#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jia h LEU 2 N 0.00 0.06 -0.77 0.27 7.12 -1.55 0.92 115.31 121.35 1jia h LEU 2 Ca 0.00 0.26 -0.05 0.00 0.13 0.00 0.00 57.88 58.22 1jia h LEU 2 Cb 0.00 0.33 -0.01 0.00 -0.53 0.00 0.00 40.66 40.46 1jia h LEU 2 CO 0.00 -0.38 -0.22 -0.07 -0.13 0.00 0.00 178.44 177.64 1jia h LEU 3 N 0.04 0.00 0.02 2.25 3.38 -1.98 -0.13 115.31 118.88 1jia h LEU 3 Ca 0.75 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 58.49 1jia h LEU 3 Cb 1.82 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.59 1jia h LEU 3 CO -0.80 0.22 -0.89 1.56 0.09 0.00 0.00 178.44 178.62 1jia h GLN 4 N 0.00 0.57 -0.15 1.13 4.20 -1.27 -1.84 115.11 117.75 1jia h GLN 4 Ca -0.00 -0.64 0.02 0.00 0.06 0.00 0.00 58.65 58.09 1jia h GLN 4 Cb 0.89 0.19 -0.02 0.00 0.30 0.00 0.00 27.48 28.83 1jia h GLN 4 CO 0.03 1.25 0.03 0.35 -0.67 0.00 0.00 178.83 179.81 1jia h PHE 5 N 0.16 0.05 -0.91 2.96 3.57 -1.12 -1.23 116.94 120.41 1jia h PHE 5 Ca -0.12 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.43 1jia h PHE 5 Cb 1.58 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 40.27 1jia h PHE 5 CO 0.13 0.02 0.60 0.00 -2.23 0.00 0.00 178.31 176.82 1jia h ARG 6 N 0.09 1.09 -0.10 1.11 3.08 -1.05 -1.79 114.38 116.81 1jia h ARG 6 Ca 0.07 -0.07 0.01 0.00 0.07 0.00 0.00 59.98 60.06 1jia h ARG 6 Cb 0.06 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 1jia h ARG 6 CO -0.09 0.72 0.01 0.87 -1.07 0.00 0.00 179.97 180.41 1jia h LYS 7 N 1.12 0.05 -0.63 0.04 6.56 -0.39 -1.91 116.57 121.41 1jia h LYS 7 Ca 0.37 -0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.94 1jia h LYS 7 Cb 0.06 -0.01 -0.03 0.00 -0.57 0.00 0.00 32.23 31.68 1jia h LYS 7 CO -0.12 0.03 0.33 0.52 -2.06 0.00 0.00 179.45 178.16 1jia h MET 8 N 0.05 0.87 -0.16 3.15 2.86 -0.65 -1.38 114.93 119.66 1jia h MET 8 Ca 0.04 -0.09 -0.06 0.00 -2.06 0.00 0.00 59.70 57.53 1jia h MET 8 Cb 0.04 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.53 1jia h MET 8 CO -0.07 0.65 -0.15 0.82 1.06 0.00 0.00 176.91 179.22 1jia h ILE 9 N 0.87 1.34 -0.50 -1.22 2.04 -0.95 -1.09 117.51 118.00 1jia h ILE 9 Ca 0.22 -1.29 0.04 0.00 1.00 0.00 0.00 64.86 64.83 1jia h ILE 9 Cb 0.04 1.82 -0.04 0.00 -0.74 0.00 0.00 36.82 37.90 1jia h ILE 9 CO -0.03 0.38 0.26 0.50 0.00 0.00 0.00 178.15 179.26 1jia h LYS 10 N 0.03 0.50 -0.17 2.37 1.63 -0.88 0.70 116.57 120.75 1jia h LYS 10 Ca 0.03 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.78 1jia h LYS 10 Cb 0.67 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 32.19 1jia h LYS 10 CO 0.04 0.33 0.05 -0.22 -3.45 0.00 0.00 179.45 176.20 1jia h LYS 11 N 0.51 0.26 -0.25 1.90 1.63 -1.23 0.19 116.57 119.58 1jia h LYS 11 Ca 0.22 -0.06 -0.15 0.00 -0.85 0.00 0.00 60.65 59.81 1jia h LYS 11 Cb 0.11 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.70 1jia h LYS 11 CO -0.15 0.38 -0.45 0.52 -3.45 0.00 0.00 179.45 176.30 1jia h MET 12 N 0.09 0.65 0.00 1.90 2.86 -0.95 -3.36 114.93 116.11 1jia h MET 12 Ca 0.05 -0.36 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 1jia h MET 12 Cb 0.23 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1jia h MET 12 CO -0.00 0.97 -1.41 0.25 1.06 0.00 0.00 176.91 177.78 1jia n THR 13 N -4.01 0.00 0.00 2.22 -2.24 0.22 -4.78 114.28 105.68 1jia n THR 13 Ca -0.02 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1jia n THR 13 Cb 0.56 0.34 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 1jia n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jia n GLY 14 N 1.71 2.95 3.78 3.38 0.00 0.67 -4.99 105.19 112.68 1jia n GLY 14 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 1jia n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jia s LYS 