#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p97 n ALA 2 N 0.00 0.00 0.21 4.61 0.00 -1.26 -5.02 120.51 119.05 1p97 n ALA 2 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.51 1p97 n ALA 2 Cb 0.00 0.00 0.46 0.00 0.00 0.00 0.00 19.45 19.91 1p97 n ALA 2 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1p97 h MET 3 N 0.00 0.00 -5.91 0.00 2.07 -2.08 -3.38 114.93 105.63 1p97 h MET 3 Ca 0.00 0.00 -0.43 0.00 -2.07 0.00 0.00 59.70 57.20 1p97 h MET 3 Cb 0.00 0.00 -0.06 0.00 -1.87 0.00 0.00 31.60 29.67 1p97 h MET 3 CO 0.00 0.29 1.06 -0.51 1.07 0.00 0.00 176.91 178.82 1p97 s ASP 4 N -6.47 5.61 -0.91 1.22 1.01 -1.26 -4.91 116.67 110.97 1p97 s ASP 4 Ca -0.01 -0.71 -0.11 0.00 0.71 0.00 0.00 52.55 52.43 1p97 s ASP 4 Cb 0.12 -2.56 0.24 0.00 1.01 0.00 0.00 42.92 41.73 1p97 s ASP 4 CO 0.66 -2.28 0.86 -0.55 0.21 0.00 0.00 175.17 174.07 1p97 s SER 5 N 6.87 6.78 -1.28 0.27 0.15 -1.26 -4.57 113.70 120.66 1p97 s SER 5 Ca 0.60 -3.09 -0.03 0.00 0.70 0.00 0.00 55.95 54.14 1p97 s SER 5 Cb -0.06 -2.16 -0.00 0.00 -1.71 0.00 0.00 66.02 62.09 1p97 s SER 5 CO 0.01 -0.43 0.69 0.29 1.20 0.00 0.00 173.24 175.00 1p97 n LYS 6 N 3.38 -4.14 -4.31 5.44 5.02 -1.26 -3.79 118.16 118.50 1p97 n LYS 6 Ca 0.17 0.59 -0.34 0.00 -2.02 0.00 0.00 58.31 56.71 1p97 n LYS 6 Cb 0.43 -5.01 -0.14 0.00 -0.02 0.00 0.00 35.03 30.28 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 -3.67 3.07 -0.02 -0.18 2.01 -1.26 -1.12 115.64 114.47 1p97 s THR 7 Ca 0.08 -0.62 0.03 0.00 0.31 0.00 0.00 61.69 61.49 1p97 s THR 7 Cb -0.02 -2.34 0.00 0.00 0.01 0.00 0.00 72.50 70.15 1p97 s THR 7 CO 0.82 0.48 -0.10 0.72 -0.69 0.00 0.00 174.62 175.86 1p97 s PHE 8 N 0.96 1.01 0.35 4.92 -0.71 -0.93 -4.96 117.98 118.61 1p97 s PHE 8 Ca -0.02 -0.25 -0.27 0.00 -1.04 0.00 0.00 56.93 55.36 1p97 s PHE 8 Cb -0.15 -0.71 -0.09 0.00 -1.21 0.00 0.00 43.02 40.86 1p97 s PHE 8 CO -0.01 -0.09 1.19 -1.17 -1.34 0.00 0.00 175.22 173.80 1p97 s LEU 9 N 0.10 4.36 0.17 -1.99 1.98 -1.26 -2.78 118.68 119.25 1p97 s LEU 9 Ca -0.02 2.42 -0.05 0.00 -2.89 0.00 0.00 54.13 53.58 1p97 s LEU 9 Cb -0.08 -3.81 -0.02 0.00 0.66 0.00 0.00 46.19 42.94 1p97 s LEU 9 CO 0.00 -0.48 0.20 -0.44 -1.89 0.00 0.00 176.35 173.74 1p97 s SER 10 N -0.89 0.13 -0.08 3.68 0.01 0.64 -0.78 113.70 116.42 1p97 s SER 10 Ca 0.51 -1.08 -0.22 0.00 1.31 0.00 0.00 55.95 56.47 1p97 s SER 10 Cb -0.33 0.40 0.05 0.00 0.21 0.00 0.00 66.02 66.34 1p97 s SER 10 CO 0.43 -0.85 0.52 0.00 0.41 0.00 0.00 173.24 173.75 1p97 s ARG 11 N -4.03 0.81 0.36 12.44 1.70 0.23 -0.30 118.95 130.16 1p97 s ARG 11 Ca 0.24 0.26 0.07 0.00 -0.47 0.00 0.00 55.73 55.83 1p97 s ARG 11 Cb 0.05 0.38 -0.07 0.00 -0.57 0.00 0.00 34.95 34.74 1p97 s ARG 11 CO 0.04 -0.21 -0.01 -1.01 -1.08 0.00 0.00 175.30 173.03 1p97 s HIS 12 N -0.80 2.29 0.36 5.89 3.76 0.13 -0.76 115.29 126.15 1p97 s HIS 12 Ca -0.09 -0.70 0.01 0.00 -0.15 0.00 0.00 55.06 54.14 1p97 s HIS 12 Cb -0.03 -1.49 0.07 0.00 1.11 0.00 0.00 32.58 32.24 1p97 s HIS 12 CO 0.05 0.36 0.49 -1.13 -0.85 0.00 0.00 174.74 173.67 1p97 n SER 13 N -0.81 0.82 0.11 1.40 3.41 -1.26 -0.11 113.62 117.17 1p97 n SER 13 Ca -0.04 -1.66 0.19 0.00 -0.26 0.00 0.00 58.87 57.10 1p97 n SER 13 Cb 0.66 -0.30 0.76 0.00 -0.26 0.00 0.00 64.21 65.06 1p97 n SER 13 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 1p97 h MET 14 N 0.00 0.00 0.00 4.33 4.05 -1.81 -0.42 114.93 121.09 1p97 h MET 14 Ca -0.16 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.26 1p97 h MET 14 Cb 0.64 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.44 1p97 h MET 14 CO 0.19 0.00 -0.32 0.22 0.23 0.00 0.00 176.91 177.23 1p97 h ASP 15 N 0.00 0.00 -5.39 1.39 3.58 -1.93 -3.49 116.42 110.59 1p97 h ASP 15 Ca 0.17 -0.02 -0.25 0.00 0.42 0.00 0.00 57.03 57.35 1p97 h ASP 15 Cb 0.88 0.00 0.19 0.00 1.72 0.00 0.00 39.33 42.11 1p97 h ASP 15 CO -0.00 0.01 -0.81 0.80 -2.88 0.00 0.00 179.24 176.35 1p97 n MET 16 N -2.82 -2.92 -0.07 0.28 0.00 -0.17 -4.99 117.12 106.42 1p97 n MET 16 Ca 0.03 0.83 -0.10 0.00 -0.00 0.00 0.00 57.70 58.47 1p97 n MET 16 Cb 0.52 -5.69 -0.03 0.00 0.00 0.00 0.00 33.22 28.01 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 -3.32 0.41 0.00 2.12 2.85 -1.26 -4.34 118.16 114.62 1p97 n LYS 17 Ca -0.11 0.17 0.00 0.00 -1.05 0.00 0.00 58.31 57.32 1p97 n LYS 17 Cb 0.62 -1.22 0.00 0.00 -0.65 0.00 0.00 35.03 33.79 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 -4.18 0.00 0.27 5.58 3.72 -1.25 -2.45 117.46 119.15 1p97 n PHE 18 Ca -0.17 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.31 1p97 n PHE 18 Cb 0.47 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.91 1p97 n PHE 18 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1p97 n THR 19 N 0.00 0.00 -3.74 4.37 -1.04 0.06 -0.23 114.28 113.70 1p97 n THR 19 Ca 0.00 -0.27 -0.12 0.00 -2.04 0.00 0.00 64.05 61.62 1p97 n THR 19 Cb 0.00 0.50 -0.11 0.00 -1.82 0.00 0.00 70.33 68.89 1p97 n THR 19 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 1p97 s TYR 20 N -2.77 -0.41 -0.03 -1.42 5.04 0.01 -4.86 117.35 112.91 1p97 s TYR 20 Ca -0.01 0.95 0.01 0.00 -2.44 0.00 0.00 57.07 55.58 1p97 s TYR 20 Cb 0.10 0.14 0.02 0.00 0.35 0.00 0.00 41.96 42.57 1p97 s TYR 20 CO 0.61 -0.22 -0.04 0.00 -1.34 0.00 0.00 175.55 174.56 1p97 s ASP 22 N 0.76 4.71 0.44 0.00 2.15 0.04 -4.69 116.67 120.08 1p97 s ASP 22 Ca -0.09 1.85 0.13 0.00 0.43 0.00 0.00 52.55 54.87 1p97 s ASP 22 Cb -0.13 -2.53 0.97 0.00 -0.30 0.00 0.00 42.92 40.94 1p97 s ASP 22 CO -0.00 -1.90 1.99 -0.78 -0.17 0.00 0.00 175.17 174.31 1p97 h ASP 23 N -0.82 0.07 -0.07 -0.34 3.58 -2.00 -2.22 116.42 114.63 1p97 h ASP 23 Ca -0.44 -0.01 0.02 0.00 0.42 0.00 0.00 57.03 57.02 1p97 h ASP 23 Cb 1.23 -0.02 -0.00 0.00 1.72 0.00 0.00 39.33 42.26 1p97 h ASP 23 CO 0.52 0.22 0.17 0.03 -2.88 0.00 0.00 179.24 177.31 1p97 h ARG 24 N 0.08 0.00 -0.02 0.28 3.08 -1.95 -2.24 114.38 113.60 1p97 h ARG 24 Ca 0.02 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 1p97 h ARG 24 Cb 0.29 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.33 1p97 h ARG 24 CO 0.02 0.00 -0.02 0.97 -1.07 0.00 0.00 179.97 179.87 1p97 h ILE 25 N 0.00 1.03 -0.88 2.04 2.10 -1.72 -0.49 117.51 119.58 1p97 h ILE 25 Ca 0.03 -0.12 0.18 0.00 1.08 0.00 0.00 64.86 66.04 1p97 h ILE 25 Cb 0.38 1.03 -0.11 0.00 -1.09 0.00 0.00 36.82 37.03 1p97 h ILE 25 CO -0.00 0.04 0.44 0.71 -1.08 0.00 0.00 178.15 178.25 1p97 h THR 26 N 0.03 0.62 0.00 2.19 1.35 -1.33 0.32 112.91 116.08 1p97 h THR 26 Ca 0.01 -0.19 -0.12 0.00 -0.55 0.00 0.00 66.41 65.56 1p97 h THR 26 Cb 0.05 0.03 -0.02 0.00 -1.73 0.00 0.00 68.15 66.48 1p97 h THR 26 CO 0.00 0.10 -0.85 -0.33 -0.25 0.00 0.00 175.52 174.19 1p97 h GLU 27 N 0.54 0.00 0.00 4.72 4.39 -1.32 -3.04 114.58 119.87 1p97 h GLU 27 Ca 0.52 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 60.08 1p97 h GLU 27 Cb 0.85 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.48 1p97 h GLU 27 CO -0.43 0.39 -1.14 1.28 -1.16 0.00 0.00 179.01 177.95 1p97 n LEU 28 N -3.07 1.87 -0.15 1.33 4.77 -0.47 -4.57 117.00 116.70 1p97 n LEU 28 Ca -0.02 0.47 0.08 0.00 -0.03 0.00 0.00 56.01 56.51 1p97 n LEU 28 Cb 0.76 -0.87 -0.06 0.00 -2.33 0.00 0.00 43.42 40.93 1p97 n LEU 28 CO 0.41 -0.06 0.08 -0.38 -1.33 0.00 0.00 177.39 176.12 1p97 n ILE 29 N -4.48 0.00 0.00 -0.08 2.08 0.99 -4.93 119.36 112.94 1p97 n ILE 29 Ca -0.23 -0.20 0.00 0.00 