0.21 -1.58 -1.57 0.00 0.00 175.55 170.55 1p97 s HIS 32 N -3.19 3.51 0.26 2.71 2.46 -1.26 -2.50 115.29 117.28 1p97 s HIS 32 Ca 0.62 0.24 -0.04 0.00 0.47 0.00 0.00 55.06 56.36 1p97 s HIS 32 Cb -0.15 -1.75 0.53 0.00 -0.13 0.00 0.00 32.58 31.08 1p97 s HIS 32 CO 0.54 0.58 1.65 -1.35 -2.47 0.00 0.00 174.74 173.70 1p97 h PRO 33 N 3.04 0.18 0.00 2.88 0.11 -1.84 0.24 132.00 136.61 1p97 h PRO 33 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1p97 h PRO 33 Cb 1.16 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1p97 h PRO 33 CO 0.75 0.12 0.00 -0.85 -0.21 0.00 0.00 178.00 177.81 1p97 n GLU 34 N -5.26 0.17 0.07 1.05 0.00 -1.26 -1.82 120.64 113.59 1p97 n GLU 34 Ca 0.16 0.25 -0.15 0.00 0.00 0.00 0.00 57.16 57.42 1p97 n GLU 34 Cb 0.54 -1.75 -0.07 0.00 0.00 0.00 0.00 31.44 30.16 1p97 n GLU 34 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1p97 h GLU 35 N 0.00 0.45 0.00 3.44 4.39 -0.91 -3.23 114.58 118.71 1p97 h GLU 35 Ca 0.00 -0.52 0.00 0.00 0.34 0.00 0.00 59.36 59.18 1p97 h GLU 35 Cb 0.53 0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 1p97 h GLU 35 CO 0.00 1.17 -0.72 -0.07 -1.16 0.00 0.00 179.01 178.23 1p97 h LEU 36 N 0.24 0.00 -8.33 1.33 4.07 -0.99 -3.45 115.31 108.17 1p97 h LEU 36 Ca -0.10 -0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.86 1p97 h LEU 36 Cb 1.67 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 43.41 1p97 h LEU 36 CO 0.18 0.00 0.01 0.18 -1.08 0.00 0.00 178.44 177.73 1p97 n LEU 37 N -2.80 1.79 0.00 1.67 4.77 -0.76 -1.37 117.00 120.30 1p97 n LEU 37 Ca 0.01 -1.52 0.00 0.00 -0.03 0.00 0.00 56.01 54.47 1p97 n LEU 37 Cb 0.54 -1.66 0.00 0.00 -2.33 0.00 0.00 43.42 39.97 1p97 n LEU 37 CO 0.38 -2.67 0.00 0.61 -1.33 0.00 0.00 177.39 174.38 1p97 n GLY 38 N 6.79 1.61 3.63 -0.72 0.00 0.12 -4.98 105.19 111.64 1p97 n GLY 38 Ca 0.47 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.09 4.08 -0.98 1.61 1.70 -0.47 -4.95 118.95 119.85 1p97 s ARG 39 Ca 0.00 0.11 -0.18 0.00 -0.47 0.00 0.00 55.73 55.19 1p97 s ARG 39 Cb 0.00 -3.61 -0.28 0.00 -0.57 0.00 0.00 34.95 30.49 1p97 s ARG 39 CO 0.00 -0.19 2.37 0.43 -1.08 0.00 0.00 175.30 176.83 1p97 n SER 40 N 5.02 -0.58 -0.18 -2.89 7.64 -1.26 -3.74 113.62 117.63 1p97 n SER 40 Ca -0.08 -0.33 -0.03 0.00 1.01 0.00 0.00 58.87 59.44 1p97 n SER 40 Cb 0.51 -0.75 0.07 0.00 -1.01 0.00 0.00 64.21 63.03 1p97 n SER 40 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p97 h ALA 41 N 11.69 0.69 0.00 -0.43 0.00 -1.81 -2.88 119.26 126.53 1p97 h ALA 41 Ca -0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1p97 h ALA 41 Cb 1.