16 N -0.03 4.49 -0.03 1.61 1.02 -1.26 -5.00 119.74 120.54 1jia s LYS 16 Ca 0.00 1.06 -0.30 0.00 0.02 0.00 0.00 55.97 56.76 1jia s LYS 16 Cb 0.00 -3.28 -0.06 0.00 -0.52 0.00 0.00 37.83 33.98 1jia s LYS 16 CO 0.00 0.53 1.63 -2.00 -0.92 0.00 0.00 175.35 174.59 1jia s GLU 17 N -0.95 4.19 0.45 1.68 -6.30 -1.26 -4.00 118.70 112.52 1jia s GLU 17 Ca 0.35 2.19 0.15 0.00 -2.50 0.00 0.00 54.97 55.16 1jia s GLU 17 Cb -0.22 -3.89 1.02 0.00 0.00 0.00 0.00 34.13 31.04 1jia s GLU 17 CO 0.24 -0.80 1.99 -1.35 0.02 0.00 0.00 175.26 175.36 1jia h PRO 18 N 9.18 0.00 0.13 4.30 0.11 -1.92 -3.07 132.00 140.73 1jia h PRO 18 Ca -0.40 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.71 1jia h PRO 18 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1jia h PRO 18 CO 0.95 0.18 -0.06 0.28 -0.21 0.00 0.00 178.00 179.14 1jia h VAL 19 N 0.00 0.72 -0.05 3.15 2.07 -1.95 0.33 116.25 120.52 1jia h VAL 19 Ca -0.00 -1.23 -0.16 0.00 0.82 0.00 0.00 66.70 66.13 1jia h VAL 19 Cb 0.33 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 1jia h VAL 19 CO 0.02 0.21 -0.67 1.62 0.02 0.00 0.00 177.57 178.78 1jia h VAL 20 N -0.94 1.41 0.00 2.57 3.04 -1.97 -1.99 116.25 118.38 1jia h VAL 20 Ca -0.02 -2.13 -0.16 0.00 -1.01 0.00 0.00 66.70 63.38 1jia h VAL 20 Cb 0.48 2.11 -0.02 0.00 -2.01 0.00 0.00 31.29 31.85 1jia h VAL 20 CO 0.03 0.63 -0.76 0.28 -1.01 0.00 0.00 177.57 176.74 1jia h SER 21 N 0.16 0.00 0.00 3.17 0.02 -1.60 -3.42 113.55 111.88 1jia h SER 21 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1jia h SER 21 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 1jia h SER 21 CO 0.10 0.76 -0.48 -1.22 -1.14 0.00 0.00 176.83 174.85 1jia n TYR 22 N -3.44 0.00 0.33 3.45 4.01 0.08 -4.67 117.16 116.92 1jia n TYR 22 Ca 0.00 0.00 0.15 0.00 -0.16 0.00 0.00 57.90 57.89 1jia n TYR 22 Cb 0.79 0.00 0.62 0.00 -0.31 0.00 0.00 39.34 40.44 1jia n TYR 22 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1jia h ALA 23 N 0.00 1.00 0.00 -0.72 0.00 -1.01 -2.92 119.26 115.61 1jia h ALA 23 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1jia h ALA 23 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1jia h ALA 23 CO 0.00 0.00 -0.11 1.19 0.00 0.00 0.00 179.25 180.33 1jia n PHE 24 N -2.64 0.00 -2.45 0.00 3.72 -1.26 -3.25 117.46 111.58 1jia n PHE 24 Ca 0.01 -0.57 -0.42 0.00 -0.05 0.00 0.00 57.45 56.42 1jia n PHE 24 Cb 0.24 -0.09 -0.03 0.00 -0.94 0.00 0.00 39.48 38.65 1jia n PHE 24 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 1jia s TYR 25 N -1.56 3.48 0.00 1.38 6.14 -1.10 -3.17 117.35 122.52 1jia s TYR 25 Ca 0.15 1.42 0.00 0.00 0.64 0.00 0.00 57.07 59.28 1jia s TYR 25 Cb 0.13 -3.37 0.00 0.00 0.42 0.00 0.00 41.96 39.14 1jia s TYR 25 CO 0.01 -1.04 0.00 0.41 0.64 0.00 0.00 175.55 175.57 1jia n GLY 26 N 2.70 0.34 0.03 8.97 0.00 0.04 -1.96 105.19 115.31 1jia n GLY 26 Ca 0.06 -0.88 0.12 0.00 0.00 0.00 0.00 46.02 45.32 1jia n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jia n TYR 28 N -1.83 0.00 0.51 0.00 4.01 -1.25 -3.20 117.16 115.40 1jia n TYR 28 Ca 0.04 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.91 1jia n TYR 28 Cb 0.40 0.00 0.38 0.00 -0.31 0.00 0.00 39.34 39.81 1jia n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1jia n GLY 30 N 1.06 0.33 3.72 0.00 0.00 -1.20 -4.65 105.19 104.45 1jia n GLY 30 Ca 0.05 -1.87 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 1jia n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jia s SER 31 N -1.00 6.64 0.00 1.61 0.01 -1.26 -4.59 113.70 115.11 1jia s SER 31 Ca 0.00 2.58 0.00 0.00 1.31 0.00 0.00 55.95 59.84 1jia s SER 31 Cb 0.00 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.63 1jia s SER 31 CO 0.00 -0.77 0.00 0.61 