0.56 0.00 0.00 62.75 62.88 1p97 n ILE 29 Cb 0.53 1.08 0.00 0.00 -0.75 0.00 0.00 39.64 40.50 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 1.30 3.08 3.36 7.39 0.00 -0.67 -0.49 105.19 119.16 1p97 n GLY 30 Ca 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.69 -3.84 -3.86 1.61 4.01 -1.26 -4.81 117.16 107.33 1p97 n TYR 31 Ca 0.00 -1.11 -0.31 0.00 -0.16 0.00 0.00 57.90 56.32 1p97 n TYR 31 Cb 0.00 -0.85 -0.04 0.00 -0.31 0.00 0.00 39.34 38.14 1p97 n TYR 31 CO 0.00 0.00 0.00 -1.01 -0.46 0.00 0.00 176.86 175.39 1p97 s HIS 32 N -3.39 3.51 0.28 -0.72 3.76 -1.26 -3.10 115.29 114.37 1p97 s HIS 32 Ca 0.64 0.32 0.02 0.00 -0.15 0.00 0.00 55.06 55.89 1p97 s HIS 32 Cb -0.02 -1.82 0.66 0.00 1.11 0.00 0.00 32.58 32.51 1p97 s HIS 32 CO 0.45 0.54 1.72 -1.35 -0.85 0.00 0.00 174.74 175.25 1p97 h PRO 33 N 2.93 0.47 0.00 8.40 0.11 -1.84 0.18 132.00 142.26 1p97 h PRO 33 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1p97 h PRO 33 Cb 1.16 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1p97 h PRO 33 CO 0.75 0.31 0.00 0.93 -0.21 0.00 0.00 178.00 179.78 1p97 h GLU 34 N 0.48 0.00 0.04 1.05 3.07 -1.94 -2.38 114.58 114.91 1p97 h GLU 34 Ca 0.52 0.00 -0.25 0.00 -0.50 0.00 0.00 59.36 59.14 1p97 h GLU 34 Cb 0.91 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.80 1p97 h GLU 34 CO -0.47 0.00 -1.21 0.93 -1.40 0.00 0.00 179.01 176.86 1p97 h GLU 35 N 0.00 0.09 0.00 2.33 3.07 -1.03 -3.22 114.58 115.82 1p97 h GLU 35 Ca 0.00 -0.16 -0.13 0.00 -0.50 0.00 0.00 59.36 58.56 1p97 h GLU 35 Cb 0.56 0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.51 1p97 h GLU 35 CO 0.00 1.00 -1.10 -0.07 -1.40 0.00 0.00 179.01 177.44 1p97 h LEU 36 N 0.03 0.00 -8.31 1.33 4.07 -1.24 -3.45 115.31 107.74 1p97 h LEU 36 Ca -0.10 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.81 1p97 h LEU 36 Cb 1.88 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.61 1p97 h LEU 36 CO 0.14 0.50 0.23 0.18 -1.08 0.00 0.00 178.44 178.42 1p97 n LEU 37 N -2.97 1.52 0.00 1.67 4.77 -0.91 -1.84 117.00 119.23 1p97 n LEU 37 Ca -0.05 -1.38 0.00 0.00 -0.03 0.00 0.00 56.01 54.54 1p97 n LEU 37 Cb 0.78 -1.56 0.00 0.00 -2.33 0.00 0.00 43.42 40.31 1p97 n LEU 37 CO 0.42 -2.51 0.00 0.61 -1.33 0.00 0.00 177.39 174.58 1p97 n GLY 38 N 6.68 1.88 3.05 -0.72 0.00 0.68 -4.99 105.19 111.78 1p97 n GLY 38 Ca 0.49 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.28 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 -0.65 1.37 -0.90 1.61 1.70 -0.77 -5.00 118.95 116.31 1p97 s ARG 39 Ca 0.00 -0.43 -0.26 0.00 -0.47 0.00 0.00 55.73 54.57 1p97 s ARG 39 Cb 0.00 -1.21 -0.21 0.00 -0.57 0.00 0.00 34.95 32.96 1p97 s ARG 39 CO 0.00 0.15 2.38 0.43 -1.08 0.00 0.00 175.30 177.17 1p97 n SER 40 N 3.31 0.08 -0.21 -2.89 7.64 -1.26 -3.83 113.62 116.46 1p97 n SER 40 Ca -0.19 0.09 0.01 0.00 1.01 0.00 0.00 58.87 59.79 1p97 n SER 40 Cb 0.53 -0.79 0.12 0.00 -1.01 0.00 0.00 64.21 63.06 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 10.71 0.82 0.00 -0.43 0.00 -1.68 -3.14 119.26 125.54 1p97 h ALA 41 Ca -0.04 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1p97 h ALA 41 Cb 1.16 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1p97 h ALA 41 CO 1.28 -0.20 0.14 0.66 0.00 0.00 0.00 179.25 181.13 1p97 n TYR 42 N -5.00 0.02 0.18 0.00 4.01 -1.26 0.06 117.16 115.16 1p97 n TYR 42 Ca 0.09 0.01 -0.07 0.00 -0.16 0.00 0.00 57.90 57.77 1p97 n TYR 42 Cb 0.29 -0.38 -0.03 0.00 -0.31 0.00 0.00 39.34 38.91 1p97 n TYR 42 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 1p97 h GLU 43 N 0.00 -0.44 0.00 -0.72 5.08 -1.95 -3.35 114.58 113.20 1p97 h GLU 43 Ca 0.00 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1p97 