#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 3.21 0.02 4.61 0.00 -1.26 -3.25 120.51 123.84 1p97 n ALA 2 Ca 0.00 -3.46 0.00 0.00 0.00 0.00 0.00 53.44 49.98 1p97 n ALA 2 Cb 0.00 -3.56 0.00 0.00 0.00 0.00 0.00 19.45 15.89 1p97 n ALA 2 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1p97 n MET 3 N 7.73 0.00 0.08 0.00 1.56 -1.26 -4.81 117.12 120.42 1p97 n MET 3 Ca 0.48 0.00 -0.13 0.00 -0.27 0.00 0.00 57.70 57.78 1p97 n MET 3 Cb 0.44 0.00 -0.08 0.00 2.15 0.00 0.00 33.22 35.73 1p97 n MET 3 CO 0.00 0.00 0.00 -0.44 -0.73 0.00 0.00 175.97 174.80 1p97 h ASP 4 N 0.00 -0.17 -3.24 6.12 3.32 -2.00 -3.40 116.42 117.04 1p97 h ASP 4 Ca 0.00 -0.26 -0.58 0.00 0.02 0.00 0.00 57.03 56.21 1p97 h ASP 4 Cb 0.00 0.04 -0.06 0.00 0.22 0.00 0.00 39.33 39.53 1p97 h ASP 4 CO 0.00 0.18 -0.10 -0.94 -1.72 0.00 0.00 179.24 176.66 1p97 s SER 5 N -5.31 6.84 -0.68 6.45 1.04 -1.23 -5.02 113.70 115.79 1p97 s SER 5 Ca -0.15 1.00 -0.25 0.00 0.48 0.00 0.00 55.95 57.04 1p97 s SER 5 Cb 0.03 -2.31 0.05 0.00 0.10 0.00 0.00 66.02 63.88 1p97 s SER 5 CO 0.61 0.13 1.09 -0.54 0.98 0.00 0.00 173.24 175.51 1p97 s LYS 6 N -0.17 3.18 -0.19 4.02 3.01 -1.12 -4.48 119.74 123.98 1p97 s LYS 6 Ca 0.27 -0.51 -0.03 0.00 -1.01 0.00 0.00 55.97 54.70 1p97 s LYS 6 Cb -0.17 -4.18 -0.01 0.00 -1.01 0.00 0.00 37.83 32.46 1p97 s LYS 6 CO 0.14 -1.90 -0.08 0.99 0.51 0.00 0.00 175.35 175.01 1p97 s THR 7 N 4.72 3.26 -0.03 2.17 2.01 -1.25 0.02 115.64 126.52 1p97 s THR 7 Ca 0.29 -0.55 0.03 0.00 0.31 0.00 0.00 61.69 61.76 1p97 s THR 7 Cb -0.13 -2.44 0.00 0.00 0.01 0.00 0.00 72.50 69.95 1p97 s THR 7 CO 0.13 0.46 -0.11 0.72 -0.69 0.00 0.00 174.62 175.14 1p97 s PHE 8 N 1.05 1.15 0.27 4.92 -0.71 -0.89 -4.94 117.98 118.83 1p97 s PHE 8 Ca 0.00 -0.32 -0.29 0.00 -1.04 0.00 0.00 56.93 55.28 1p97 s PHE 8 Cb -0.15 -0.82 -0.09 0.00 -1.21 0.00 0.00 43.02 40.75 1p97 s PHE 8 CO -0.01 -0.14 1.22 -1.17 -1.34 0.00 0.00 175.22 173.78 1p97 s LEU 9 N 0.25 4.47 0.05 -1.99 1.98 -1.26 -2.63 118.68 119.55 1p97 s LEU 9 Ca -0.05 2.43 0.00 0.00 -2.89 0.00 0.00 54.13 53.62 1p97 s LEU 9 Cb -0.10 -3.63 -0.03 0.00 0.66 0.00 0.00 46.19 43.09 1p97 s LEU 9 CO 0.01 -0.37 -0.04 -0.55 -1.89 0.00 0.00 176.35 173.51 1p97 s SER 10 N -0.38 0.58 -0.07 3.68 0.15 -0.25 -1.18 113.70 116.22 1p97 s SER 10 Ca 0.49 -0.83 0.01 0.00 0.70 0.00 0.00 55.95 56.33 1p97 s SER 10 Cb -0.35 0.14 0.02 0.00 -1.71 0.00 0.00 66.02 64.11 1p97 s SER 10 CO 0.44 -0.46 -0.08 -0.13 1.20 0.00 0.00 173.24 174.21 1p97 s ARG 11 N -3.03 1.36 0.12 5.44 1.81 -0.19 -1.32 118.95 123.14 1p97 s ARG 11 Ca 0.00 -0.26 0.04 0.00 -1.72 0.00 0.00 55.73 53.79 1p97 s ARG 11 Cb 0.01 -1.26 -0.04 0.00 -0.45 0.00 0.00 34.95 33.21 1p97 s ARG 11 CO -0.06 -0.08 0.07 -1.01 -0.68 0.00 0.00 175.30 173.54 1p97 s HIS 12 N 1.02 3.09 0.76 -0.53 3.76 0.67 -0.35 115.29 123.72 1p97 s HIS 12 Ca -0.08 0.00 -0.07 0.00 -0.15 0.00 0.00 55.06 54.76 1p97 s HIS 12 Cb -0.15 -1.54 0.12 0.00 1.11 0.00 0.00 32.58 32.12 1p97 s HIS 12 CO -0.00 0.51 1.07 -1.54 -0.85 0.00 0.00 174.74 173.93 1p97 s SER 13 N -2.62 4.27 0.22 1.40 1.04 -1.26 0.20 113.70 116.95 1p97 s SER 13 Ca 0.29 0.11 -0.12 0.00 0.48 0.00 0.00 55.95 56.71 1p97 s SER 13 Cb -0.11 -0.54 0.28 0.00 0.10 0.00 0.00 66.02 65.75 1p97 s SER 13 CO 0.21 -1.94 1.63 -0.03 0.98 0.00 0.00 173.24 174.09 1p97 h MET 14 N -0.79 0.02 0.00 4.02 4.05 -1.73 0.12 114.93 120.62 1p97 h MET 14 Ca -0.42 -0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 58.99 1p97 h MET 14 Cb 1.28 -0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 32.07 1p97 h MET 14 CO 0.48 0.01 -0.04 0.22 0.23 0.00 0.00 176.91 177.81 1p97 