0.41 0.00 0.00 173.24 173.49 1jia n GLY 32 N 3.38 -1.03 0.00 3.44 0.00 -1.26 -5.03 105.19 104.69 1jia n GLY 32 Ca 0.12 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.74 1jia n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jia n GLY 33 N 0.00 4.55 3.46 -0.02 0.00 -1.26 -4.73 105.19 107.19 1jia n GLY 33 Ca 0.00 -0.67 -0.09 0.00 0.00 0.00 0.00 46.02 45.26 1jia n GLY 33 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1jia s ARG 34 N -3.54 1.31 1.55 1.61 1.81 -1.20 -5.01 118.95 115.48 1jia s ARG 34 Ca 0.00 -1.01 0.00 0.00 -1.72 0.00 0.00 55.73 53.00 1jia s ARG 34 Cb 0.00 0.46 0.00 0.00 -0.45 0.00 0.00 34.95 34.96 1jia s ARG 34 CO 0.00 -0.53 0.00 0.41 -0.68 0.00 0.00 175.30 174.50 1jia n GLY 35 N -0.30 -1.29 3.76 -3.53 0.00 -1.12 -4.63 105.19 98.07 1jia n GLY 35 Ca -0.08 -1.48 -0.35 0.00 0.00 0.00 0.00 46.02 44.10 1jia n GLY 35 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1jia s LYS 36 N 0.00 3.94 -0.10 1.61 2.20 -1.25 -1.84 119.74 124.30 1jia s LYS 36 Ca 0.00 -0.21 -0.40 0.00 -0.36 0.00 0.00 55.97 55.00 1jia s LYS 36 Cb 0.00 -3.32 -0.18 0.00 -1.51 0.00 0.00 37.83 32.82 1jia s LYS 36 CO 0.00 0.44 1.42 -2.30 -0.36 0.00 0.00 175.35 174.55 1jia n PRO 37 N 3.08 0.76 0.22 4.03 -0.02 -1.26 -4.82 135.00 136.98 1jia n PRO 37 Ca -0.17 0.28 0.08 0.00 -2.02 0.00 0.00 63.50 61.67 1jia n PRO 37 Cb 0.53 -1.88 0.51 0.00 -0.02 0.00 0.00 33.50 32.64 1jia n PRO 37 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1jia h LYS 38 N 4.99 0.00 0.00 -0.52 1.79 -1.97 -3.47 116.57 117.39 1jia h LYS 38 Ca -0.48 0.00 0.02 0.00 -2.18 0.00 0.00 60.65 58.01 1jia h LYS 38 Cb 1.36 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.00 1jia h LYS 38 CO 0.83 0.25 0.08 -0.40 -1.08 0.00 0.00 179.45 179.13 1jia n ASP 39 N -3.66 -0.28 -0.12 0.86 5.75 -1.26 -5.03 116.55 112.81 1jia n ASP 39 Ca -0.01 -1.15 -0.06 0.00 -0.01 0.00 0.00 54.79 53.55 1jia n ASP 39 Cb 0.37 0.45 0.12 0.00 -1.03 0.00 0.00 41.12 41.03 1jia n ASP 39 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1jia h ALA 40 N 2.00 0.99 -0.43 2.12 0.00 -1.92 -0.96 119.26 121.05 1jia h ALA 40 Ca -0.04 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 1jia h ALA 40 Cb 0.18 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1jia h ALA 40 CO 0.06 0.61 0.27 1.15 0.00 0.00 0.00 179.25 181.33 1jia h THR 41 N 0.75 1.13 -0.56 0.00 2.02 -1.92 -1.01 112.91 113.33 1jia h THR 41 Ca 0.13 -0.28 -0.06 0.00 0.77 0.00 0.00 66.41 66.97 1jia h THR 41 Cb 0.56 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 1jia h THR 41 CO 0.03 0.13 0.10 -0.78 0.37 0.00 0.00 175.52 175.37 1jia h ASP 42 N 0.58 0.84 0.40 4.18 3.58 -1.88 -1.00 116.42 123.11 1jia h ASP 42 Ca 0.16 -0.17 -0.05 0.00 0.42 0.00 0.00 57.03 57.38 1jia h ASP 42 Cb -0.02 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 40.80 1jia h ASP 42 CO -0.03 0.84 -0.26 -0.09 -2.88 0.00 0.00 179.24 176.82 1jia h ARG 43 N 0.84 0.00 -0.31 0.28 2.43 -0.51 0.97 114.38 118.07 1jia h ARG 43 Ca 0.18 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.31 1jia h ARG 43 Cb 0.36 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 1jia h ARG 43 CO 0.01 0.26 0.05 0.00 -1.51 0.00 0.00 179.97 178.77 1jia h PHE 46 N 0.78 0.15 -0.70 0.00 3.57 -0.51 -0.82 116.94 119.41 1jia h PHE 46 Ca 0.19 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.68 1jia h PHE 46 Cb 0.13 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 1jia h PHE 46 CO 0.01 0.19 0.43 0.28 -2.23 0.00 0.00 178.31 176.99 1jia h VAL 47 N 0.07 1.19 -0.39 1.41 2.07 -1.23 -1.17 116.25 118.19 1jia h VAL 47 Ca 0.04 -0.41 -0.06 0.00 0.82 0.00 0.00 66.70 67.08 1jia h VAL 47 Cb 0.09 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 