h GLU 43 Cb 0.27 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1p97 h GLU 43 CO 0.00 -0.30 -0.49 1.97 -1.00 0.00 0.00 179.01 179.19 1p97 n PHE 44 N -3.62 0.63 -1.03 4.33 -1.74 -0.48 -4.73 117.46 110.82 1p97 n PHE 44 Ca -0.06 0.18 -0.39 0.00 -0.56 0.00 0.00 57.45 56.62 1p97 n PHE 44 Cb 0.18 -0.71 -0.09 0.00 1.52 0.00 0.00 39.48 40.38 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 -2.13 1.07 -1.78 2.97 9.36 0.11 -2.86 117.16 123.89 1p97 n TYR 45 Ca 0.04 -1.04 0.00 0.00 3.32 0.00 0.00 57.90 60.22 1p97 n TYR 45 Cb 0.44 -1.51 0.00 0.00 -0.63 0.00 0.00 39.34 37.64 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 10.30 -2.85 0.40 2.98 8.25 -1.24 -3.71 115.22 129.34 1p97 n HIS 46 Ca 0.47 1.70 -0.17 0.00 -0.26 0.00 0.00 57.72 59.46 1p97 n HIS 46 Cb 0.42 -3.09 -0.08 0.00 1.12 0.00 0.00 29.99 28.36 1p97 n HIS 46 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1p97 h ALA 47 N 2.51 -1.25 0.00 -1.41 0.00 -1.80 -1.37 119.26 115.94 1p97 h ALA 47 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1p97 h ALA 47 Cb 0.00 0.50 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1p97 h ALA 47 CO 0.00 -1.20 -1.23 1.47 0.00 0.00 0.00 179.25 178.29 1p97 n LEU 48 N -5.06 0.56 -0.87 0.00 -0.00 -1.26 -4.23 117.00 106.13 1p97 n LEU 48 Ca -0.13 0.09 0.12 0.00 -0.00 0.00 0.00 56.01 56.09 1p97 n LEU 48 Cb 0.44 -0.06 0.23 0.00 -0.00 0.00 0.00 43.42 44.03 1p97 n LEU 48 CO 0.31 -0.04 0.71 0.47 -0.00 0.00 0.00 177.39 178.84 1p97 n ASP 49 N -2.25 2.68 -0.02 1.45 9.92 -1.23 -4.20 116.55 122.88 1p97 n ASP 49 Ca 0.00 -1.87 -0.09 0.00 -0.53 0.00 0.00 54.79 52.30 1p97 n ASP 49 Cb 0.50 -0.06 -0.03 0.00 -0.64 0.00 0.00 41.12 40.89 1p97 n ASP 49 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 1p97 h SER 50 N 3.97 -0.20 -0.80 -2.24 0.87 -1.32 -2.49 113.55 111.34 1p97 h SER 50 Ca 0.00 0.06 0.11 0.00 -1.23 0.00 0.00 61.79 60.73 1p97 h SER 50 Cb 0.85 0.12 -0.08 0.00 -0.44 0.00 0.00 62.40 62.85 1p97 h SER 50 CO 0.00 -0.08 0.42 -0.08 -0.53 0.00 0.00 176.83 176.56 1p97 h GLU 51 N -0.03 0.65 -0.73 2.24 4.81 -1.85 0.26 114.58 119.93 1p97 h GLU 51 Ca 0.08 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.32 1p97 h GLU 51 Cb 0.16 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.34 1p97 h GLU 51 CO -0.19 0.43 0.45 -0.91 -0.73 0.00 0.00 179.01 178.06 1p97 h ASN 52 N 0.67 0.71 0.27 1.04 4.21 -1.72 0.23 115.58 120.99 1p97 h ASN 52 Ca 0.41 0.01 -0.12 0.00 1.21 0.00 0.00 56.30 57.80 1p97 h ASN 52 Cb 0.47 -0.14 -0.01 0.00 -1.12 0.00 0.00 38.32 37.52 1p97 h ASN 52 CO -0.30 0.47 -0.49 -0.03 -1.29 0.00 0.00 177.43 175.80 1p97 h MET 53 N 0.85 0.26 -0.83 0.81 4.05 -0.65 -0.78 114.93 118.63 1p97 h MET 53 Ca 0.31 -0.14 0.00 0.00 -0.28 0.00 0.00 59.70 59.59 1p97 h MET 53 Cb 0.10 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 30.87 1p97 h MET 53 CO -0.14 0.69 0.53 1.15 0.23 0.00 0.00 176.91 179.37 1p97 h THR 54 N 0.20 1.22 -0.14 -0.77 2.02 0.12 0.43 112.91 116.00 1p97 h THR 54 Ca 0.01 -0.45 -0.10 0.00 0.77 0.00 0.00 66.41 66.64 1p97 h THR 54 Cb 0.94 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 1p97 h THR 54 CO 0.08 0.22 -0.35 0.11 0.37 0.00 0.00 175.52 175.96 1p97 h LYS 55 N 1.14 0.29 -0.57 6.66 6.56 -0.27 -0.42 116.57 129.96 1p97 h LYS 55 Ca 0.30 -0.12 -0.08 0.00 -1.06 0.00 0.00 60.65 59.69 1p97 h LYS 55 Cb -0.09 -0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 31.54 1p97 h LYS 55 CO -0.06 0.61 0.04 0.77 -2.06 0.00 0.00 179.45 178.75 1p97 h SER 56 N 0.25 0.92 -0.35 0.86 0.02 -0.16 -0.08 113.55 115.00 1p97 h SER 56 Ca 0.03 -0.22 -0.05 0.00 -0.84 0.00 0.00 61.79 60.70 1p97 h SER 56 Cb 0.74 