h ASP 15 N 0.02 0.00 -4.76 1.39 3.58 -1.93 -3.49 116.42 111.23 1p97 h ASP 15 Ca 0.33 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.78 1p97 h ASP 15 Cb 0.52 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.57 1p97 h ASP 15 CO -0.67 0.04 -0.16 0.80 -2.88 0.00 0.00 179.24 176.38 1p97 n MET 16 N -3.12 -1.33 -0.08 0.28 0.00 0.42 -5.03 117.12 108.27 1p97 n MET 16 Ca 0.03 1.45 -0.14 0.00 -0.00 0.00 0.00 57.70 59.03 1p97 n MET 16 Cb 0.48 -4.69 -0.05 0.00 0.00 0.00 0.00 33.22 28.96 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 -1.07 0.43 0.00 2.12 2.85 -1.26 -4.44 118.16 116.79 1p97 n LYS 17 Ca 0.04 0.18 0.00 0.00 -1.05 0.00 0.00 58.31 57.48 1p97 n LYS 17 Cb 0.44 -1.25 0.00 0.00 -0.65 0.00 0.00 35.03 33.57 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 -4.13 0.00 0.16 5.58 3.72 -1.25 -2.46 117.46 119.09 1p97 n PHE 18 Ca -0.25 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.23 1p97 n PHE 18 Cb 0.58 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 39.00 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 0.53 0.63 114.28 113.85 1p97 n THR 19 Ca 0.00 -0.32 -0.13 0.00 -2.27 0.00 0.00 64.05 61.33 1p97 n THR 19 Cb 0.00 0.33 -0.10 0.00 -2.10 0.00 0.00 70.33 68.46 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 -2.98 -0.50 -0.05 4.78 5.04 -0.96 -4.77 117.35 117.90 1p97 s TYR 20 Ca -0.03 1.22 0.01 0.00 -2.44 0.00 0.00 57.07 55.82 1p97 s TYR 20 Cb 0.11 0.17 0.02 0.00 0.35 0.00 0.00 41.96 42.61 1p97 s TYR 20 CO 0.67 -0.24 -0.05 0.00 -1.34 0.00 0.00 175.55 174.59 1p97 s ASP 22 N 1.10 5.00 0.57 0.00 2.15 -0.33 -4.74 116.67 120.43 1p97 s ASP 22 Ca -0.08 2.29 0.26 0.00 0.43 0.00 0.00 52.55 55.45 1p97 s ASP 22 Cb -0.14 -2.59 1.66 0.00 -0.30 0.00 0.00 42.92 41.55 1p97 s ASP 22 CO -0.01 -1.71 2.22 -0.78 -0.17 0.00 0.00 175.17 174.72 1p97 h ASP 23 N 0.50 0.00 0.01 -0.34 3.58 -2.00 0.24 116.42 118.41 1p97 h ASP 23 Ca -0.49 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 56.96 1p97 h ASP 23 Cb 1.28 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.33 1p97 h ASP 23 CO 0.54 0.00 -0.00 0.03 -2.88 0.00 0.00 179.24 176.93 1p97 h ARG 24 N 0.00 0.00 -0.68 0.28 3.08 -1.94 -2.94 114.38 112.18 1p97 h ARG 24 Ca -0.00 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.15 1p97 h ARG 24 Cb 0.01 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 1p97 h ARG 24 CO 0.00 0.00 0.45 0.97 -1.07 0.00 0.00 179.97 180.32 1p97 h ILE 25 N 0.00 0.92 -1.01 2.04 -0.00 -1.28 -0.14 117.51 118.03 1p97 h ILE 25 Ca -0.00 -0.19 0.26 0.00 -0.00 0.00 0.00 64.86 64.93 1p97 h ILE 25 Cb 0.00 0.33 -0.12 0.00 -0.00 0.00 0.00 36.82 37.03 1p97 h ILE 25 CO 0.00 0.10 0.61 0.71 -0.00 0.00 0.00 178.15 179.57 1p97 h THR 26 N 0.54 0.51 0.00 2.19 1.35 -1.49 0.27 112.91 116.28 1p97 h THR 26 Ca 0.31 -0.18 -0.08 0.00 -0.55 0.00 0.00 66.41 65.91 1p97 h THR 26 Cb 0.51 -0.07 -0.01 0.00 -1.73 0.00 0.00 68.15 66.85 1p97 h THR 26 CO -0.10 0.10 -1.29 -0.62 -0.25 0.00 0.00 175.52 173.36 1p97 n GLU 27 N -4.86 0.62 -0.07 4.72 -0.58 -0.13 -3.03 120.64 117.31 1p97 n GLU 27 Ca 0.27 0.13 -0.06 0.00 -0.42 0.00 0.00 57.16 57.08 1p97 n GLU 27 Cb 0.79 -1.79 -0.03 0.00 -0.57 0.00 0.00 31.44 29.85 1p97 n GLU 27 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1p97 h LEU 28 N 0.00 0.00 -1.06 -4.62 3.38 -0.34 -3.40 115.31 109.28 1p97 h LEU 28 Ca -0.08 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1p97 h LEU 28 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1p97 h LEU 28 CO 0.02 0.83 -0.42 -0.38 0.09 0.00 0.00 178.44 178.58 1p97 n ILE 29 N -4.60 0.00 0.00 1.22 2.08 0.74 -4.95 119.36 113.85 1p97 