1jia h VAL 47 CO -0.01 0.20 -0.01 -0.74 0.02 0.00 0.00 177.57 177.04 1jia h HIS 48 N 0.96 0.76 -0.33 1.57 -0.00 -0.98 0.15 115.15 117.29 1jia h HIS 48 Ca 0.25 -0.13 0.03 0.00 -0.00 0.00 0.00 60.37 60.52 1jia h HIS 48 Cb -0.06 -0.20 -0.03 0.00 -0.00 0.00 0.00 27.41 27.13 1jia h HIS 48 CO 0.00 0.78 0.14 -0.44 -0.00 0.00 0.00 177.93 178.42 1jia h ASP 49 N 0.52 0.18 -0.27 3.26 3.32 -0.81 -1.80 116.42 120.83 1jia h ASP 49 Ca 0.11 0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.15 1jia h ASP 49 Cb 0.48 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.01 1jia h ASP 49 CO 0.02 0.14 0.06 0.00 -1.72 0.00 0.00 179.24 177.74 1jia h TYR 52 N 0.92 0.45 0.00 0.00 -1.99 -0.90 -3.07 116.97 112.38 1jia h TYR 52 Ca 0.18 -0.16 -0.02 0.00 2.00 0.00 0.00 58.73 60.73 1jia h TYR 52 Cb 0.43 -0.08 -0.00 0.00 2.00 0.00 0.00 36.73 39.07 1jia h TYR 52 CO 0.03 0.84 -0.11 1.49 -0.00 0.00 0.00 178.16 180.40 1jia h GLU 53 N 0.28 0.00 0.00 4.88 4.81 -1.04 -2.71 114.58 120.80 1jia h GLU 53 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1jia h GLU 53 Cb 1.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.45 1jia h GLU 53 CO 0.09 0.11 0.00 1.63 -0.73 0.00 0.00 179.01 180.12 1jia n LYS 54 N -3.97 0.13 -2.71 1.92 5.02 -1.15 -4.83 118.16 112.57 1jia n LYS 54 Ca -0.02 0.12 -0.43 0.00 -2.02 0.00 0.00 58.31 55.96 1jia n LYS 54 Cb 0.20 -1.66 -0.03 0.00 -0.02 0.00 0.00 35.03 33.53 1jia n LYS 54 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1jia s VAL 55 N -3.06 4.61 -0.09 -0.18 1.01 -1.03 -5.02 120.40 116.65 1jia s VAL 55 Ca 0.12 1.66 0.02 0.00 0.00 0.00 0.00 61.98 63.78 1jia s VAL 55 Cb 0.15 -4.33 -0.02 0.00 0.00 0.00 0.00 36.38 32.18 1jia s VAL 55 CO 0.55 -0.37 -0.14 -0.89 0.00 0.00 0.00 175.10 174.25 1jia s THR 56 N 3.41 3.02 0.00 3.92 2.01 -1.26 -4.76 115.64 121.98 1jia s THR 56 Ca 0.42 -0.71 0.00 0.00 0.31 0.00 0.00 61.69 61.71 1jia s THR 56 Cb -0.13 -2.22 0.00 0.00 0.01 0.00 0.00 72.50 70.16 1jia s THR 56 CO 0.13 0.56 0.00 0.61 -0.69 0.00 0.00 174.62 175.23 1jia n GLY 59 N 2.89 1.47 3.49 4.40 0.00 -1.26 -4.93 105.19 111.24 1jia n GLY 59 Ca -0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 1jia n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jia s ASP 67 N -2.84 6.56 0.25 0.00 -1.08 -1.26 -4.97 116.67 113.33 1jia s ASP 67 Ca 0.07 0.27 -0.04 0.00 -0.52 0.00 0.00 52.55 52.32 1jia s ASP 67 Cb -0.01 -2.49 0.38 0.00 -1.46 0.00 0.00 42.92 39.33 1jia s ASP 67 CO -0.06 -1.14 1.83 1.55 0.52 0.00 0.00 175.17 177.87 1jia h PRO 68 N 9.15 0.86 0.00 4.34 0.13 -1.92 -1.19 132.00 143.38 1jia h PRO 68 Ca -0.24 -0.05 -0.22 0.00 -0.87 0.00 0.00 66.00 64.62 1jia h PRO 68 Cb 1.07 -0.19 -0.03 0.00 0.13 0.00 0.00 31.00 31.97 1jia h PRO 68 CO 1.07 0.57 -1.08 -0.22 -0.23 0.00 0.00 178.00 178.11 1jia h LYS 69 N 0.89 0.00 -0.01 0.86 3.64 -1.96 -3.38 116.57 116.61 1jia h LYS 69 Ca 0.39 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 1jia h LYS 69 Cb 0.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1jia h LYS 69 CO -0.21 0.91 0.00 0.91 -2.27 0.00 0.00 179.45 178.79 1jia n TRP 70 N -3.30 0.01 -3.72 1.91 7.02 -1.17 -1.58 117.44 116.60 1jia n TRP 70 Ca -0.02 -0.03 -0.30 0.00 -1.02 0.00 0.00 57.50 56.13 1jia n TRP 70 Cb 0.95 -0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 29.80 1jia n TRP 70 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1jia s ASP 71 N -0.23 6.43 0.27 -0.99 1.01 -0.46 -4.84 116.67 117.87 1jia s ASP 71 Ca 0.03 0.47 -0.09 0.00 0.71 0.00 0.00 52.55 53.67 1jia s ASP 71 Cb 0.02 -2.04 -0.07 0.00 1.01 0.00 0.00 42.92 41.84 1jia s ASP 71 CO 0.03 0.03 0.59 -1.81 0.21 0.00 0.00 175.17 174.22 1jia s ASP 72 N -2.72 6.57 0.43 0.27 