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.02 1p97 h SER 56 CO 0.06 0.95 0.01 -0.74 -1.14 0.00 0.00 176.83 175.97 1p97 h HIS 57 N 0.89 0.66 0.00 3.45 -0.00 0.31 0.23 115.15 120.69 1p97 h HIS 57 Ca 0.17 -0.11 -0.04 0.00 -0.00 0.00 0.00 60.37 60.39 1p97 h HIS 57 Cb 0.46 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 27.69 1p97 h HIS 57 CO 0.03 0.71 -0.20 -0.56 -0.00 0.00 0.00 177.93 177.91 1p97 h GLN 58 N 0.43 0.00 0.00 5.26 3.07 -0.89 -1.76 115.11 121.23 1p97 h GLN 58 Ca 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.82 1p97 h GLN 58 Cb 0.43 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.99 1p97 h GLN 58 CO 0.02 0.20 -0.18 -0.97 0.09 0.00 0.00 178.83 177.98 1p97 h ASN 59 N 0.00 0.00 0.14 0.06 -1.24 -0.76 -3.37 115.58 110.41 1p97 h ASN 59 Ca -0.00 -0.39 -0.03 0.00 0.71 0.00 0.00 56.30 56.59 1p97 h ASN 59 Cb 0.59 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.64 1p97 h ASN 59 CO 0.03 0.80 -0.12 0.25 -1.29 0.00 0.00 177.43 177.09 1p97 h LEU 60 N -1.00 0.00 -2.41 0.34 5.85 -0.52 -2.76 115.31 114.81 1p97 h LEU 60 Ca -0.03 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.71 1p97 h LEU 60 Cb 0.53 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 1p97 h LEU 60 CO -0.02 0.12 0.13 0.00 -0.34 0.00 0.00 178.44 178.34 1p97 n THR 62 N -3.55 0.00 -0.01 0.00 -1.04 -1.06 -4.74 114.28 103.87 1p97 n THR 62 Ca -0.01 -0.46 -0.01 0.00 -2.04 0.00 0.00 64.05 61.54 1p97 n THR 62 Cb 0.23 0.70 -0.02 0.00 -1.82 0.00 0.00 70.33 69.41 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 0.23 3.01 0.00 -2.82 4.76 -1.04 -5.01 118.16 117.28 1p97 n LYS 63 Ca 0.01 -0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1p97 n LYS 63 Cb 0.89 -1.07 0.00 0.00 -1.84 0.00 0.00 35.03 33.01 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 2.75 2.46 3.43 0.72 0.00 -1.04 -4.97 105.19 108.54 1p97 n GLY 64 Ca -0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.40 0.92 -0.07 1.61 0.74 -1.26 -1.86 119.66 119.34 1p97 s GLN 65 Ca 0.00 0.15 -0.24 0.00 0.05 0.00 0.00 55.36 55.32 1p97 s GLN 65 Cb 0.00 0.43 0.05 0.00 1.10 0.00 0.00 33.01 34.59 1p97 s GLN 65 CO 0.00 -0.27 0.56 0.54 -0.55 0.00 0.00 175.29 175.57 1p97 s VAL 66 N -1.14 0.02 -0.41 1.34 0.11 -0.35 -4.61 120.40 115.35 1p97 s VAL 66 Ca -0.11 -0.14 0.03 0.00 -2.93 0.00 0.00 61.98 58.83 1p97 s VAL 66 Cb -0.02 -0.86 0.12 0.00 -1.53 0.00 0.00 36.38 34.09 1p97 s VAL 66 CO 0.08 -0.08 0.16 0.68 -3.33 0.00 0.00 175.10 172.61 1p97 s VAL 67 N -0.97 1.99 0.44 2.04 -7.23 -1.26 0.34 120.40 115.75 1p97 s VAL 67 Ca -0.10 -2.56 -0.22 0.00 -1.81 0.00 0.00 61.98 57.29 1p97 s VAL 67 Cb -0.02 -2.43 -0.09 0.00 0.56 0.00 0.00 36.38 34.40 1p97 s VAL 67 CO 0.07 -0.74 1.05 -0.55 -0.31 0.00 0.00 175.10 174.62 1p97 s SER 68 N 0.51 6.54 0.29 4.85 0.15 0.13 -4.96 113.70 121.21 1p97 s SER 68 Ca 0.14 2.00 -0.06 0.00 0.70 0.00 0.00 55.95 58.73 1p97 s SER 68 Cb -0.22 -2.57 -0.05 0.00 -1.71 0.00 0.00 66.02 61.46 1p97 s SER 68 CO -0.06 -0.64 0.57 -0.83 1.20 0.00 0.00 173.24 173.47 1p97 s GLY 69 N -1.75 1.92 -0.09 9.45 0.00 -1.26 -2.91 107.32 112.68 1p97 s GLY 69 Ca 0.62 -0.50 -0.36 0.00 0.00 0.00 0.00 44.72 44.48 1p97 s GLY 69 CO 0.24 -0.38 1.74 0.61 0.00 0.00 0.00 173.10 175.31 1p97 n GLN 70 N -0.86 1.78 -4.64 2.90 10.64 -1.23 -4.63 117.38 121.34 1p97 n GLN 70 Ca -0.01 0.65 -0.29 0.00 -1.83 0.00 0.00 57.00 55.52 1p97 n GLN 70 Cb 0.54 -2.42 -0.09 0.00 -0.86 0.00 0.00 30.24 27.41 1p97 n GLN 70 CO 0.00 0.00 0.00 1.52 -1.83 0.00 0.00 177.06 176.75 1p97 s TYR 71 N 3.10 2.03 -0.33 2.61 -0.85 0.67 -4.75 117.35 119.82 1p97 s TYR 71 Ca 0.91 -0.94 -0.18 0.00 -0.52 0.00 0.00 57.07 