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1p97 h ALA 41 CO 1.50 -0.13 0.52 1.88 0.00 0.00 0.00 179.25 183.03 1p97 h TYR 42 N 0.47 0.00 0.00 0.00 0.05 -1.88 0.57 116.97 116.18 1p97 h TYR 42 Ca 0.25 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.03 1p97 h TYR 42 Cb 0.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.96 1p97 h TYR 42 CO -0.13 0.00 0.00 0.93 -1.05 0.00 0.00 178.16 177.91 1p97 h GLU 43 N 0.00 0.00 0.00 4.88 4.39 -1.91 -3.35 114.58 118.60 1p97 h GLU 43 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1p97 h GLU 43 Cb 1.05 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.70 1p97 h GLU 43 CO 0.00 0.00 -0.02 1.97 -1.16 0.00 0.00 179.01 179.80 1p97 n PHE 44 N -3.02 0.00 -1.60 4.33 -1.74 0.14 -5.00 117.46 110.56 1p97 n PHE 44 Ca 0.01 0.00 -0.41 0.00 -0.56 0.00 0.00 57.45 56.49 1p97 n PHE 44 Cb 0.33 0.17 -0.03 0.00 1.52 0.00 0.00 39.48 41.47 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 2.89 -1.61 2.97 9.36 0.18 -3.41 117.16 127.54 1p97 n TYR 45 Ca 0.00 -2.35 -0.01 0.00 3.32 0.00 0.00 57.90 58.87 1p97 n TYR 45 Cb 0.51 -2.22 -0.01 0.00 -0.63 0.00 0.00 39.34 36.99 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 7.64 -1.60 0.18 2.98 8.25 -1.24 -3.17 115.22 128.26 1p97 n HIS 46 Ca 0.50 0.95 -0.15 0.00 -0.26 0.00 0.00 57.72 58.75 1p97 n HIS 46 Cb 0.41 -2.52 -0.09 0.00 1.12 0.00 0.00 29.99 28.91 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 1.43 -1.03 0.00 -1.41 0.00 -1.81 0.41 119.26 116.85 1p97 h ALA 47 Ca -0.07 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1p97 h ALA 47 Cb 0.16 0.76 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1p97 h ALA 47 CO 0.00 -1.10 -0.54 1.37 0.00 0.00 0.00 179.25 178.98 1p97 h LEU 48 N -0.78 0.00 0.00 0.00 -0.00 -1.91 -3.34 115.31 109.27 1p97 h LEU 48 Ca -0.03 -0.06 0.00 0.00 -0.00 0.00 0.00 57.88 57.79 1p97 h LEU 48 Cb 0.72 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.38 1p97 h LEU 48 CO -0.15 0.03 -1.01 0.47 -0.00 0.00 0.00 178.44 177.77 1p97 n ASP 49 N -2.59 0.83 -0.12 0.17 8.00 -1.11 -4.34 116.55 117.40 1p97 n ASP 49 Ca 0.02 -0.77 -0.07 0.00 0.71 0.00 0.00 54.79 54.69 1p97 n ASP 49 Cb 0.50 0.96 -0.01 0.00 -0.02 0.00 0.00 41.12 42.56 1p97 n ASP 49 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 1p97 h SER 50 N 0.00 -1.00 -0.73 -2.24 0.87 -0.13 0.38 113.55 110.70 1p97 h SER 50 Ca 0.00 0.18 -0.02 0.00 -1.23 0.00 0.00 61.79 60.72 1p97 h SER 50 Cb 0.56 0.48 -0.03 0.00 -0.44 0.00 0.00 62.40 62.96 1p97 h SER 50 CO 0.00 -0.30 0.37 -0.33 -0.53 0.00 0.00 176.83 176.04 1p97 h GLU 51 N -0.23 1.04 -0.23 2.24 5.08 -1.83 0.55 114.58 121.19 1p97 h GLU 51 Ca 0.18 -0.14 0.05 0.00 -1.00 0.00 0.00 59.36 58.45 1p97 h GLU 51 Cb 0.52 