n ILE 29 Ca -0.10 -0.29 0.00 0.00 0.56 0.00 0.00 62.75 62.92 1p97 n ILE 29 Cb 0.30 1.27 0.00 0.00 -0.75 0.00 0.00 39.64 40.46 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 1.37 2.94 1.04 7.39 0.00 -0.76 -1.30 105.19 115.88 1p97 n GLY 30 Ca 0.09 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.62 -3.85 -4.04 1.61 4.01 -1.26 -4.79 117.16 107.22 1p97 n TYR 31 Ca 0.00 -0.31 -0.31 0.00 -0.16 0.00 0.00 57.90 57.11 1p97 n TYR 31 Cb 0.00 -0.29 -0.06 0.00 -0.31 0.00 0.00 39.34 38.68 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 -1.75 3.27 0.22 -0.72 2.46 -1.26 -3.25 115.29 114.26 1p97 s HIS 32 Ca 0.21 0.14 -0.08 0.00 0.47 0.00 0.00 55.06 55.80 1p97 s HIS 32 Cb -0.01 -1.68 0.33 0.00 -0.13 0.00 0.00 32.58 31.10 1p97 s HIS 32 CO 0.15 0.54 1.73 -1.35 -2.47 0.00 0.00 174.74 173.33 1p97 h PRO 33 N 3.48 0.36 0.00 2.88 0.11 -1.86 0.11 132.00 137.08 1p97 h PRO 33 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1p97 h PRO 33 Cb 1.17 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1p97 h PRO 33 CO 0.67 0.24 0.00 0.39 -0.21 0.00 0.00 178.00 179.08 1p97 n GLU 34 N -5.04 0.14 -0.02 1.05 -0.58 -1.26 -1.96 120.64 112.97 1p97 n GLU 34 Ca 0.10 0.42 -0.05 0.00 -0.42 0.00 0.00 57.16 57.22 1p97 n GLU 34 Cb 0.33 -1.80 -0.04 0.00 -0.57 0.00 0.00 31.44 29.37 1p97 n GLU 34 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 1p97 h GLU 35 N 0.00 -0.07 0.00 3.49 4.22 -1.18 -3.31 114.58 117.73 1p97 h GLU 35 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.43 1p97 h GLU 35 Cb 0.28 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 1p97 h GLU 35 CO 0.00 0.18 -0.06 -0.07 -2.18 0.00 0.00 179.01 176.89 1p97 h LEU 36 N -1.00 0.00 -8.34 1.64 4.07 -1.34 -3.42 115.31 106.91 1p97 h LEU 36 Ca -0.01 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.94 1p97 h LEU 36 Cb 0.28 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.02 1p97 h LEU 36 CO 0.01 0.06 0.04 -0.76 -1.08 0.00 0.00 178.44 176.71 1p97 s LEU 37 N -6.44 2.87 0.00 1.67 1.43 -0.83 -2.05 118.68 115.34 1p97 s LEU 37 Ca -0.00 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.17 1p97 s LEU 37 Cb 0.10 -2.55 0.00 0.00 0.03 0.00 0.00 46.19 43.77 1p97 s LEU 37 CO 0.55 -3.88 0.00 0.61 0.23 0.00 0.00 176.35 173.85 1p97 n GLY 38 N 6.80 1.19 2.90 -3.19 0.00 0.20 -4.99 105.19 108.11 1p97 n GLY 38 Ca 0.47 -0.12 -0.15 0.00 0.00 0.00 0.00 46.02 46.22 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 -0.99 0.30 -0.72 1.61 1.70 -0.87 -4.98 118.95 115.00 1p97 s ARG 39 Ca 0.00 -0.07 -0.28 0.00 -0.47 0.00 0.00 55.73 54.91 1p97 s ARG 39 Cb 0.00 -0.34 -0.17 0.00 -0.57 0.00 0.00 34.95 33.87 1p97 s ARG 39 CO 0.00 0.01 2.10 0.43 -1.08 0.00 0.00 175.30 176.76 1p97 n SER 40 N 3.32 0.33 -0.08 -2.89 7.64 -1.26 -3.86 113.62 116.81 1p97 n SER 40 Ca -0.17 0.24 -0.07 0.00 1.01 0.00 0.00 58.87 59.89 1p97 n SER 40 Cb 0.56 -0.75 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 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 9.21 0.29 0.00 -0.43 0.00 -1.70 -3.23 119.26 123.40 1p97 h ALA 41 Ca -0.05 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1p97 h ALA 41 Cb 1.09 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1p97 h ALA 41 CO 1.08 -0.39 0.55 1.88 0.00 0.00 0.00 179.25 182.37 1p97 h TYR 42 N 0.11 0.00 0.00 0.00 -1.99 -1.86 0.49 116.97 113.73 1p97 h TYR 42 Ca 0.15 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.88 1p97 h TYR 42 Cb 0.18 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.91 1p97 h TYR 42 CO -0.21 0.00 0.00 0.39 -0.00 0.00 0.00 178.16 178.34 1p97 n GLU 43 N -2.42 0.00 0.01 4.88 1.02 -1.22 -4.04 