56.34 1p97 s TYR 71 Cb -0.82 -1.53 -0.01 0.00 0.38 0.00 0.00 41.96 39.98 1p97 s TYR 71 CO 0.53 0.16 0.53 1.03 -1.52 0.00 0.00 175.55 176.28 1p97 s ARG 72 N -3.81 3.73 -0.12 -3.49 0.52 -1.26 -0.38 118.95 114.14 1p97 s ARG 72 Ca 0.20 -0.03 -0.04 0.00 -0.52 0.00 0.00 55.73 55.34 1p97 s ARG 72 Cb 0.05 -3.77 -0.03 0.00 0.52 0.00 0.00 34.95 31.71 1p97 s ARG 72 CO 0.10 -0.59 0.02 1.41 0.02 0.00 0.00 175.30 176.27 1p97 s MET 73 N 2.42 3.33 -0.08 3.54 1.75 0.56 -3.63 119.30 127.20 1p97 s MET 73 Ca 0.20 -0.38 -0.30 0.00 -1.25 0.00 0.00 55.69 53.96 1p97 s MET 73 Cb -0.15 -2.94 -0.03 0.00 2.84 0.00 0.00 34.83 34.55 1p97 s MET 73 CO 0.13 0.56 1.30 -1.17 -0.65 0.00 0.00 175.02 175.18 1p97 s LEU 74 N -0.46 4.26 0.52 4.11 2.96 -1.14 -1.32 118.68 127.62 1p97 s LEU 74 Ca 0.09 1.87 -0.06 0.00 -0.22 0.00 0.00 54.13 55.81 1p97 s LEU 74 Cb -0.12 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.99 1p97 s LEU 74 CO 0.02 -0.69 0.84 0.00 -1.32 0.00 0.00 176.35 175.20 1p97 s ALA 75 N 2.79 3.34 0.51 5.97 0.00 0.11 -4.88 121.76 129.59 1p97 s ALA 75 Ca 0.58 -0.49 0.37 0.00 0.00 0.00 0.00 51.96 52.42 1p97 s ALA 75 Cb -0.26 -2.66 1.53 0.00 0.00 0.00 0.00 23.12 21.74 1p97 s ALA 75 CO 0.21 -0.50 1.71 -0.22 0.00 0.00 0.00 175.76 176.96 1p97 h LYS 76 N 0.06 0.06 -0.63 0.00 3.64 -1.11 -0.91 116.57 117.68 1p97 h LYS 76 Ca -0.46 -0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 58.56 1p97 h LYS 76 Cb 1.21 -0.01 -0.21 0.00 -0.41 0.00 0.00 32.23 32.81 1p97 h LYS 76 CO 0.61 0.04 0.17 -2.39 -2.27 0.00 0.00 179.45 175.61 1p97 n HIS 77 N -4.26 2.01 -1.11 1.91 1.44 -1.26 -4.84 115.22 109.11 1p97 n HIS 77 Ca 0.33 -1.88 -0.04 0.00 -2.01 0.00 0.00 57.72 54.12 1p97 n HIS 77 Cb 1.44 -0.71 -0.02 0.00 0.12 0.00 0.00 29.99 30.82 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 -1.08 0.66 3.88 -1.39 0.00 -0.36 -4.99 105.19 101.92 1p97 n GLY 78 Ca 0.45 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.67 1.62 -0.04 -0.02 0.00 -1.14 -3.79 107.32 101.27 1p97 s GLY 79 Ca 0.00 -0.42 -0.02 0.00 0.00 0.00 0.00 44.72 44.28 1p97 s GLY 79 CO 0.00 -0.01 0.05 -0.19 0.00 0.00 0.00 173.10 172.95 1p97 s TYR 80 N -3.41 0.14 0.01 1.90 2.02 0.13 0.04 117.35 118.18 1p97 s TYR 80 Ca 0.59 0.20 0.08 0.00 -0.37 0.00 0.00 57.07 57.58 1p97 s TYR 80 Cb -0.11 -0.52 -0.02 0.00 -0.40 0.00 0.00 41.96 40.90 1p97 s TYR 80 CO 0.51 -0.21 -0.25 0.14 -1.57 0.00 0.00 175.55 174.18 1p97 s VAL 81 N 2.15 2.23 -0.36 0.71 -7.23 -0.43 0.46 120.40 117.93 1p97 s VAL 81 Ca 0.05 -1.20 -0.26 0.00 -1.81 0.00 0.00 61.98 58.76 1p97 s VAL 81 Cb -0.12 -1.83 0.01 0.00 0.56 0.00 0.00 36.38 35.00 1p97 s VAL 81 CO -0.03 0.48 0.93 0.26 -0.31 0.00 0.00 175.10 176.42 1p97 s TRP 82 N -0.73 3.10 0.00 2.82 0.52 -1.23 -0.32 118.94 123.10 1p97 s TRP 82 Ca 0.11 0.81 0.07 0.00 0.02 0.00 0.00 56.10 57.11 1p97 s TRP 82 Cb -0.10 -3.61 -0.02 0.00 -1.15 0.00 0.00 33.47 28.59 1p97 s TRP 82 CO 0.01 -0.80 -0.22 -0.51 0.02 0.00 0.00 176.95 175.45 1p97 s LEU 83 N 3.44 2.08 -0.11 2.99 1.02 0.49 0.19 118.68 128.77 1p97 s LEU 83 Ca 0.38 -0.44 -0.03 0.00 0.02 0.00 0.00 54.13 54.07 1p97 s LEU 83 Cb -0.12 -1.11 -0.03 0.00 0.02 0.00 0.00 46.19 44.95 1p97 s LEU 83 CO 0.18 0.25 -0.01 -0.70 0.02 0.00 0.00 176.35 176.08 1p97 s GLU 84 N -0.71 3.27 -0.27 1.70 2.12 -0.71 -0.24 118.70 123.86 1p97 s GLU 84 Ca 0.08 -0.45 0.00 0.00 0.36 0.00 0.00 54.97 54.97 1p97 s GLU 84 Cb -0.09 -2.85 0.05 0.00 0.26 0.00 0.00 34.13 31.50 1p97 s GLU 84 CO -0.00 0.52 -0.06 0.99 -0.54 0.00 0.00 175.26 176.16 1p97 s THR 85 N -0.37 2.60 -0.54 -1.70 2.01 -1.15 -0.94 115.64 115.56 1p97 s THR 85 Ca 0.07 -1.42 -0.26 0.00 0.31 0.00 0.00 61.69 60.39 1p97 