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.53 1p97 h GLU 51 CO -0.53 0.80 -0.06 -0.97 -1.00 0.00 0.00 179.01 177.25 1p97 h ASN 52 N 1.02 -0.21 0.56 1.42 -0.73 -1.52 0.55 115.58 116.66 1p97 h ASN 52 Ca 0.25 0.07 -0.05 0.00 1.87 0.00 0.00 56.30 58.45 1p97 h ASN 52 Cb 0.08 0.14 -0.01 0.00 0.27 0.00 0.00 38.32 38.81 1p97 h ASN 52 CO -0.04 -0.08 -0.23 0.24 -0.37 0.00 0.00 177.43 176.96 1p97 h MET 53 N 0.00 0.00 -0.65 6.67 2.86 0.28 -0.57 114.93 123.53 1p97 h MET 53 Ca 0.11 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.69 1p97 h MET 53 Cb 0.17 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 1p97 h MET 53 CO -0.24 0.23 0.17 1.15 1.06 0.00 0.00 176.91 179.28 1p97 h THR 54 N 0.00 1.25 -0.01 2.22 2.02 0.15 0.41 112.91 118.95 1p97 h THR 54 Ca -0.00 -0.89 -0.10 0.00 0.77 0.00 0.00 66.41 66.19 1p97 h THR 54 Cb 0.57 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 1p97 h THR 54 CO 0.03 0.34 -0.44 0.11 0.37 0.00 0.00 175.52 175.93 1p97 h LYS 55 N 0.96 0.03 -0.20 6.66 6.56 0.18 -2.08 116.57 128.68 1p97 h LYS 55 Ca 0.21 -0.01 -0.13 0.00 -1.06 0.00 0.00 60.65 59.66 1p97 h LYS 55 Cb 0.32 -0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.97 1p97 h LYS 55 CO -0.00 0.47 -0.42 0.77 -2.06 0.00 0.00 179.45 178.20 1p97 h SER 56 N 0.02 0.50 -0.71 0.86 0.02 -0.18 0.48 113.55 114.54 1p97 h SER 56 Ca -0.00 -0.22 -0.00 0.00 -0.84 0.00 0.00 61.79 60.72 1p97 h SER 56 Cb 0.80 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.16 1p97 h SER 56 CO 0.06 0.86 0.43 -0.74 -1.14 0.00 0.00 176.83 176.30 1p97 h HIS 57 N 0.38 0.93 0.00 3.45 -0.00 0.19 0.53 115.15 120.64 1p97 h HIS 57 Ca 0.03 -0.00 -0.06 0.00 -0.00 0.00 0.00 60.37 60.34 1p97 h HIS 57 Cb 0.90 -0.31 -0.01 0.00 -0.00 0.00 0.00 27.41 28.00 1p97 h HIS 57 CO 0.03 0.63 -0.29 1.96 -0.00 0.00 0.00 177.93 180.25 1p97 h GLN 58 N 0.97 0.00 0.02 5.26 4.20 -1.03 -0.52 115.11 124.00 1p97 h GLN 58 Ca 0.25 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.96 1p97 h GLN 58 Cb -0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.74 1p97 h GLN 58 CO -0.05 0.29 -0.01 -0.97 -0.67 0.00 0.00 178.83 177.42 1p97 h ASN 59 N 0.00 -0.02 0.18 1.46 -1.24 -0.24 -3.33 115.58 112.39 1p97 h ASN 59 Ca -0.00 -0.53 -0.01 0.00 0.71 0.00 0.00 56.30 56.46 1p97 h ASN 59 Cb 0.75 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.80 1p97 h ASN 59 CO 0.04 0.74 -0.06 0.25 -1.29 0.00 0.00 177.43 177.10 1p97 h LEU 60 N -0.99 0.00 -2.58 0.34 5.85 0.07 -2.03 115.31 115.98 1p97 h LEU 60 Ca -0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1p97 h LEU 60 Cb 0.55 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.58 1p97 h LEU 60 CO 0.00 