1.01 -1.26 0.45 116.67 121.43 1jia s ASP 72 Ca 0.39 0.92 0.03 0.00 0.71 0.00 0.00 52.55 54.60 1jia s ASP 72 Cb -0.12 -2.23 -0.04 0.00 1.01 0.00 0.00 42.92 41.55 1jia s ASP 72 CO 0.27 -0.15 0.05 -0.72 0.21 0.00 0.00 175.17 174.83 1jia s TYR 73 N -1.97 1.96 -0.25 4.23 -0.85 -1.26 -4.84 117.35 114.37 1jia s TYR 73 Ca 0.47 -1.02 -0.09 0.00 -0.52 0.00 0.00 57.07 55.91 1jia s TYR 73 Cb -0.11 -1.44 -0.04 0.00 0.38 0.00 0.00 41.96 40.75 1jia s TYR 73 CO 0.24 0.06 0.13 0.99 -1.52 0.00 0.00 175.55 175.46 1jia s THR 74 N -3.03 4.97 0.09 -3.49 2.01 -1.26 -4.98 115.64 109.95 1jia s THR 74 Ca 0.21 0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.26 1jia s THR 74 Cb 0.04 -3.33 -0.04 0.00 0.01 0.00 0.00 72.50 69.18 1jia s THR 74 CO 0.11 0.32 -0.02 -0.72 -0.69 0.00 0.00 174.62 173.62 1jia s TYR 75 N 1.40 0.76 0.17 4.92 1.13 -1.26 -0.68 117.35 123.78 1jia s TYR 75 Ca 0.06 -1.06 -0.07 0.00 -1.41 0.00 0.00 57.07 54.59 1jia s TYR 75 Cb -0.15 -0.47 -0.02 0.00 -1.10 0.00 0.00 41.96 40.22 1jia s TYR 75 CO 0.06 -0.33 0.25 -1.54 -2.51 0.00 0.00 175.55 171.48 1jia s SER 76 N -3.00 0.09 -0.37 -0.18 1.04 -0.18 -4.94 113.70 106.15 1jia s SER 76 Ca 0.13 -0.97 -0.13 0.00 0.48 0.00 0.00 55.95 55.46 1jia s SER 76 Cb 0.07 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.61 1jia s SER 76 CO -0.05 -0.88 0.26 0.26 0.98 0.00 0.00 173.24 173.81 1jia s TRP 77 N -4.00 3.23 -0.19 5.02 0.52 -1.26 -0.55 118.94 121.72 1jia s TRP 77 Ca 0.20 -0.48 -0.01 0.00 0.02 0.00 0.00 56.10 55.83 1jia s TRP 77 Cb 0.04 -2.52 0.00 0.00 -1.15 0.00 0.00 33.47 29.85 1jia s TRP 77 CO 0.02 -0.50 -0.13 0.21 0.02 0.00 0.00 176.95 176.57 1jia s LYS 78 N 1.68 3.21 -1.18 4.98 2.20 0.57 -4.72 119.74 126.47 1jia s LYS 78 Ca 0.05 -0.73 -0.09 0.00 -0.36 0.00 0.00 55.97 54.84 1jia s LYS 78 Cb -0.18 -2.75 0.07 0.00 -1.51 0.00 0.00 37.83 33.46 1jia s LYS 78 CO 0.10 -0.13 0.41 0.09 -0.36 0.00 0.00 175.35 175.45 1jia n ASN 79 N 4.50 -3.24 0.00 1.43 3.02 -1.26 -1.10 115.26 118.62 1jia n ASN 79 Ca -0.19 -0.33 0.00 0.00 -0.03 0.00 0.00 54.58 54.03 1jia n ASN 79 Cb 0.51 -2.71 0.00 0.00 -0.61 0.00 0.00 39.78 36.96 1jia n ASN 79 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jia n GLY 80 N -1.06 0.26 3.51 7.41 0.00 -1.26 -5.09 105.19 108.96 1jia n GLY 80 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 1jia n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jia s THR 81 N -2.00 2.69 -0.09 2.61 2.01 -0.25 -5.12 115.64 115.49 1jia s THR 81 Ca 0.00 -2.27 -0.21 0.00 0.31 0.00 0.00 61.69 59.52 1jia s THR 81 Cb 0.00 -2.41 -0.04 0.00 0.01 0.00 0.00 72.50 70.06 1jia s THR 81 CO 0.00 -0.38 0.59 -0.63 -0.69 0.00 0.00 174.62 173.51 1jia s ILE 82 N -2.42 5.11 -0.22 1.82 1.01 -1.26 -0.32 121.20 124.92 1jia s ILE 82 Ca 0.30 1.19 0.00 0.00 0.00 0.00 0.00 60.65 62.15 1jia s ILE 82 Cb -0.06 -3.93 0.03 0.00 0.01 0.00 0.00 42.46 38.52 1jia s ILE 82 CO 0.16 0.30 -0.12 -0.69 0.00 0.00 0.00 174.94 174.58 1jia s VAL 83 N 0.66 2.44 0.04 2.92 1.01 0.29 -4.93 120.40 122.82 1jia s VAL 83 Ca 0.32 -1.11 -0.29 0.00 0.00 0.00 0.00 61.98 60.90 1jia s VAL 83 Cb -0.16 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.97 1jia s VAL 83 CO 0.14 0.28 0.91 0.00 0.00 0.00 0.00 175.10 176.44 1jia n GLY 85 N 2.62 5.46 0.31 0.00 0.00 0.15 -4.98 105.19 108.75 1jia n GLY 85 Ca 0.03 -1.19 0.04 0.00 0.00 0.00 0.00 46.02 44.89 1jia n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jia n GLY 86 N 2.22 -1.79 0.66 -0.02 0.00 -1.26 -4.44 105.19 100.56 1jia n GLY 86 Ca 0.00 -1.43 0.07 0.00 0.00 0.00 0.00 46.02 44.66 1jia n GLY 86 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jia n ASP 88 N -2.36 2.57 -4.55 1.61 8.00 -1.26 -4.87 116.55 115.69 1jia