120.64 118.86 1p97 n GLU 43 Ca -0.01 0.46 0.13 0.00 -0.02 0.00 0.00 57.16 57.72 1p97 n GLU 43 Cb 0.57 -1.34 0.43 0.00 -0.02 0.00 0.00 31.44 31.09 1p97 n GLU 43 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 1p97 n PHE 44 N -1.89 0.06 -0.57 -0.32 1.16 -0.36 -4.61 117.46 110.93 1p97 n PHE 44 Ca 0.00 0.02 -0.24 0.00 -1.87 0.00 0.00 57.45 55.35 1p97 n PHE 44 Cb 0.00 -0.42 -0.04 0.00 -1.61 0.00 0.00 39.48 37.41 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 -1.56 0.83 -0.81 2.97 9.36 0.16 -2.85 117.16 125.25 1p97 n TYR 45 Ca 0.06 -1.24 0.00 0.00 3.32 0.00 0.00 57.90 60.04 1p97 n TYR 45 Cb 0.35 -1.20 0.00 0.00 -0.63 0.00 0.00 39.34 37.86 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 6.01 -2.17 -0.03 2.98 8.25 -1.25 -4.16 115.22 124.86 1p97 n HIS 46 Ca 0.33 1.14 -0.01 0.00 -0.26 0.00 0.00 57.72 58.92 1p97 n HIS 46 Cb 0.20 -2.38 -0.00 0.00 1.12 0.00 0.00 29.99 28.93 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 1.12 0.00 0.00 -1.41 0.00 -1.84 -3.27 119.26 113.86 1p97 h ALA 47 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1p97 h ALA 47 Cb 0.00 0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1p97 h ALA 47 CO 0.00 0.15 -1.11 1.47 0.00 0.00 0.00 179.25 179.76 1p97 n LEU 48 N -3.54 0.60 -1.03 0.00 -0.00 -1.26 -4.03 117.00 107.75 1p97 n LEU 48 Ca -0.02 0.06 0.12 0.00 -0.00 0.00 0.00 56.01 56.17 1p97 n LEU 48 Cb 0.08 -0.08 0.14 0.00 -0.00 0.00 0.00 43.42 43.55 1p97 n LEU 48 CO 0.03 -0.01 0.65 -0.67 -0.00 0.00 0.00 177.39 177.39 1p97 n ASP 49 N -2.14 3.16 0.26 1.45 2.03 -1.26 -4.38 116.55 115.67 1p97 n ASP 49 Ca 0.01 -1.99 -0.16 0.00 0.52 0.00 0.00 54.79 53.17 1p97 n ASP 49 Cb 0.47 -0.09 -0.08 0.00 -0.72 0.00 0.00 41.12 40.70 1p97 n ASP 49 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 1p97 h SER 50 N 4.60 -0.53 -0.99 1.67 0.87 -1.70 -3.19 113.55 114.29 1p97 h SER 50 Ca 0.00 -0.00 0.16 0.00 -1.23 0.00 0.00 61.79 60.72 1p97 h SER 50 Cb 0.99 0.14 -0.10 0.00 -0.44 0.00 0.00 62.40 62.99 1p97 h SER 50 CO 0.00 -0.35 0.61 -0.33 -0.53 0.00 0.00 176.83 176.23 1p97 h GLU 51 N -0.66 0.83 -0.37 2.24 5.08 -1.86 0.17 114.58 120.00 1p97 h GLU 51 Ca -0.06 -0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.32 1p97 h GLU 51 Cb 0.50 -0.19 -0.09 0.00 0.50 0.00 0.00 28.75 29.47 1p97 h GLU 51 CO 0.10 0.55 -0.29 -0.91 -1.00 0.00 0.00 179.01 177.47 1p97 h ASN 52 N 0.85 -0.94 1.09 1.42 -0.26 -1.84 0.43 115.58 116.32 1p97 h ASN 52 Ca 0.54 0.17 -0.10 0.00 -0.56 0.00 0.00 56.30 56.36 1p97 h ASN 52 Cb 0.72 0.45 -0.01 0.00 -1.06 0.00 0.00 38.32 38.41 1p97 h ASN 52 CO -0.33 -0.30 -0.46 0.24 -1.06 0.00 0.00 177.43 175.51 1p97 h MET 53 N -0.23 0.00 -0.56 0.81 2.86 -0.96 -0.46 114.93 116.39 1p97 h MET 53 Ca 0.17 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.74 1p97 h MET 53 Cb 0.51 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.15 1p97 h MET 53 CO -0.50 0.46 0.06 1.15 1.06 0.00 0.00 176.91 179.14 1p97 h THR 54 N 0.00 1.26 -0.07 2.22 2.02 0.22 0.15 112.91 118.71 1p97 h THR 54 Ca -0.00 -1.02 -0.12 0.00 0.77 0.00 0.00 66.41 66.03 1p97 h THR 54 Cb 1.14 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 68.37 1p97 h THR 54 CO 0.06 0.37 -0.50 0.11 0.37 0.00 0.00 175.52 175.93 1p97 h LYS 55 N 0.83 0.17 -0.00 6.66 6.56 0.02 -1.93 116.57 128.88 1p97 h LYS 55 Ca 0.16 -0.10 -0.06 0.00 -1.06 0.00 0.00 60.65 59.60 1p97 h LYS 55 Cb 0.46 0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 32.12 1p97 h LYS 55 CO 0.02 0.64 -0.28 0.77 -2.06 0.00 0.00 179.45 178.53 1p97 h SER 56 N 0.14 0.00 -0.29 0.86 0.02 -0.68 0.23 113.55 113.82 1p97 h SER 56 Ca 0.00 -0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 1p97 h SER 56 Cb 0.93 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.46 1p97 h SER 56 CO 0.07 0.28 -0.21 -0.74 -1.14 0.00 0.00 176.83 175.10 1p97 h HIS 57 N 0.00 0.86 0.00 3.45 -0.00 0.01 0.38 115.15 119.85 1p97 h HIS 57 Ca -0.00 -0.19 -0.09 0.00 -0.00 0.00 0.00 60.37 60.09 1p97 h HIS 57 Cb 0.50 -0.21 -0.01 0.00 -0.00 0.00 0.00 27.41 27.69 1p97 h HIS 57 CO 0.00 0.90 -0.41 1.96 -0.00 0.00 0.00 177.93 180.38 1p97 h GLN 58 N 0.67 0.00 0.00 5.26 4.20 -0.58 -2.19 115.11 122.47 1p97 h GLN 58 Ca 0.10 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.77 1p97 h GLN 58 Cb 0.71 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.48 1p97 h GLN 58 CO 0.05 0.41 -0.22 -0.97 -0.67 0.00 0.00 178.83 177.44 1p97 h ASN 59 N 0.00 0.00 0.05 1.46 -1.24 -0.24 -3.31 115.58 112.31 1p97 h ASN 59 Ca -0.00 -0.73 -0.00 0.00 0.71 0.00 0.00 56.30 56.28 1p97 h ASN 59 Cb 0.91 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.96 1p97 h ASN 59 CO 0.05 0.99 -0.02 0.25 -1.29 0.00 0.00 177.43 177.41 1p97 h LEU 60 N -1.00 0.00 -2.67 0.34 5.85 -0.31 -2.10 115.31 115.41 1p97 h LEU 60 Ca -0.05 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.67 1p97 h LEU 60 Cb 0.87 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.90 1p97 h LEU 60 CO -0.03 0.02 0.00 0.00 -0.34 0.00 0.00 178.44 178.08 1p97 n THR 62 N -3.04 0.00 -0.01 0.00 -1.04 -0.87 -4.80 114.28 104.52 1p97 n THR 62 Ca -0.02 -0.04 0.01 0.00 -2.04 0.00 0.00 64.05 61.95 1p97 n THR 62 Cb 0.11 0.34 -0.05 0.00 -1.82 0.00 0.00 70.33 68.91 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 0.02 1.38 0.00 -2.82 4.76 -0.85 -5.01 118.16 115.64 1p97 n LYS 63 Ca -0.00 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.40 1p97 n LYS 63 Cb 0.65 -1.15 0.00 0.00 -1.84 0.00 0.00 35.03 32.69 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 2.35 2.78 3.61 0.72 0.00 -1.13 -4.91 105.19 108.62 1p97 n GLY 64 Ca -0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.24 0.55 -0.03 1.61 0.74 -1.26 -1.72 119.66 119.31 1p97 s GLN 65 Ca 0.00 0.38 -0.08 0.00 0.05 0.00 0.00 55.36 55.72 1p97 s GLN 65 Cb 0.00 0.26 0.01 0.00 1.10 0.00 0.00 33.01 34.38 1p97 s GLN 65 CO 0.00 -0.12 0.17 0.54 -0.55 0.00 0.00 175.29 175.33 1p97 s VAL 66 N -0.39 0.05 -0.44 1.34 0.11 0.88 -4.81 120.40 117.14 1p97 s VAL 66 Ca 0.01 -0.42 0.03 0.00 -2.93 0.00 0.00 61.98 58.67 1p97 s VAL 66 Cb -0.03 -0.38 0.12 0.00 -1.53 0.00 0.00 36.38 34.56 1p97 s VAL 66 CO -0.03 -0.23 0.20 -0.69 -3.33 0.00 0.00 175.10 171.02 1p97 s VAL 67 N -0.83 1.98 0.89 2.04 1.01 -1.26 0.55 120.40 124.77 1p97 s VAL 67 Ca -0.09 -2.70 -0.13 0.00 0.00 0.00 0.00 61.98 59.06 1p97 s VAL 67 Cb -0.05 -2.40 0.16 0.00 0.00 0.00 0.00 36.38 34.08 1p97 s VAL 67 CO 0.01 -0.78 1.24 -0.55 0.00 0.00 0.00 175.10 175.02 1p97 s SER 68 N 0.33 3.67 0.06 3.32 0.15 -0.77 -5.01 113.70 115.44 1p97 s SER 68 Ca 0.15 0.35 0.00 0.00 0.70 0.00 0.00 55.95 57.15 1p97 s SER 68 Cb -0.23 -0.57 0.00 0.00 -1.71 0.00 0.00 66.02 63.51 1p97 s SER 68 CO -0.04 -2.38 0.02 0.61 1.20 0.00 0.00 173.24 172.65 1p97 n GLY 69 N -3.52 3.66 3.53 9.45 0.00 -1.26 -3.90 105.19 113.15 1p97 n GLY 69 Ca 0.13 -2.21 -0.51 0.00 0.00 0.00 0.00 46.02 43.43 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 -0.35 1.28 -4.16 1.61 6.02 -1.21 -4.13 117.38 116.44 1p97 n GLN 70 Ca -0.01 0.40 -0.27 0.00 -0.01 0.00 0.00 57.00 57.10 1p97 n GLN 70 Cb 0.07 -2.46 -0.05 0.00 1.02 0.00 0.00 30.24 28.82 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 6.27 2.12 -0.47 1.08 -0.85 0.11 -4.77 117.35 120.84 1p97 s TYR 71 Ca 1.05 -0.75 -0.12 0.00 -0.52 0.00 0.00 57.07 56.73 1p97 s TYR 71 Cb -0.85 -1.88 0.10 0.00 0.38 0.00 0.00 41.96 39.71 1p97 s TYR 71 CO 0.52 -0.04 0.36 1.03 -1.52 0.00 0.00 175.55 175.89 1p97 s ARG 72 N -4.03 2.75 -0.13 -3.49 0.52 -1.26 -1.80 118.95 111.50 1p97 s ARG 72 Ca 0.31 -1.54 -0.16 0.00 -0.52 0.00 0.00 55.73 53.82 1p97 s ARG 72 Cb 0.01 -4.00 -0.04 0.00 0.52 0.00 0.00 34.95 31.44 1p97 s ARG 72 CO 0.18 -1.09 0.39 1.41 0.02 0.00 0.00 175.30 176.21 1p97 s MET 73 N 1.50 4.26 0.00 3.54 1.75 -0.05 -3.75 119.30 126.56 1p97 s MET 73 Ca 0.04 0.29 0.01 0.00 -1.25 0.00 0.00 55.69 54.77 1p97 s MET 73 Cb -0.25 -3.41 0.03 0.00 2.84 0.00 0.00 34.83 34.03 1p97 s MET 73 CO 0.03 0.24 0.86 -0.11 -0.65 0.00 0.00 175.02 175.39 1p97 n LEU 74 N 3.48 0.00 0.00 4.11 7.94 -1.13 -0.86 117.00 130.54 1p97 n LEU 74 Ca -0.10 0.34 0.00 0.00 -1.11 0.00 0.00 56.01 55.14 1p97 n LEU 74 Cb 0.52 -0.34 0.00 0.00 0.53 0.00 0.00 43.42 44.13 1p97 n LEU 74 CO 0.41 -0.34 0.00 0.00 -1.11 0.00 0.00 177.39 176.36 1p97 n ALA 75 N -1.34 0.00 0.01 1.96 0.00 -1.20 -0.59 120.51 119.35 1p97 n ALA 75 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1p97 n ALA 75 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 1p97 n ALA 75 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1p97 h LYS 76 N 0.00 0.00 0.00 0.00 3.64 -1.53 -3.38 116.57 115.30 1p97 h LYS 76 Ca 0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1p97 h LYS 76 Cb 0.00 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1p97 h LYS 76 CO 0.00 0.67 -0.26 -2.39 -2.27 0.00 0.00 179.45 175.20 1p97 n HIS 77 N -3.15 0.00 -0.79 1.91 1.44 -1.26 -4.91 115.22 108.45 1p97 n HIS 77 Ca -0.11 -1.25 0.00 0.00 -2.01 0.00 0.00 57.72 54.35 1p97 n HIS 77 Cb 1.01 -0.20 0.00 0.00 0.12 0.00 0.00 29.99 30.92 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 -1.26 0.54 0.00 -1.39 0.00 -0.95 -5.05 105.19 97.08 1p97 n GLY 78 Ca 0.17 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.79 0.06 2.96 -0.02 0.00 0.25 -4.73 105.19 100.92 1p97 n GLY 79 Ca 0.00 -1.82 -0.13 0.00 0.00 0.00 0.00 46.02 44.07 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 0.03 -0.13 -0.04 1.61 2.02 -0.08 -3.27 117.35 117.49 1p97 s TYR 80 Ca 0.00 0.34 0.06 0.00 -0.37 0.00 0.00 57.07 57.10 1p97 s TYR 80 Cb 0.00 -0.01 -0.01 0.00 -0.40 0.00 0.00 41.96 41.54 1p97 s TYR 80 CO 0.00 -0.09 -0.22 0.14 -1.57 0.00 0.00 175.55 173.81 1p97 s VAL 81 N 0.43 1.78 -0.24 0.71 -7.23 -0.04 0.71 120.40 116.52 1p97 s VAL 81 Ca -0.03 -0.93 -0.22 0.00 -1.81 0.00 0.00 61.98 58.99 1p97 s VAL 81 Cb -0.04 -1.50 -0.01 0.00 0.56 0.00 0.00 36.38 35.38 1p97 s VAL 81 CO -0.02 0.50 0.71 0.26 -0.31 0.00 0.00 175.10 176.25 1p97 s TRP 82 N -0.23 3.31 0.00 2.82 0.52 -1.25 -0.87 118.94 123.24 1p97 s TRP 82 Ca 0.01 0.96 0.05 0.00 0.02 0.00 0.00 56.10 57.14 1p97 s TRP 82 Cb -0.11 -2.92 -0.01 0.00 -1.15 0.00 0.00 33.47 29.27 1p97 s TRP 82 CO 0.02 -0.33 -0.15 -0.51 0.02 0.00 0.00 176.95 176.00 1p97 s LEU 83 N 2.55 2.06 -0.13 2.99 1.02 -0.75 -0.30 118.68 126.12 1p97 s LEU 83 Ca 0.30 -0.32 -0.03 0.00 0.02 0.00 0.00 54.13 54.10 1p97 s LEU 83 Cb -0.15 -0.74 -0.03 0.00 0.02 0.00 0.00 46.19 45.28 1p97 s LEU 83 CO 0.08 0.15 -0.01 -0.70 0.02 0.00 0.00 176.35 175.90 1p97 s GLU 84 N -0.54 3.44 -0.12 1.70 2.12 -0.28 0.06 118.70 125.07 1p97 s GLU 84 Ca 0.05 -0.45 0.01 0.00 0.36 0.00 0.00 54.97 54.94 1p97 s GLU 84 Cb -0.06 -2.91 0.02 0.00 0.26 0.00 0.00 34.13 31.43 1p97 s GLU 84 CO -0.00 0.43 -0.15 0.99 -0.54 0.00 0.00 175.26 175.99 1p97 s THR 85 N -0.14 1.55 -0.44 -1.70 2.01 -1.25 -0.13 115.64 115.54 1p97 s THR 85 Ca 0.04 -0.65 -0.25 0.00 0.31 0.00 0.00 