0.06 -0.00 0.00 -0.34 0.00 0.00 178.44 178.16 1p97 n THR 62 N -3.13 0.00 0.00 0.00 -1.04 -0.81 -4.80 114.28 104.50 1p97 n THR 62 Ca -0.02 -0.48 0.00 0.00 -2.04 0.00 0.00 64.05 61.51 1p97 n THR 62 Cb 0.13 0.70 0.00 0.00 -1.82 0.00 0.00 70.33 69.35 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 0.24 2.75 -0.09 -2.82 4.76 -0.92 -5.02 118.16 117.06 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 0.90 -0.94 0.00 0.00 -1.84 0.00 0.00 35.03 33.15 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 2.55 1.79 3.57 0.72 0.00 -1.16 -4.95 105.19 107.70 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 -0.35 0.69 -0.05 1.61 0.74 -1.26 -2.50 119.66 118.54 1p97 s GLN 65 Ca 0.00 0.20 -0.10 0.00 0.05 0.00 0.00 55.36 55.51 1p97 s GLN 65 Cb 0.00 0.33 0.02 0.00 1.10 0.00 0.00 33.01 34.46 1p97 s GLN 65 CO 0.00 -0.21 0.25 0.54 -0.55 0.00 0.00 175.29 175.32 1p97 s VAL 66 N -1.04 0.04 0.06 1.34 0.11 0.10 -4.63 120.40 116.38 1p97 s VAL 66 Ca -0.04 -0.30 0.09 0.00 -2.93 0.00 0.00 61.98 58.80 1p97 s VAL 66 Cb -0.01 -0.46 -0.03 0.00 -1.53 0.00 0.00 36.38 34.36 1p97 s VAL 66 CO 0.03 -0.16 -0.24 -0.69 -3.33 0.00 0.00 175.10 170.70 1p97 s VAL 67 N -0.64 1.97 0.06 2.04 1.01 -1.26 0.39 120.40 123.96 1p97 s VAL 67 Ca -0.07 -1.38 -0.26 0.00 0.00 0.00 0.00 61.98 60.27 1p97 s VAL 67 Cb -0.04 -1.70 0.07 0.00 0.00 0.00 0.00 36.38 34.70 1p97 s VAL 67 CO 0.02 0.25 0.61 -0.55 0.00 0.00 0.00 175.10 175.43 1p97 s SER 68 N -1.37 -0.57 0.00 3.32 0.15 -0.64 -4.98 113.70 109.61 1p97 s SER 68 Ca 0.10 0.30 0.00 0.00 0.70 0.00 0.00 55.95 57.06 1p97 s SER 68 Cb -0.10 0.55 0.00 0.00 -1.71 0.00 0.00 66.02 64.77 1p97 s SER 68 CO 0.03 -0.78 0.00 0.61 1.20 0.00 0.00 173.24 174.29 1p97 n GLY 69 N 0.27 2.58 3.56 9.45 0.00 -1.26 -1.98 105.19 117.80 1p97 n GLY 69 Ca -0.18 -2.10 -0.53 0.00 0.00 0.00 0.00 46.02 43.21 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 -0.51 1.27 -4.71 1.61 6.02 -1.22 -4.14 117.38 115.70 1p97 n GLN 70 Ca 0.00 0.41 -0.31 0.00 -0.01 0.00 0.00 57.00 57.09 1p97 n GLN 70 Cb 0.00 -2.37 -0.09 0.00 1.02 0.00 0.00 30.24 28.81 1p97 n GLN 70 CO 0.00 0.00 0.00 1.52 -1.01 0.00 0.00 177.06 177.57 1p97 s TYR 71 N 5.60 2.02 -0.43 1.08 -0.85 0.68 -4.82 117.35 120.63 1p97 s TYR 71 Ca 1.04 -0.90 -0.12 0.00 -0.52 0.00 0.00 57.07 56.56 1p97 s TYR 71 Cb -0.91 -1.63 0.06 0.00 0.38 0.00 0.00 41.96 39.87 1p97 s TYR 71 CO 0.55 0.26 0.31 1.03 -1.52 0.00 0.00 175.55 176.18 1p97 s ARG 72 N -3.83 2.81 -0.10 -3.49 3.00 -1.26 -1.81 118.95 114.28 1p97 s ARG 72 Ca 0.14 -1.33 -0.05 0.00 0.00 0.00 0.00 55.73 54.49 1p97 s ARG 72 Cb 0.04 -3.93 -0.04 0.00 0.00 0.00 0.00 34.95 31.02 1p97 s ARG 72 