#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h4c n LEU 2 N 0.00 0.00 0.10 -4.53 4.77 -1.26 -2.24 117.00 113.84 2h4c n LEU 2 Ca 0.00 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.75 2h4c n LEU 2 Cb 0.00 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 40.94 2h4c n LEU 2 CO 0.00 0.00 -0.10 -0.26 -1.33 0.00 0.00 177.39 175.70 2h4c h PHE 3 N 0.00 0.87 0.00 -1.77 0.05 -1.98 -2.88 116.94 111.22 2h4c h PHE 3 Ca 0.00 -0.60 -0.15 0.00 3.82 0.00 0.00 57.97 61.04 2h4c h PHE 3 Cb 0.00 -0.05 -0.02 0.00 2.00 0.00 0.00 35.95 37.88 2h4c h PHE 3 CO 0.00 1.46 -0.73 1.96 -0.18 0.00 0.00 178.31 180.82 2h4c h GLN 4 N 0.04 0.00 -0.20 1.51 4.20 -1.87 -2.23 115.11 116.55 2h4c h GLN 4 Ca -0.20 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.48 2h4c h GLN 4 Cb 1.93 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.71 2h4c h GLN 4 CO 0.23 0.67 0.02 0.35 -0.67 0.00 0.00 178.83 179.43 2h4c h PHE 5 N 0.00 0.36 -0.03 2.96 3.57 -1.58 0.15 116.94 122.37 2h4c h PHE 5 Ca -0.02 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.40 2h4c h PHE 5 Cb 1.54 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 40.17 2h4c h PHE 5 CO 0.00 0.50 -0.13 0.00 -2.23 0.00 0.00 178.31 176.45 2h4c h ALA 6 N 0.82 1.72 0.02 2.41 0.00 -1.49 0.26 119.26 123.01 2h4c h ALA 6 Ca 0.06 -0.14 -0.22 0.00 0.00 0.00 0.00 54.91 54.61 2h4c h ALA 6 Cb 0.33 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2h4c h ALA 6 CO 0.01 0.21 -1.05 0.00 0.00 0.00 0.00 179.25 178.42 2h4c h ARG 7 N 0.05 0.05 -0.01 0.00 3.08 -0.93 -1.40 114.38 115.22 2h4c h ARG 7 Ca 0.01 -0.09 -0.15 0.00 0.07 0.00 0.00 59.98 59.82 2h4c h ARG 7 Cb 0.26 0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.36 2h4c h ARG 7 CO 0.02 1.04 -0.59 -0.07 -1.07 0.00 0.00 179.97 179.30 2h4c h LEU 8 N 0.01 0.53 0.35 3.04 3.38 -0.09 -0.77 115.31 121.77 2h4c h LEU 8 Ca -0.03 -0.75 -0.01 0.00 0.09 0.00 0.00 57.88 57.17 2h4c h LEU 8 Cb 1.81 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.39 2h4c h LEU 8 CO 0.14 1.21 -0.28 0.40 0.09 0.00 0.00 178.44 180.01 2h4c h ILE 9 N -0.09 0.00 -0.62 1.22 2.04 -0.59 -0.95 117.51 118.52 2h4c h ILE 9 Ca -0.07 0.00 0.18 0.00 1.00 0.00 0.00 64.86 65.97 2h4c h ILE 9 Cb 1.30 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 2h4c h ILE 9 CO 0.12 0.00 0.61 0.44 0.00 0.00 0.00 178.15 179.31 2h4c h ASP 10 N -0.61 0.00 0.46 1.72 3.32 -1.33 1.04 116.42 121.02 2h4c h ASP 10 Ca -0.05 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 2h4c h ASP 10 Cb 0.51 