n ASP 88 Ca -0.00 -1.75 -0.43 0.00 0.71 0.00 0.00 54.79 53.32 1jia n ASP 88 Cb 0.14 -0.12 -0.06 0.00 -0.02 0.00 0.00 41.12 41.07 1jia n ASP 88 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1jia s ASP 89 N -1.10 6.43 0.49 -2.24 -1.08 -1.26 -4.96 116.67 112.94 1jia s ASP 89 Ca 0.22 -0.00 0.22 0.00 -0.52 0.00 0.00 52.55 52.47 1jia s ASP 89 Cb 0.13 -2.37 1.27 0.00 -1.46 0.00 0.00 42.92 40.49 1jia s ASP 89 CO 0.19 -0.80 2.03 1.55 0.52 0.00 0.00 175.17 178.66 1jia h PRO 90 N 8.76 0.00 -0.15 4.34 0.13 -1.94 -2.52 132.00 140.63 1jia h PRO 90 Ca -0.25 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.80 1jia h PRO 90 Cb 1.09 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 1jia h PRO 90 CO 0.92 0.16 -0.22 0.00 -0.23 0.00 0.00 178.00 178.63 1jia h LYS 92 N 0.02 1.06 -0.31 0.00 1.57 -1.90 -2.22 116.57 114.79 1jia h LYS 92 Ca 0.01 -0.30 -0.08 0.00 -1.87 0.00 0.00 60.65 58.41 1jia h LYS 92 Cb 0.78 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.96 1jia h LYS 92 CO 0.05 1.00 -0.14 -0.22 -0.57 0.00 0.00 179.45 179.58 1jia h LYS 93 N 0.99 0.54 -0.77 3.15 3.64 -1.46 -1.15 116.57 121.51 1jia h LYS 93 Ca 0.19 -0.16 0.03 0.00 -1.27 0.00 0.00 60.65 59.44 1jia h LYS 93 Cb 0.49 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.21 1jia h LYS 93 CO 0.02 0.66 0.49 1.49 -2.27 0.00 0.00 179.45 179.84 1jia h GLU 94 N 0.49 0.91 -0.16 1.90 4.81 -0.83 -0.99 114.58 120.72 1jia h GLU 94 Ca 0.09 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1jia h GLU 94 Cb 0.53 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 1jia h GLU 94 CO 0.03 0.60 0.09 0.28 -0.73 0.00 0.00 179.01 179.28 1jia h VAL 95 N 0.94 1.11 -0.78 0.32 2.07 -0.79 -2.46 116.25 116.66 1jia h VAL 95 Ca 0.31 -0.31 0.08 0.00 0.82 0.00 0.00 66.70 67.61 1jia h VAL 95 Cb 0.03 1.02 -0.07 0.00 -1.52 0.00 0.00 31.29 30.75 1jia h VAL 95 CO -0.12 0.10 0.45 0.00 0.02 0.00 0.00 177.57 178.02 1jia h GLU 97 N 0.77 0.44 -0.24 0.00 4.39 -0.86 -0.41 114.58 118.66 1jia h GLU 97 Ca 0.37 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.99 1jia h GLU 97 Cb 0.30 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1jia h GLU 97 CO -0.23 0.44 0.13 0.00 -1.16 0.00 0.00 179.01 178.18 1jia h ASP 99 N 0.27 0.31 0.04 0.00 5.19 -0.94 -1.93 116.42 119.36 1jia h ASP 99 Ca 0.08 -0.29 0.01 0.00 -0.62 0.00 0.00 57.03 56.22 1jia h ASP 99 Cb 0.09 -0.08 -0.02 0.00 0.18 0.00 0.00 39.33 39.50 1jia h ASP 99 CO -0.01 0.52 -0.11 0.50 -3.12 0.00 0.00 179.24 177.03 1jia h LYS 100 N 0.09 -0.19 -0.90 3.56 3.64 -1.14 -1.32 116.57 120.31 1jia h LYS 100 Ca 0.06 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.50 1jia h LYS 100 Cb 0.36 0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.16 1jia h LYS 100 CO 0.01 -0.13 0.57 0.00 -2.27 0.00 0.00 179.45 177.63 1jia h ALA 101 N 0.74 1.23 -0.38 5.00 0.00 -1.22 -1.58 119.26 123.04 1jia h ALA 101 Ca 0.03 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1jia h ALA 101 Cb 0.23 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1jia h ALA 101 CO -0.08 0.36 -0.08 0.00 0.00 0.00 0.00 179.25 179.45 1jia h ALA 102 N 1.41 0.52 -0.39 0.00 0.00 -1.12 -1.70 119.26 117.98 1jia h ALA 102 Ca 0.38 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1jia h ALA 102 Cb 0.12 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1jia h ALA 102 CO -0.16 0.38 -0.14 0.00 0.00 0.00 0.00 179.25 179.32 1jia h ALA 103 N 0.84 1.02 -0.11 0.00 0.00 -0.77 0.01 119.26 120.24 1jia h ALA 103 Ca 0.10 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1jia h ALA 103 Cb 0.59 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1jia h ALA 103 CO 0.04 0.59 -0.02 0.82 0.00 0.00 0.00 179.25 180.68 1jia h ILE 104 