CO 0.07 -0.93 0.12 1.41 0.00 0.00 0.00 175.30 175.97 1p97 s MET 73 N 1.55 3.34 -0.11 3.54 1.75 0.71 -3.69 119.30 126.39 1p97 s MET 73 Ca 0.03 -0.22 -0.29 0.00 -1.25 0.00 0.00 55.69 53.96 1p97 s MET 73 Cb -0.23 -3.09 -0.03 0.00 2.84 0.00 0.00 34.83 34.32 1p97 s MET 73 CO 0.05 0.75 1.44 -1.17 -0.65 0.00 0.00 175.02 175.44 1p97 s LEU 74 N -1.14 4.25 0.65 4.11 2.96 -1.22 -0.40 118.68 127.88 1p97 s LEU 74 Ca 0.16 1.94 -0.09 0.00 -0.22 0.00 0.00 54.13 55.93 1p97 s LEU 74 Cb -0.12 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.04 1p97 s LEU 74 CO 0.06 -0.83 1.00 0.00 -1.32 0.00 0.00 176.35 175.26 1p97 s ALA 75 N 3.71 3.09 0.48 5.97 0.00 0.74 -4.86 121.76 130.89 1p97 s ALA 75 Ca 0.63 -0.46 0.38 0.00 0.00 0.00 0.00 51.96 52.51 1p97 s ALA 75 Cb -0.27 -2.85 1.57 0.00 0.00 0.00 0.00 23.12 21.57 1p97 s ALA 75 CO 0.22 -0.94 1.58 -0.22 0.00 0.00 0.00 175.76 176.40 1p97 h LYS 76 N -0.41 0.01 -0.46 0.00 3.64 -1.50 0.25 116.57 118.11 1p97 h LYS 76 Ca -0.45 -0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 58.77 1p97 h LYS 76 Cb 1.25 -0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.97 1p97 h LYS 76 CO 0.62 0.01 0.09 -2.39 -2.27 0.00 0.00 179.45 175.51 1p97 n HIS 77 N -4.46 1.52 -0.72 1.91 1.44 -1.26 -4.86 115.22 108.79 1p97 n HIS 77 Ca 0.41 -1.28 0.00 0.00 -2.01 0.00 0.00 57.72 54.84 1p97 n HIS 77 Cb 1.70 -0.52 0.00 0.00 0.12 0.00 0.00 29.99 31.30 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 -0.69 0.63 2.11 -1.39 0.00 0.88 -5.03 105.19 101.70 1p97 n GLY 78 Ca 0.33 -0.13 -0.15 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.72 -0.93 2.81 -0.02 0.00 -1.13 -4.74 105.19 98.45 1p97 n GLY 79 Ca 0.00 -1.75 -0.16 0.00 0.00 0.00 0.00 46.02 44.11 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 -2.39 0.20 0.07 1.61 2.02 -0.72 -0.19 117.35 117.96 1p97 s TYR 80 Ca 0.40 0.04 0.07 0.00 -0.37 0.00 0.00 57.07 57.22 1p97 s TYR 80 Cb -0.01 -0.33 -0.03 0.00 -0.40 0.00 0.00 41.96 41.19 1p97 s TYR 80 CO 0.28 -0.11 -0.20 0.14 -1.57 0.00 0.00 175.55 174.09 1p97 s VAL 81 N 0.96 1.64 -0.13 0.71 -7.23 0.46 0.81 120.40 117.61 1p97 s VAL 81 Ca -0.09 -1.33 -0.20 0.00 -1.81 0.00 0.00 61.98 58.54 1p97 s VAL 81 Cb -0.12 -1.46 -0.03 0.00 0.56 0.00 0.00 36.38 35.32 1p97 s VAL 81 CO -0.02 0.07 0.59 0.26 -0.31 0.00 0.00 175.10 175.69 1p97 s TRP 82 N -0.97 3.48 0.00 2.82 0.52 -1.25 -0.20 118.94 123.34 1p97 s TRP 82 Ca 0.06 1.00 0.01 0.00 0.02 0.00 0.00 56.10 57.19 1p97 s TRP 82 Cb -0.09 -2.71 -0.01 0.00 -1.15 0.00 0.00 33.47 29.51 1p97 s TRP 82 CO 0.03 0.02 -0.04 -0.51 0.02 0.00 0.00 176.95 176.46 1p97 s LEU 83 N 1.15 2.04 -0.02 2.99 1.02 -0.75 -0.53 118.68 124.58 1p97 