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.06 2h4c h ASP 10 CO 0.00 0.00 -0.11 0.00 -1.72 0.00 0.00 179.24 177.41 2h4c h ALA 11 N 1.36 1.20 -0.36 3.45 0.00 0.26 -0.69 119.26 124.48 2h4c h ALA 11 Ca 0.29 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2h4c h ALA 11 Cb 1.50 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.28 2h4c h ALA 11 CO -0.00 0.14 0.00 1.63 0.00 0.00 0.00 179.25 181.01 2h4c n LYS 12 N -3.51 2.32 -3.15 0.00 4.76 0.36 -4.87 118.16 114.07 2h4c n LYS 12 Ca -0.01 -2.11 0.04 0.00 -2.87 0.00 0.00 58.31 53.36 2h4c n LYS 12 Cb 0.25 -1.42 -0.00 0.00 -1.84 0.00 0.00 35.03 32.02 2h4c n LYS 12 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 2h4c s GLN 13 N -1.23 0.45 0.00 1.97 -0.21 -0.27 -4.53 119.66 115.85 2h4c s GLN 13 Ca 0.32 0.38 0.00 0.00 0.02 0.00 0.00 55.36 56.09 2h4c s GLN 13 Cb 0.19 0.19 0.00 0.00 1.00 0.00 0.00 33.01 34.38 2h4c s GLN 13 CO 0.25 -0.83 0.00 0.39 -2.12 0.00 0.00 175.29 172.99 2h4c n GLU 14 N 5.25 0.00 -4.09 2.91 1.02 -1.24 -4.34 120.64 120.16 2h4c n GLU 14 Ca 0.07 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.11 2h4c n GLU 14 Cb 0.55 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.87 2h4c n GLU 14 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2h4c s ALA 16 N -0.48 0.56 0.00 0.62 0.00 -1.26 -4.54 121.76 116.66 2h4c s ALA 16 Ca 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 50.90 2h4c s ALA 16 Cb 0.00 0.19 0.00 0.00 0.00 0.00 0.00 23.12 23.31 2h4c s ALA 16 CO 0.00 -0.25 0.00 1.19 0.00 0.00 0.00 175.76 176.70 2h4c n PHE 17 N 0.55 0.00 0.67 0.00 3.01 -1.26 -4.76 117.46 115.67 2h4c n PHE 17 Ca -0.17 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.35 2h4c n PHE 17 Cb 0.59 -1.32 0.32 0.00 -0.01 0.00 0.00 39.48 39.06 2h4c n PHE 17 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 2h4c n SER 18 N 0.00 0.00 -0.57 4.37 3.41 -1.26 -0.93 113.62 118.64 2h4c n SER 18 Ca 0.00 -0.31 0.13 0.00 -0.26 0.00 0.00 58.87 58.43 2h4c n SER 18 Cb 0.00 -0.01 0.44 0.00 -0.26 0.00 0.00 64.21 64.38 2h4c n SER 18 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 2h4c n PHE 19 N -1.01 0.03 0.30 7.33 1.16 -1.26 -3.78 117.46 120.23 2h4c n PHE 19 Ca 0.08 -0.02 0.17 0.00 -1.87 0.00 0.00 57.45 55.82 2h4c n PHE 19 Cb 0.04 0.00 0.75 0.00 -1.61 0.00 0.00 39.48 38.65 2h4c n PHE 19 CO 0.00 0.00 0.00 0.74 -1.87 0.00 0.00 176.76 175.63 2h4c h PHE 20 N 2.72 0.00 -0.42 2.97 0.05 -1.42 -2.95 116.94 117.89 2h4c h PHE 20 Ca 0.00 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 