s THR 85 Cb -0.12 -2.47 0.03 0.00 0.01 0.00 0.00 72.50 69.96 1p97 s THR 85 CO 0.02 -0.00 1.02 -1.58 -0.69 0.00 0.00 174.62 173.39 1p97 s GLN 86 N 1.20 3.45 0.18 4.92 0.74 0.68 0.18 119.66 131.01 1p97 s GLN 86 Ca -0.06 0.02 0.07 0.00 0.05 0.00 0.00 55.36 55.45 1p97 s GLN 86 Cb -0.19 -4.01 -0.04 0.00 1.10 0.00 0.00 33.01 29.87 1p97 s GLN 86 CO -0.04 -1.49 0.01 0.20 -0.55 0.00 0.00 175.29 173.43 1p97 s GLY 87 N 2.74 1.71 -0.19 2.59 0.00 0.15 -0.45 107.32 113.87 1p97 s GLY 87 Ca 0.36 -1.38 -0.16 0.00 0.00 0.00 0.00 44.72 43.54 1p97 s GLY 87 CO 0.23 -1.40 0.51 -1.59 0.00 0.00 0.00 173.10 170.85 1p97 s THR 88 N -1.78 -0.01 -0.29 0.90 2.01 -0.68 -1.21 115.64 114.59 1p97 s THR 88 Ca 0.28 0.02 -0.10 0.00 0.31 0.00 0.00 61.69 62.20 1p97 s THR 88 Cb -0.09 -0.72 -0.03 0.00 0.01 0.00 0.00 72.50 71.67 1p97 s THR 88 CO 0.19 0.01 0.16 -0.69 -0.69 0.00 0.00 174.62 173.59 1p97 s VAL 89 N 0.62 4.87 -0.43 3.82 1.01 -0.78 -0.11 120.40 129.40 1p97 s VAL 89 Ca -0.03 -0.11 -0.23 0.00 0.00 0.00 0.00 61.98 61.61 1p97 s VAL 89 Cb -0.05 -3.37 0.02 0.00 0.00 0.00 0.00 36.38 32.98 1p97 s VAL 89 CO -0.04 0.20 0.76 -0.51 0.00 0.00 0.00 175.10 175.50 1p97 s ILE 90 N 1.68 4.70 0.37 2.22 2.07 -0.06 -4.82 121.20 127.36 1p97 s ILE 90 Ca 0.06 0.46 -0.08 0.00 -1.41 0.00 0.00 60.65 59.67 1p97 s ILE 90 Cb -0.16 -4.28 -0.06 0.00 0.13 0.00 0.00 42.46 38.09 1p97 s ILE 90 CO 0.08 -0.64 0.70 -0.31 -1.91 0.00 0.00 174.94 172.86 1p97 s TYR 91 N 3.17 3.48 0.12 3.50 1.51 -1.26 -0.56 117.35 127.30 1p97 s TYR 91 Ca 0.29 0.90 -0.31 0.00 -1.01 0.00 0.00 57.07 56.94 1p97 s TYR 91 Cb -0.13 -2.33 -0.09 0.00 -0.11 0.00 0.00 41.96 39.31 1p97 s TYR 91 CO 0.21 -0.02 1.60 1.21 -1.11 0.00 0.00 175.55 177.44 1p97 s ASN 92 N -3.20 6.60 0.24 2.29 3.84 0.53 -4.62 114.94 120.61 1p97 s ASN 92 Ca 0.49 2.54 -0.04 0.00 0.21 0.00 0.00 52.86 56.06 1p97 s ASN 92 Cb -0.10 -2.58 0.25 0.00 -0.55 0.00 0.00 41.25 38.27 1p97 s ASN 92 CO 0.31 -0.85 1.73 1.55 -2.79 0.00 0.00 177.10 177.06 1p97 h PRO 93 N 7.54 0.89 0.05 0.43 0.13 -1.96 0.49 132.00 139.59 1p97 h PRO 93 Ca -0.43 -0.25 -0.33 0.00 -0.87 0.00 0.00 66.00 64.13 1p97 h PRO 93 Cb 1.20 -0.10 -0.04 0.00 0.13 0.00 0.00 31.00 32.19 1p97 h PRO 93 CO 0.92 0.88 -1.86 2.89 -0.23 0.00 0.00 178.00 180.60 1p97 n ARG 94 N -4.21 0.69 -0.00 0.86 1.85 -1.26 -4.35 116.66 110.23 1p97 n ARG 94 Ca 0.03 0.27 0.07 0.00 -1.00 0.00 0.00 57.85 57.22 1p97 n ARG 94 Cb 0.30 -1.75 -0.10 0.00 -1.05 0.00 0.00 32.46 29.87 1p97 n ARG 94 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1p97 n ASN 95 N -3.22 1.47 -1.95 2.89 4.13 -1.25 -4.99 115.26 112.34 1p97 n ASN 95 Ca -0.24 -0.22 -0.10 0.00 1.68 0.00 0.00 54.58 55.70 1p97 n ASN 95 Cb 1.05 1.47 -0.02 0.00 -1.54 0.00 0.00 39.78 40.74 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 -1.81 -0.83 -4.89 3.41 4.77 0.17 -4.93 117.00 112.90 1p97 n LEU 96 Ca -0.01 0.25 -0.30 0.00 -0.03 0.00 0.00 56.01 55.92 1p97 n LEU 96 Cb 0.33 -1.79 0.05 0.00 -2.33 0.00 0.00 43.42 39.68 1p97 n LEU 96 CO 0.29 -0.28 0.74 -1.10 -1.33 0.00 0.00 177.39 175.71 1p97 s GLN 97 N -4.09 2.85 -0.50 3.23 -1.52 -1.26 -4.62 119.66 113.75 1p97 s GLN 97 Ca 0.00 0.43 -0.26 0.00 -1.95 0.00 0.00 55.36 53.58 1p97 s GLN 97 Cb 0.00 -2.04 -0.06 0.00 -0.22 0.00 0.00 33.01 30.69 1p97 s GLN 97 CO 0.00 -1.02 2.35 -1.25 -0.25 0.00 0.00 175.29 175.11 1p97 s PRO 98 N -5.34 2.17 0.07 2.91 0.04 -1.26 -0.35 135.00 133.23 1p97 s PRO 98 Ca 0.58 1.33 -0.21 0.00 0.04 0.00 0.00 61.00 62.75 1p97 s PRO 98 Cb -0.11 -4.56 -0.11 0.00 0.04 0.00 0.00 34.50 29.76 1p97 s PRO 98 CO 0.51 -3.21 1.52 0.37 0.04 0.00 0.00 177.00 176.23 1p97 h GLN 99 N 19.03 0.29 -2.72 4.56 