s LEU 83 Ca 0.30 -0.14 -0.00 0.00 0.02 0.00 0.00 54.13 54.31 1p97 s LEU 83 Cb -0.16 -0.19 -0.04 0.00 0.02 0.00 0.00 46.19 45.83 1p97 s LEU 83 CO 0.12 0.01 0.05 -0.70 0.02 0.00 0.00 176.35 175.85 1p97 s GLU 84 N -0.30 3.00 -0.12 1.70 2.12 -0.18 -0.23 118.70 124.68 1p97 s GLU 84 Ca -0.00 -0.49 0.01 0.00 0.36 0.00 0.00 54.97 54.84 1p97 s GLU 84 Cb -0.03 -2.82 0.02 0.00 0.26 0.00 0.00 34.13 31.57 1p97 s GLU 84 CO -0.00 0.66 -0.12 0.99 -0.54 0.00 0.00 175.26 176.24 1p97 s THR 85 N -1.11 1.37 -0.39 -1.70 2.01 -0.84 -0.44 115.64 114.53 1p97 s THR 85 Ca 0.20 -0.53 -0.15 0.00 0.31 0.00 0.00 61.69 61.52 1p97 s THR 85 Cb -0.12 -1.29 0.01 0.00 0.01 0.00 0.00 72.50 71.11 1p97 s THR 85 CO 0.11 0.42 0.33 -1.58 -0.69 0.00 0.00 174.62 173.21 1p97 s GLN 86 N 1.35 3.15 0.11 4.92 0.74 0.24 -1.62 119.66 128.57 1p97 s GLN 86 Ca 0.00 -0.83 0.05 0.00 0.05 0.00 0.00 55.36 54.64 1p97 s GLN 86 Cb -0.13 -3.93 -0.04 0.00 1.10 0.00 0.00 33.01 30.01 1p97 s GLN 86 CO -0.07 -0.70 0.00 0.20 -0.55 0.00 0.00 175.29 174.18 1p97 s GLY 87 N 1.72 1.86 -0.13 2.59 0.00 0.16 -0.71 107.32 112.81 1p97 s GLY 87 Ca 0.08 -1.18 -0.18 0.00 0.00 0.00 0.00 44.72 43.44 1p97 s GLY 87 CO 0.11 -1.17 0.47 -1.59 0.00 0.00 0.00 173.10 170.92 1p97 s THR 88 N -1.42 0.01 -0.25 0.90 2.01 -0.48 -0.72 115.64 115.70 1p97 s THR 88 Ca 0.26 -0.10 -0.08 0.00 0.31 0.00 0.00 61.69 62.08 1p97 s THR 88 Cb -0.11 -0.69 -0.04 0.00 0.01 0.00 0.00 72.50 71.67 1p97 s THR 88 CO 0.18 -0.05 0.10 -0.69 -0.69 0.00 0.00 174.62 173.47 1p97 s VAL 89 N -0.23 4.66 -0.31 3.82 1.01 -1.04 0.10 120.40 128.41 1p97 s VAL 89 Ca -0.04 -0.06 -0.21 0.00 0.00 0.00 0.00 61.98 61.68 1p97 s VAL 89 Cb -0.03 -3.18 -0.01 0.00 0.00 0.00 0.00 36.38 33.16 1p97 s VAL 89 CO 0.02 0.33 0.65 -0.51 0.00 0.00 0.00 175.10 175.59 1p97 s ILE 90 N 1.49 4.91 0.19 2.22 2.07 0.49 -4.87 121.20 127.71 1p97 s ILE 90 Ca 0.06 0.84 0.02 0.00 -1.41 0.00 0.00 60.65 60.16 1p97 s ILE 90 Cb -0.15 -4.03 -0.04 0.00 0.13 0.00 0.00 42.46 38.37 1p97 s ILE 90 CO 0.05 -0.18 0.35 -0.31 -1.91 0.00 0.00 174.94 172.93 1p97 s TYR 91 N 2.67 3.48 0.16 3.50 1.51 -1.26 -0.99 117.35 126.42 1p97 s TYR 91 Ca 0.26 0.19 -0.30 0.00 -1.01 0.00 0.00 57.07 56.20 1p97 s TYR 91 Cb -0.15 -1.73 -0.08 0.00 -0.11 0.00 0.00 41.96 39.90 1p97 s TYR 91 CO 0.12 0.44 1.21 1.21 -1.11 0.00 0.00 175.55 177.42 1p97 s ASN 92 N -3.35 7.08 0.12 2.29 3.04 -0.82 -4.77 114.94 118.52 1p97 s ASN 92 Ca 0.36 2.20 -0.12 0.00 0.04 0.00 0.00 52.86 55.33 1p97 s ASN 92 Cb -0.11 -2.60 -0.10 0.00 -1.54 0.00 0.00 41.25 36.90 1p97 s ASN 92 CO 0.29 -0.40 1.39 1.55 -3.04 0.00 0.00 177.10 176.89 1p97 h PRO 93 N 5.60 0.85 -0.02 0.43 0.13 -1.97 0.62 