2h4c h PHE 20 Cb 0.58 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.53 2h4c h PHE 20 CO 0.02 0.00 0.00 0.36 -0.18 0.00 0.00 178.31 178.51 2h4c n LYS 21 N -2.93 3.38 0.00 1.51 2.85 -1.25 -3.57 118.16 118.15 2h4c n LYS 21 Ca 0.00 -2.10 0.00 0.00 -1.05 0.00 0.00 58.31 55.17 2h4c n LYS 21 Cb 0.25 -1.90 0.00 0.00 -0.65 0.00 0.00 35.03 32.73 2h4c n LYS 21 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2h4c n TYR 22 N 0.54 0.00 -0.28 5.58 4.01 -1.11 -4.65 117.16 121.25 2h4c n TYR 22 Ca 0.19 -0.06 0.10 0.00 -0.16 0.00 0.00 57.90 57.97 2h4c n TYR 22 Cb 0.81 -0.01 0.24 0.00 -0.31 0.00 0.00 39.34 40.07 2h4c n TYR 22 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 2h4c h ILE 23 N 0.75 0.35 -1.18 -0.72 1.08 -1.65 -2.04 117.51 114.10 2h4c h ILE 23 Ca 0.00 -0.07 -0.15 0.00 -0.39 0.00 0.00 64.86 64.26 2h4c h ILE 23 Cb 0.37 0.14 -0.20 0.00 -3.07 0.00 0.00 36.82 34.05 2h4c h ILE 23 CO 0.00 0.04 -0.51 -0.55 -0.69 0.00 0.00 178.15 176.43 2h4c s SER 24 N -5.14 -1.05 -0.07 1.72 0.15 -1.26 -2.63 113.70 105.42 2h4c s SER 24 Ca -0.12 -1.24 -0.00 0.00 0.70 0.00 0.00 55.95 55.29 2h4c s SER 24 Cb 0.24 1.68 0.02 0.00 -1.71 0.00 0.00 66.02 66.25 2h4c s SER 24 CO 0.77 -0.15 -0.03 -0.47 1.20 0.00 0.00 173.24 174.55 2h4c s TYR 25 N 1.46 0.89 0.00 3.44 6.14 -1.10 0.15 117.35 128.32 2h4c s TYR 25 Ca 0.21 -0.31 0.00 0.00 0.64 0.00 0.00 57.07 57.60 2h4c s TYR 25 Cb -0.04 -0.86 0.00 0.00 0.42 0.00 0.00 41.96 41.47 2h4c s TYR 25 CO -0.06 -0.33 0.00 0.41 0.64 0.00 0.00 175.55 176.21 2h4c n GLY 26 N 4.74 -0.63 0.01 8.97 0.00 -0.63 -2.32 105.19 115.35 2h4c n GLY 26 Ca -0.14 -1.13 0.12 0.00 0.00 0.00 0.00 46.02 44.87 2h4c n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h4c n TYR 28 N -1.63 0.00 -1.68 0.00 4.02 -1.26 -2.55 117.16 114.07 2h4c n TYR 28 Ca 0.05 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.51 2h4c n TYR 28 Cb 0.36 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.67 2h4c n TYR 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2h4c n GLY 30 N 1.03 2.88 3.52 0.00 0.00 -0.77 -2.73 105.19 109.13 2h4c n GLY 30 Ca 0.06 0.30 -0.43 0.00 0.00 0.00 0.00 46.02 45.95 2h4c n GLY 30 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2h4c s TRP 31 N 0.00 2.86 0.00 1.61 0.52 -1.08 -4.79 118.94 118.07 2h4c s TRP 31 Ca 0.00 -1.26 0.00 0.00 0.02 0.00 0.00 56.10 54.86 2h4c s TRP 31 Cb 0.00 -4.53 0.00 0.00 -1.15 0.00 0.00 33.47 27.79 2h4c s TRP 31 CO 0.00 -1.71 0.00 0.41 0.02 0.00 0.00 176.95 175.67 2h4c n GLY 32 N 