N 0.64 1.28 -0.97 0.00 2.04 -1.21 -2.73 117.51 116.56 1jia h ILE 104 Ca 0.11 -0.91 0.15 0.00 1.00 0.00 0.00 64.86 65.21 1jia h ILE 104 Cb 0.61 1.66 -0.10 0.00 -0.74 0.00 0.00 36.82 38.25 1jia h ILE 104 CO 0.04 0.26 0.58 0.00 0.00 0.00 0.00 178.15 179.03 1jia h PHE 106 N 0.81 1.07 -0.00 0.00 0.04 -0.82 -2.36 116.94 115.69 1jia h PHE 106 Ca 0.52 -0.04 -0.00 0.00 2.80 0.00 0.00 57.97 61.26 1jia h PHE 106 Cb 0.70 -0.34 -0.00 0.00 2.20 0.00 0.00 35.95 38.51 1jia h PHE 106 CO -0.02 0.76 -0.00 -0.09 -0.60 0.00 0.00 178.31 178.36 1jia h ARG 107 N 1.08 0.00 0.00 1.51 1.12 -0.67 -2.16 114.38 115.26 1jia h ARG 107 Ca 0.27 -0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.14 1jia h ARG 107 Cb 0.08 -0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.04 1jia h ARG 107 CO -0.04 0.41 0.00 -0.25 -3.11 0.00 0.00 179.97 176.98 1jia n ASP 108 N -4.89 0.55 -0.08 -3.80 8.00 -0.38 -1.65 116.55 114.29 1jia n ASP 108 Ca -0.08 0.75 0.09 0.00 0.71 0.00 0.00 54.79 56.25 1jia n ASP 108 Cb 0.21 -0.82 0.12 0.00 -0.02 0.00 0.00 41.12 40.62 1jia n ASP 108 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1jia n ASN 109 N -2.23 2.34 0.27 -2.24 3.02 -0.90 -4.54 115.26 110.97 1jia n ASN 109 Ca -0.01 -2.94 0.11 0.00 -0.03 0.00 0.00 54.58 51.70 1jia n ASN 109 Cb 0.05 -0.38 0.72 0.00 -0.61 0.00 0.00 39.78 39.56 1jia n ASN 109 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1jia h LEU 110 N 0.04 0.00 -1.50 3.41 5.85 -0.67 -1.82 115.31 120.61 1jia h LEU 110 Ca 0.00 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 1jia h LEU 110 Cb 0.94 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 1jia h LEU 110 CO 0.00 0.05 -0.20 0.07 -0.34 0.00 0.00 178.44 178.03 1jia h LYS 111 N 0.00 0.08 -0.51 1.25 2.10 -1.80 -3.05 116.57 114.63 1jia h LYS 111 Ca -0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 1jia h LYS 111 Cb 0.11 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.43 1jia h LYS 111 CO 0.01 0.27 0.00 0.25 -2.00 0.00 0.00 179.45 177.98 1jia n THR 112 N -4.27 0.87 -1.66 0.07 -2.24 -0.70 -4.98 114.28 101.37 1jia n THR 112 Ca -0.02 -0.93 -0.43 0.00 -2.27 0.00 0.00 64.05 60.40 1jia n THR 112 Cb 0.28 0.62 -0.03 0.00 -2.10 0.00 0.00 70.33 69.10 1jia n THR 112 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1jia s TYR 113 N -1.07 1.26 -0.25 4.78 6.14 -1.15 -4.96 117.35 122.09 1jia s TYR 113 Ca 0.37 0.28 -0.10 0.00 0.64 0.00 0.00 57.07 58.26 1jia s TYR 113 Cb 0.20 -4.02 -0.04 0.00 0.42 0.00 0.00 41.96 38.51 1jia s TYR 113 CO 0.26 -4.39 0.14 0.15 0.64 0.00 0.00 175.55 172.36 1jia s LYS 114 N 5.77 3.92 0.62 4.97 3.01 -1.26 -4.96 119.74 131.80 1jia s LYS 114 Ca 0.95 -0.35 0.33 0.00 -1.01 0.00 0.00 55.97 55.90 1jia s LYS 114 Cb -0.35 -3.50 1.87 0.00 -1.01 0.00 0.00 37.83 34.84 1jia s LYS 114 CO 0.36 -0.07 2.18 -0.22 0.51 0.00 0.00 175.35 178.12 1jia h LYS 115 N 7.93 0.00 0.00 1.68 3.11 -2.01 0.30 116.57 127.59 1jia h LYS 115 Ca -0.37 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.47 1jia h LYS 115 Cb 1.18 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.41 1jia h LYS 115 CO 0.60 0.00 0.00 0.07 -2.81 0.00 0.00 179.45 177.31 1jia h ARG 116 N 0.00 0.00 -0.21 1.90 0.11 -2.01 -2.71 114.38 111.45 1jia h ARG 116 Ca 0.04 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.12 1jia h ARG 116 Cb 0.27 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.35 1jia h ARG 116 CO -0.00 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.73 1jia n TYR 117 N -2.59 0.26 0.24 4.08 4.01 0.10 -4.65 117.16 118.60 1jia n TYR 117 Ca 0.01 -0.13 0.09 0.00 -0.16 0.00 0.00 57.90 57.71 1jia n TYR 117 Cb 0.24 -0.00 0.59 0.00 -0.31 0.00 0.00 39.34 39.86 1jia n TYR 117 CO 0.00 0.00 