132.00 137.63 1p97 h PRO 93 Ca -0.44 -0.55 0.00 0.00 -0.87 0.00 0.00 66.00 64.14 1p97 h PRO 93 Cb 1.21 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1p97 h PRO 93 CO 0.76 1.18 0.00 0.54 -0.23 0.00 0.00 178.00 180.26 1p97 n ARG 94 N -4.03 1.74 0.00 0.86 1.74 -1.26 -4.33 116.66 111.38 1p97 n ARG 94 Ca -0.05 -1.08 0.00 0.00 -0.77 0.00 0.00 57.85 55.95 1p97 n ARG 94 Cb 0.63 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.59 1p97 n ARG 94 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1p97 n ASN 95 N 0.31 0.00 -3.09 0.55 4.05 -1.23 -5.04 115.26 110.81 1p97 n ASN 95 Ca 0.18 0.00 -0.21 0.00 0.45 0.00 0.00 54.58 55.01 1p97 n ASN 95 Cb 0.38 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.40 1p97 n ASN 95 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1p97 n LEU 96 N -0.49 -1.70 -4.87 1.20 4.77 0.21 -4.94 117.00 111.19 1p97 n LEU 96 Ca 0.00 -0.24 -0.30 0.00 -0.03 0.00 0.00 56.01 55.43 1p97 n LEU 96 Cb 0.00 -2.31 0.04 0.00 -2.33 0.00 0.00 43.42 38.82 1p97 n LEU 96 CO 0.00 0.11 0.74 -1.10 -1.33 0.00 0.00 177.39 175.81 1p97 s GLN 97 N -5.74 2.96 -0.72 3.23 -0.21 -1.26 -4.72 119.66 113.20 1p97 s GLN 97 Ca 0.29 0.58 -0.26 0.00 0.02 0.00 0.00 55.36 56.00 1p97 s GLN 97 Cb -0.15 -2.02 -0.05 0.00 1.00 0.00 0.00 33.01 31.78 1p97 s GLN 97 CO 0.36 -0.99 2.06 -2.14 -2.12 0.00 0.00 175.29 172.46 1p97 s PRO 98 N -5.28 2.37 0.02 2.91 0.02 -1.26 -1.94 135.00 131.84 1p97 s PRO 98 Ca 0.58 0.41 -0.25 0.00 0.02 0.00 0.00 61.00 61.76 1p97 s PRO 98 Cb -0.12 -4.70 -0.18 0.00 0.02 0.00 0.00 34.50 29.52 1p97 s PRO 98 CO 0.53 -3.29 1.38 0.37 -0.33 0.00 0.00 177.00 175.65 1p97 h GLN 99 N 14.14 -0.16 -2.74 5.54 5.75 -1.36 -3.21 115.11 133.06 1p97 h GLN 99 Ca -0.10 0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.40 1p97 h GLN 99 Cb 1.10 0.04 -0.14 0.00 1.07 0.00 0.00 27.48 29.55 1p97 h GLN 99 CO 1.18 0.15 0.24 0.00 -2.65 0.00 0.00 178.83 177.74 1p97 s ILE 101 N -3.20 3.96 -0.40 0.00 1.09 0.99 -0.37 121.20 123.26 1p97 s ILE 101 Ca -0.01 -0.31 -0.13 0.00 -1.10 0.00 0.00 60.65 59.10 1p97 s ILE 101 Cb -0.01 -2.78 0.03 0.00 -1.06 0.00 0.00 42.46 38.64 1p97 s ILE 101 CO -0.08 0.44 0.26 -0.04 -0.10 0.00 0.00 174.94 175.42 1p97 s MET 102 N 0.91 2.87 -0.27 2.79 -1.94 0.12 -0.29 119.30 123.49 1p97 s MET 102 Ca 0.01 -1.12 -0.07 0.00 -1.71 0.00 0.00 55.69 52.80 1p97 s MET 102 Cb -0.14 -3.86 -0.01 0.00 2.01 0.00 0.00 34.83 32.82 1p97 s MET 102 CO 0.02 -0.77 0.07 0.00 -0.01 0.00 0.00 175.02 174.32 1p97 s VAL 104 N 1.57 5.13 -0.03 0.00 1.01 0.11 -0.19 120.40 128.00 1p97 s VAL 104 Ca 0.05 0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.18 1p97 s VAL 104 Cb -0.16 