61.69 61.14 1p97 s THR 85 Cb -0.13 -1.42 0.02 0.00 0.01 0.00 0.00 72.50 70.98 1p97 s THR 85 CO 0.02 0.45 0.88 -1.58 -0.69 0.00 0.00 174.62 173.70 1p97 s GLN 86 N 1.13 3.55 0.09 4.92 -0.44 0.69 -1.85 119.66 127.75 1p97 s GLN 86 Ca -0.03 0.15 0.03 0.00 -2.50 0.00 0.00 55.36 53.01 1p97 s GLN 86 Cb -0.14 -3.91 -0.04 0.00 -1.64 0.00 0.00 33.01 27.28 1p97 s GLN 86 CO -0.04 -1.13 0.08 0.20 0.50 0.00 0.00 175.29 174.89 1p97 s GLY 87 N 2.15 2.00 -0.16 2.59 0.00 0.19 -0.46 107.32 113.63 1p97 s GLY 87 Ca 0.35 -1.03 -0.13 0.00 0.00 0.00 0.00 44.72 43.91 1p97 s GLY 87 CO 0.24 -1.01 0.42 -1.59 0.00 0.00 0.00 173.10 171.16 1p97 s THR 88 N -1.41 -0.01 -0.34 0.90 2.01 -0.12 -0.08 115.64 116.59 1p97 s THR 88 Ca 0.29 0.03 -0.12 0.00 0.31 0.00 0.00 61.69 62.20 1p97 s THR 88 Cb -0.12 -0.60 -0.00 0.00 0.01 0.00 0.00 72.50 71.79 1p97 s THR 88 CO 0.22 0.01 0.21 -0.69 -0.69 0.00 0.00 174.62 173.68 1p97 s VAL 89 N 0.57 4.96 -0.55 3.82 1.01 -0.70 0.06 120.40 129.57 1p97 s VAL 89 Ca -0.03 -0.42 -0.25 0.00 0.00 0.00 0.00 61.98 61.28 1p97 s VAL 89 Cb -0.04 -3.60 0.04 0.00 0.00 0.00 0.00 36.38 32.78 1p97 s VAL 89 CO -0.03 -0.05 0.98 -0.51 0.00 0.00 0.00 175.10 175.48 1p97 s ILE 90 N 1.66 4.34 0.48 2.22 2.07 0.25 -4.86 121.20 127.36 1p97 s ILE 90 Ca 0.05 0.40 -0.15 0.00 -1.41 0.00 0.00 60.65 59.54 1p97 s ILE 90 Cb -0.18 -4.56 -0.08 0.00 0.13 0.00 0.00 42.46 37.78 1p97 s ILE 90 CO 0.09 -1.13 0.92 -0.31 -1.91 0.00 0.00 174.94 172.60 1p97 s TYR 91 N 4.07 3.45 0.10 3.50 1.51 -1.26 -0.77 117.35 127.96 1p97 s TYR 91 Ca 0.33 1.35 -0.31 0.00 -1.01 0.00 0.00 57.07 57.43 1p97 s TYR 91 Cb -0.12 -2.70 -0.09 0.00 -0.11 0.00 0.00 41.96 38.95 1p97 s TYR 91 CO 0.21 -0.29 1.57 1.21 -1.11 0.00 0.00 175.55 177.13 1p97 s ASN 92 N -3.07 6.65 0.30 2.29 3.84 0.30 -4.64 114.94 120.60 1p97 s ASN 92 Ca 0.57 2.47 -0.02 0.00 0.21 0.00 0.00 52.86 56.09 1p97 s ASN 92 Cb -0.10 -2.58 0.44 0.00 -0.55 0.00 0.00 41.25 38.46 1p97 s ASN 92 CO 0.31 -0.82 1.92 1.55 -2.79 0.00 0.00 177.10 177.27 1p97 h PRO 93 N 7.60 0.99 0.11 0.43 0.13 -1.95 0.91 132.00 140.22 1p97 h PRO 93 Ca -0.42 -0.10 -0.36 0.00 -0.87 0.00 0.00 66.00 64.25 1p97 h PRO 93 Cb 1.20 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 32.11 1p97 h PRO 93 CO 0.91 0.72 -1.97 0.54 -0.23 0.00 0.00 178.00 177.97 1p97 n ARG 94 N -4.37 0.74 -0.03 0.86 1.74 -1.26 -4.44 116.66 109.90 1p97 n ARG 94 Ca 0.07 0.28 0.01 0.00 -0.77 0.00 0.00 57.85 57.44 1p97 n ARG 94 Cb 0.10 -1.70 -0.14 0.00 -1.02 0.00 0.00 32.46 29.69 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 -3.54 0.19 -1.91 0.55 2.85 -1.22 -4.96 115.26 107.23 1p97 n ASN 95 Ca -0.33 0.08 -0.10 0.00 -0.11 0.00 0.00 54.58 54.13 1p97 n ASN 95 Cb 1.02 1.22 -0.02 0.00 1.24 0.00 0.00 39.78 43.24 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 -2.58 -0.85 -4.85 1.20 4.77 0.32 -4.91 117.00 110.09 1p97 n LEU 96 Ca -0.16 0.25 -0.31 0.00 -0.03 0.00 0.00 56.01 55.76 1p97 n LEU 96 Cb 0.84 -1.81 0.04 0.00 -2.33 0.00 0.00 43.42 40.15 1p97 n LEU 96 CO 0.44 -0.31 0.72 0.00 -1.33 0.00 0.00 177.39 176.91 1p97 s GLN 97 N -4.00 3.15 -0.47 3.23 -2.07 -1.26 -4.57 119.66 113.67 1p97 s GLN 97 Ca 0.00 0.79 -0.27 0.00 -1.82 0.00 0.00 55.36 54.06 1p97 s GLN 97 Cb 0.00 -2.03 -0.08 0.00 -1.09 0.00 0.00 33.01 29.81 1p97 s GLN 97 CO 0.00 -0.90 2.39 -0.35 -1.32 0.00 0.00 175.29 175.11 1p97 n PRO 98 N -2.98 1.14 -0.05 9.60 -0.04 -1.26 -0.54 135.00 140.87 1p97 n PRO 98 Ca 0.07 0.12 -0.14 0.00 -0.04 0.00 0.00 63.50 63.50 1p97 n PRO 98 Cb 0.54 -3.21 -0.07 0.00 -0.04 0.00 0.00 33.50 30.73 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 17.78 0.52 -2.52 0.54 5.75 -1.21 -3.37 115.11 132.60 1p97 h GLN 99 Ca -0.26 -0.33 0.13 0.00 -0.15 0.00 0.00 58.65 58.03 1p97 h GLN 99 Cb 1.27 0.04 -0.09 0.00 1.07 0.00 0.00 27.48 29.77 1p97 h GLN 99 CO 1.13 0.94 0.41 0.00 -2.65 0.00 0.00 178.83 178.66 1p97 s ILE 101 N -3.43 2.81 -0.23 0.00 1.09 0.13 -0.59 121.20 120.98 1p97 s ILE 101 Ca 0.10 -0.75 -0.06 0.00 -1.10 0.00 0.00 60.65 58.83 1p97 s ILE 101 Cb -0.02 -2.15 -0.03 0.00 -1.06 0.00 0.00 42.46 39.20 1p97 s ILE 101 CO 0.00 0.54 0.04 -0.04 -0.10 0.00 0.00 174.94 175.38 1p97 s MET 102 N 0.30 3.62 -0.15 2.79 -1.94 0.11 -0.24 119.30 123.79 1p97 s MET 102 Ca -0.12 -0.50 0.01 0.00 -1.71 0.00 0.00 55.69 53.37 1p97 s MET 102 Cb -0.16 -3.23 0.02 0.00 2.01 0.00 0.00 34.83 33.47 1p97 s MET 102 CO 0.06 -0.14 -0.19 0.00 -0.01 0.00 0.00 175.02 174.75 1p97 s VAL 104 N 1.11 5.04 -0.08 0.00 1.01 0.40 -1.09 120.40 126.79 1p97 s VAL 104 Ca -0.01 0.31 -0.01 0.00 0.00 0.00 0.00 61.98 62.26 1p97 s VAL 104 Cb -0.14 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 1p97 s VAL 104 CO -0.07 -0.20 -0.02 0.20 0.00 0.00 0.00 175.10 175.02 1p97 s ASN 105 N 1.75 5.09 -0.37 3.32 0.01 -1.08 -0.22 114.94 123.44 1p97 s ASN 105 Ca 0.18 0.10 0.03 0.00 -0.71 0.00 0.00 52.86 52.45 1p97 s ASN 105 Cb -0.16 -1.40 0.11 0.00 0.41 0.00 0.00 41.25 40.21 1p97 s ASN 105 CO 0.13 0.37 0.11 -0.31 -1.51 0.00 0.00 177.10 175.89 1p97 s TYR 106 N -0.85 2.98 -0.32 2.20 1.51 0.82 -2.10 117.35 121.59 1p97 s TYR 106 Ca 0.13 -2.65 -0.29 0.00 -1.01 0.00 0.00 57.07 53.25 1p97 s TYR 106 Cb -0.11 -2.50 -0.02 0.00 -0.11 0.00 0.00 41.96 39.22 1p97 s TYR 106 CO 0.02 -0.89 1.73 0.08 -1.11 0.00 0.00 175.55 175.38 1p97 s VAL 107 N 0.86 3.55 -0.07 0.71 1.01 0.10 -1.13 120.40 125.43 1p97 s VAL 107 Ca 0.12 0.57 -0.07 0.00 0.00 0.00 0.00 61.98 62.60 1p97 s VAL 107 Cb -0.20 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.44 1p97 s VAL 107 CO -0.10 -0.43 -0.14 0.18 0.00 0.00 0.00 175.10 174.61 1p97 n LEU 108 N 9.82 0.76 -4.92 3.92 4.77 0.59 -2.80 117.00 129.14 1p97 n LEU 108 Ca 0.22 0.14 -0.26 0.00 -0.03 0.00 0.00 56.01 56.07 1p97 n LEU 108 Cb 0.47 -0.60 0.05 0.00 -2.33 0.00 0.00 43.42 41.01 1p97 n LEU 108 CO 0.68 -0.41 0.58 -0.44 -1.33 0.00 0.00 177.39 176.47 1p97 s SER 109 N -4.74 5.16 0.45 -1.43 0.01 -1.17 -4.98 113.70 107.01 1p97 s SER 109 Ca -0.11 0.58 0.00 0.00 1.31 0.00 0.00 55.95 57.73 1p97 s SER 109 Cb 0.02 -1.38 0.00 0.00 0.21 0.00 0.00 66.02 64.87 1p97 s SER 109 CO 0.17 -1.36 0.00 -0.62 0.41 0.00 0.00 173.24 171.83 1p97 n GLU 110 N -2.78 0.69 -2.50 12.44 -0.58 -1.26 -4.08 120.64 122.56 1p97 n GLU 110 Ca 0.07 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.38 1p97 n GLU 110 Cb 0.59 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 31.44 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 -0.24 4.40 -0.38 -3.67 1.01 -1.26 -4.29 121.20 116.77 1p97 s ILE 111 Ca 0.00 1.68 -0.05 0.00 0.00 0.00 0.00 60.65 62.28 1p97 s ILE 111 Cb 0.00 -4.12 0.08 0.00 0.01 0.00 0.00 42.46 38.43 1p97 s ILE 111 CO 0.00 -0.19 0.17 -0.70 0.00 0.00 0.00 174.94 174.23 1p97 s GLU 112 N 3.47 2.36 -0.90 2.79 2.12 0.22 -4.93 118.70 123.83 1p97 s GLU 112 Ca 0.51 -1.52 -0.12 0.00 0.36 0.00 0.00 54.97 54.20 1p97 s GLU 112 Cb -0.19 -3.56 0.23 0.00 0.26 0.00 0.00 34.13 30.88 1p97 s GLU 112 CO 0.13 -0.90 0.86 0.15 -0.54 0.00 0.00 175.26 174.95 1p97 s LYS 113 N 1.29 3.75 0.00 4.30 1.02 -1.26 -0.90 119.74 127.93 1p97 s LYS 113 Ca 0.03 -2.68 0.00 0.00 0.02 0.00 0.00 55.97 53.33 1p97 s LYS 113 Cb -0.22 -4.45 0.00 0.00 -0.52 0.00 0.00 37.83 32.64 1p97 s LYS 113 CO -0.01 -1.27 0.00 0.09 -0.92 0.00 0.00 175.35 173.24