0.00 1.98 -0.46 0.00 0.00 176.86 178.38 1jia h MET 118 N 4.48 0.00 -1.17 -0.72 4.05 -1.56 0.19 114.93 120.20 1jia h MET 118 Ca 0.00 0.00 -0.38 0.00 -0.28 0.00 0.00 59.70 59.04 1jia h MET 118 Cb 0.97 0.00 -0.35 0.00 -0.80 0.00 0.00 31.60 31.42 1jia h MET 118 CO 0.00 0.19 -1.05 0.00 0.23 0.00 0.00 176.91 176.28 1jia n ALA 119 N -2.36 2.36 -1.71 0.39 0.00 -1.25 -3.58 120.51 114.35 1jia n ALA 119 Ca -0.02 -2.90 -0.43 0.00 0.00 0.00 0.00 53.44 50.10 1jia n ALA 119 Cb 0.28 -0.96 -0.03 0.00 0.00 0.00 0.00 19.45 18.74 1jia n ALA 119 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1jia n TYR 120 N 0.04 2.67 -1.78 0.00 9.36 -1.14 -4.92 117.16 121.38 1jia n TYR 120 Ca 0.13 0.06 -0.42 0.00 3.32 0.00 0.00 57.90 60.99 1jia n TYR 120 Cb 0.76 -2.66 -0.03 0.00 -0.63 0.00 0.00 39.34 36.78 1jia n TYR 120 CO 0.00 0.00 0.00 -2.14 0.22 0.00 0.00 176.86 174.94 1jia s PRO 121 N 1.26 4.00 0.54 2.98 0.02 -1.26 -4.84 135.00 137.71 1jia s PRO 121 Ca 0.76 2.36 0.28 0.00 0.02 0.00 0.00 61.00 64.42 1jia s PRO 121 Cb -0.53 -4.13 1.44 0.00 0.02 0.00 0.00 34.50 31.30 1jia s PRO 121 CO 0.33 -1.09 1.96 0.22 -0.33 0.00 0.00 177.00 178.09 1jia h ASP 122 N 10.87 0.00 0.74 2.53 3.58 -1.91 0.17 116.42 132.40 1jia h ASP 122 Ca -0.45 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.00 1jia h ASP 122 Cb 1.22 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.27 1jia h ASP 122 CO 0.95 0.00 -0.00 0.16 -2.88 0.00 0.00 179.24 177.47 1jia h ILE 124 N 0.00 0.00 -0.00 2.25 3.07 -2.02 -2.29 117.51 118.52 1jia h ILE 124 Ca 0.29 -0.37 0.00 0.00 1.55 0.00 0.00 64.86 66.33 1jia h ILE 124 Cb 1.20 1.37 0.00 0.00 -0.27 0.00 0.00 36.82 39.12 1jia h ILE 124 CO -0.00 0.00 -0.06 0.18 -1.05 0.00 0.00 178.15 177.22 1jia n LEU 125 N -3.09 0.35 -4.72 0.16 4.77 0.05 -4.77 117.00 109.74 1jia n LEU 125 Ca -0.00 0.04 -0.40 0.00 -0.03 0.00 0.00 56.01 55.61 1jia n LEU 125 Cb 0.24 -0.16 -0.04 0.00 -2.33 0.00 0.00 43.42 41.12 1jia n LEU 125 CO 0.25 0.06 0.48 0.00 -1.33 0.00 0.00 177.39 176.85 1jia n SER 127 N 3.48 -2.31 -0.04 0.00 2.88 -1.26 -4.82 113.62 111.55 1jia n SER 127 Ca -0.00 0.03 -0.10 0.00 -1.33 0.00 0.00 58.87 57.47 1jia n SER 127 Cb 0.51 -1.04 -0.09 0.00 -0.75 0.00 0.00 64.21 62.84 1jia n SER 127 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1jia h SER 128 N -1.88 -0.03 -1.75 -3.46 4.64 -1.95 -2.97 113.55 106.15 1jia h SER 128 Ca -0.50 -0.62 -0.52 0.00 -0.47 0.00 0.00 61.79 59.68 1jia h SER 128 Cb 1.33 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1jia h SER 128 CO 0.37 0.74 1.58 0.29 -0.87 0.00 0.00 176.83 178.94 1jia n LYS 129 N -4.72 1.43 -3.29 4.77 5.02 -1.26 -3.99 118.16 116.12 1jia n LYS 129 Ca -0.07 0.23 -0.38 0.00 -2.02 0.00 0.00 58.31 56.07 1jia n LYS 129 Cb 0.31 -3.34 -0.06 0.00 -0.02 0.00 0.00 35.03 31.93 1jia n LYS 129 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1jia s SER 130 N 10.52 7.01 0.49 4.39 0.01 -1.26 -3.78 113.70 131.09 1jia s SER 130 Ca 1.00 1.23 -0.21 0.00 1.31 0.00 0.00 55.95 59.27 1jia s SER 130 Cb -0.26 -2.35 -0.07 0.00 0.21 0.00 0.00 66.02 63.56 1jia s SER 130 CO 0.30 0.23 1.13 -0.70 0.41 0.00 0.00 173.24 174.61 1jia s GLU 131 N -1.33 3.65 0.21 12.44 2.12 -0.76 -4.89 118.70 130.13 1jia s GLU 131 Ca 0.31 1.64 -0.08 0.00 0.36 0.00 0.00 54.97 57.20 1jia s GLU 131 Cb -0.18 -2.23 -0.07 0.00 0.26 0.00 0.00 34.13 31.91 1jia s GLU 131 CO 0.19 -0.61 0.51 0.15 -0.54 0.00 0.00 175.26 174.95 1jia s LYS 132 N -2.96 3.75 0.00 4.30 1.02 -1.26 -4.99 119.74 119.59 1jia s LYS 132 Ca 0.67 0.17 0.21 0.00 0.02 0.00 0.00 55.97 57.03 1jia s LYS 132 Cb -0.25 -2.70 1.23 0.00 -0.52 0.00 0.00 37.83 35.59 1jia s LYS 132 CO 0.29 0.35 1.61 0.00 -0.92 0.00 0.00 175.35 176.68