5.75 -1.09 -3.37 115.11 137.57 1p97 h GLN 99 Ca -0.25 -0.09 0.10 0.00 -0.15 0.00 0.00 58.65 58.27 1p97 h GLN 99 Cb 1.26 -0.03 -0.07 0.00 1.07 0.00 0.00 27.48 29.70 1p97 h GLN 99 CO 1.16 0.48 0.34 0.00 -2.65 0.00 0.00 178.83 178.16 1p97 s ILE 101 N -3.62 1.49 -0.26 0.00 1.01 0.84 -0.89 121.20 119.77 1p97 s ILE 101 Ca 0.10 -0.66 -0.09 0.00 0.00 0.00 0.00 60.65 60.00 1p97 s ILE 101 Cb -0.04 -1.34 -0.04 0.00 0.01 0.00 0.00 42.46 41.05 1p97 s ILE 101 CO 0.02 0.44 0.13 -0.04 0.00 0.00 0.00 174.94 175.49 1p97 s MET 102 N 0.76 3.81 -0.19 2.79 -1.94 0.84 0.21 119.30 125.58 1p97 s MET 102 Ca -0.12 -0.40 -0.03 0.00 -1.71 0.00 0.00 55.69 53.44 1p97 s MET 102 Cb -0.16 -3.48 -0.01 0.00 2.01 0.00 0.00 34.83 33.19 1p97 s MET 102 CO 0.02 -0.16 -0.06 0.00 -0.01 0.00 0.00 175.02 174.81 1p97 s VAL 104 N 1.04 5.15 -0.08 0.00 1.01 0.40 -0.26 120.40 127.66 1p97 s VAL 104 Ca 0.00 -0.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.66 1p97 s VAL 104 Cb -0.15 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 1p97 s VAL 104 CO -0.00 -0.04 -0.03 0.20 0.00 0.00 0.00 175.10 175.23 1p97 s ASN 105 N 1.69 4.95 -0.29 3.32 0.01 -1.12 -0.23 114.94 123.27 1p97 s ASN 105 Ca 0.06 0.05 0.02 0.00 -0.71 0.00 0.00 52.86 52.28 1p97 s ASN 105 Cb -0.18 -1.36 0.08 0.00 0.41 0.00 0.00 41.25 40.21 1p97 s ASN 105 CO 0.10 0.36 0.01 -0.31 -1.51 0.00 0.00 177.10 175.75 1p97 s TYR 106 N -0.76 2.78 -0.60 2.20 1.51 -0.11 -2.20 117.35 120.18 1p97 s TYR 106 Ca 0.12 -2.23 -0.27 0.00 -1.01 0.00 0.00 57.07 53.68 1p97 s TYR 106 Cb -0.11 -2.10 -0.01 0.00 -0.11 0.00 0.00 41.96 39.63 1p97 s TYR 106 CO 0.02 -0.87 1.71 0.08 -1.11 0.00 0.00 175.55 175.38 1p97 s VAL 107 N 1.25 3.48 0.00 0.71 1.01 -0.28 -1.74 120.40 124.84 1p97 s VAL 107 Ca 0.03 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.34 1p97 s VAL 107 Cb -0.19 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.07 1p97 s VAL 107 CO -0.11 -1.04 0.00 0.18 0.00 0.00 0.00 175.10 174.14 1p97 n LEU 108 N 11.58 0.30 -4.33 3.92 4.77 0.13 -4.57 117.00 128.80 1p97 n LEU 108 Ca 0.17 0.00 -0.46 0.00 -0.03 0.00 0.00 56.01 55.69 1p97 n LEU 108 Cb 0.51 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.55 1p97 n LEU 108 CO 0.71 0.00 0.25 -0.44 -1.33 0.00 0.00 177.39 176.58 1p97 s SER 109 N -1.00 6.28 0.22 -1.43 0.01 -1.20 -4.92 113.70 111.65 1p97 s SER 109 Ca 0.00 -1.85 0.00 0.00 1.31 0.00 0.00 55.95 55.41 1p97 s SER 109 Cb 0.00 -2.23 0.00 0.00 0.21 0.00 0.00 66.02 64.00 1p97 s SER 109 CO 0.00 -0.88 0.00 -0.62 0.41 0.00 0.00 173.24 172.15 1p97 n GLU 110 N 5.32 -1.35 -3.47 12.44 4.71 -1.26 -3.57 120.64 133.46 1p97 n GLU 110 Ca -0.08 1.02 -0.38 0.00 -0.01 0.00 0.00 57.16 57.71 1p97 n GLU 110 Cb 0.42 -1.90 -0.08 0.00 -1.01 0.00 0.00 31.44 28.87 1p97 n GLU 110 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 1p97 s ILE 111 N -3.34 5.25 -0.28 -3.67 1.01 -1.26 -3.91 121.20 114.99 1p97 s ILE 111 Ca 0.00 0.55 0.02 0.00 0.00 0.00 0.00 60.65 61.22 1p97 s ILE 111 Cb 0.00 -3.66 0.07 0.00 0.01 0.00 0.00 42.46 38.88 1p97 s ILE 111 CO 0.00 0.28 -0.05 -0.70 0.00 0.00 0.00 174.94 174.46 1p97 s GLU 112 N 1.26 2.15 -0.52 2.79 2.12 0.17 -4.93 118.70 121.75 1p97 s GLU 112 Ca 0.15 -1.43 -0.03 0.00 0.36 0.00 0.00 54.97 54.02 1p97 s GLU 112 Cb -0.14 -3.02 0.14 0.00 0.26 0.00 0.00 34.13 31.36 1p97 s GLU 112 CO 0.07 -0.65 0.33 0.15 -0.54 0.00 0.00 175.26 174.62 1p97 s LYS 113 N 1.10 2.32 0.00 4.30 3.01 -1.26 0.21 119.74 129.42 1p97 s LYS 113 Ca -0.05 -2.16 0.00 0.00 -1.01 0.00 0.00 55.97 52.75 1p97 s LYS 113 Cb -0.20 -3.69 0.00 0.00 -1.01 0.00 0.00 37.83 32.93 1p97 s LYS 113 CO -0.05 -1.13 0.00 0.09 0.51 0.00 0.00 175.35 174.77