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 1p97 s VAL 104 CO 0.03 -0.13 -0.08 0.20 0.00 0.00 0.00 175.10 175.12 1p97 s ASN 105 N 1.74 4.53 -0.38 3.32 0.01 -1.14 -0.59 114.94 122.44 1p97 s ASN 105 Ca 0.14 -0.12 0.03 0.00 -0.71 0.00 0.00 52.86 52.20 1p97 s ASN 105 Cb -0.16 -1.06 0.11 0.00 0.41 0.00 0.00 41.25 40.54 1p97 s ASN 105 CO 0.12 0.32 0.12 -0.31 -1.51 0.00 0.00 177.10 175.84 1p97 s TYR 106 N -0.90 3.03 -0.47 2.20 1.51 0.41 -2.24 117.35 120.89 1p97 s TYR 106 Ca 0.15 -2.71 -0.28 0.00 -1.01 0.00 0.00 57.07 53.22 1p97 s TYR 106 Cb -0.11 -2.54 0.00 0.00 -0.11 0.00 0.00 41.96 39.20 1p97 s TYR 106 CO 0.05 -0.88 1.54 0.08 -1.11 0.00 0.00 175.55 175.23 1p97 s VAL 107 N 0.77 3.72 -0.04 0.71 1.01 0.17 -1.01 120.40 125.72 1p97 s VAL 107 Ca 0.13 0.67 -0.03 0.00 0.00 0.00 0.00 61.98 62.75 1p97 s VAL 107 Cb -0.21 -4.14 -0.01 0.00 0.00 0.00 0.00 36.38 32.02 1p97 s VAL 107 CO -0.09 -0.84 -0.06 0.18 0.00 0.00 0.00 175.10 174.29 1p97 n LEU 108 N 9.80 0.52 -4.89 3.92 4.32 0.31 -4.71 117.00 126.27 1p97 n LEU 108 Ca 0.17 0.33 -0.30 0.00 -0.02 0.00 0.00 56.01 56.19 1p97 n LEU 108 Cb 0.49 -0.60 0.16 0.00 -1.62 0.00 0.00 43.42 41.84 1p97 n LEU 108 CO 0.70 -0.49 0.82 -0.44 -1.22 0.00 0.00 177.39 176.77 1p97 s SER 109 N -4.20 3.42 0.00 -1.43 0.01 -1.22 -4.99 113.70 105.29 1p97 s SER 109 Ca -0.05 0.49 0.00 0.00 1.31 0.00 0.00 55.95 57.70 1p97 s SER 109 Cb 0.01 -0.72 0.00 0.00 0.21 0.00 0.00 66.02 65.52 1p97 s SER 109 CO 0.07 -2.56 0.00 -0.62 0.41 0.00 0.00 173.24 170.54 1p97 n GLU 110 N -3.70 2.70 -2.34 12.44 1.02 -1.26 -4.35 120.64 125.15 1p97 n GLU 110 Ca 0.12 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.83 1p97 n GLU 110 Cb 0.60 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 32.00 1p97 n GLU 110 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1p97 s ILE 111 N 1.64 3.97 -0.49 -3.67 1.01 -1.26 -4.27 121.20 118.13 1p97 s ILE 111 Ca 0.00 1.06 -0.10 0.00 0.00 0.00 0.00 60.65 61.62 1p97 s ILE 111 Cb 0.00 -4.09 0.12 0.00 0.01 0.00 0.00 42.46 38.50 1p97 s ILE 111 CO 0.00 -0.54 0.37 -0.70 0.00 0.00 0.00 174.94 174.07 1p97 s GLU 112 N 4.55 2.54 -0.63 2.79 2.56 0.24 -4.95 118.70 125.80 1p97 s GLU 112 Ca 0.61 -1.79 -0.21 0.00 0.00 0.00 0.00 54.97 53.58 1p97 s GLU 112 Cb -0.17 -3.97 0.08 0.00 2.00 0.00 0.00 34.13 32.08 1p97 s GLU 112 CO 0.28 -1.21 0.86 0.15 -0.56 0.00 0.00 175.26 174.78 1p97 s LYS 113 N 1.33 3.08 0.00 4.30 1.02 -1.26 -1.75 119.74 126.47 1p97 s LYS 113 Ca 0.06 -1.03 0.24 0.00 0.02 0.00 0.00 55.97 55.26 1p97 s LYS 113 Cb -0.26 -4.24 0.19 0.00 -0.52 0.00 0.00 37.83 32.99 1p97 s LYS 113 CO -0.01 -1.71 1.25 0.09 -0.92 0.00 0.00 175.35 174.05