5.94 2.63 0.95 0.98 0.00 -1.25 -4.86 105.19 109.58 2h4c n GLY 32 Ca 0.32 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.45 2h4c n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h4c n GLY 33 N 0.00 1.15 3.11 -0.02 0.00 -1.06 -4.98 105.19 103.39 2h4c n GLY 33 Ca 0.00 -0.42 -0.12 0.00 0.00 0.00 0.00 46.02 45.47 2h4c n GLY 33 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2h4c s GLN 34 N -2.50 0.26 1.69 1.61 0.74 -1.12 -5.07 119.66 115.28 2h4c s GLN 34 Ca 0.00 0.44 0.00 0.00 0.05 0.00 0.00 55.36 55.85 2h4c s GLN 34 Cb 0.00 0.02 0.00 0.00 1.10 0.00 0.00 33.01 34.13 2h4c s GLN 34 CO 0.00 -0.09 0.00 0.41 -0.55 0.00 0.00 175.29 175.06 2h4c n GLY 35 N 3.55 0.65 3.29 2.59 0.00 -1.25 -4.69 105.19 109.33 2h4c n GLY 35 Ca -0.19 -1.35 -0.31 0.00 0.00 0.00 0.00 46.02 44.17 2h4c n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2h4c s THR 36 N 0.00 2.12 -0.30 2.61 2.01 -1.26 -1.11 115.64 119.71 2h4c s THR 36 Ca 0.00 -1.06 -0.33 0.00 0.31 0.00 0.00 61.69 60.61 2h4c s THR 36 Cb 0.00 -1.76 -0.09 0.00 0.01 0.00 0.00 72.50 70.66 2h4c s THR 36 CO 0.00 0.57 2.20 -2.65 -0.69 0.00 0.00 174.62 174.05 2h4c n PRO 37 N 2.78 1.36 -0.03 4.92 -0.02 -1.26 -4.65 135.00 138.10 2h4c n PRO 37 Ca -0.17 0.37 0.18 0.00 -2.02 0.00 0.00 63.50 61.86 2h4c n PRO 37 Cb 0.52 -2.71 0.64 0.00 -0.02 0.00 0.00 33.50 31.92 2h4c n PRO 37 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2h4c h LYS 38 N 13.23 0.11 -1.97 -0.52 1.79 -1.96 -3.45 116.57 123.80 2h4c h LYS 38 Ca -0.32 -0.01 0.32 0.00 -2.18 0.00 0.00 60.65 58.46 2h4c h LYS 38 Cb 1.30 -0.03 -0.08 0.00 -1.58 0.00 0.00 32.23 31.84 2h4c h LYS 38 CO 1.00 0.07 0.84 0.16 -1.08 0.00 0.00 179.45 180.45 2h4c s ASP 39 N -6.20 -0.01 0.10 0.86 1.47 -1.26 -4.98 116.67 106.65 2h4c s ASP 39 Ca -0.06 -0.24 -0.12 0.00 1.18 0.00 0.00 52.55 53.32 2h4c s ASP 39 Cb 0.20 0.19 0.06 0.00 -0.34 0.00 0.00 42.92 43.03 2h4c s ASP 39 CO 0.74 -0.37 0.78 0.00 0.68 0.00 0.00 175.17 177.00 2h4c n ALA 40 N -0.76 -0.17 0.49 2.11 0.00 -1.26 0.50 120.51 121.42 2h4c n ALA 40 Ca -0.01 0.47 -0.20 0.00 0.00 0.00 0.00 53.44 53.71 2h4c n ALA 40 Cb 0.60 -0.16 -0.09 0.00 0.00 0.00 0.00 19.45 19.79 2h4c n ALA 40 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2h4c h THR 41 N 0.00 0.05 -0.83 0.00 2.02 -1.90 -2.01 112.91 110.25 2h4c h THR 41 Ca 0.14 -0.05 0.18 0.00 0.77 0.00 0.00 66.41 67.44 2h4c h THR 41 Cb 0.26 0.06 -0.15 0.00 -1.74 0.00 0.00 68.15 66.58 2h4c h THR 41 CO -0.49 0.00 -0.13 -0.78 0.37 0.00 0.00 175.52 174.49 2h4c h ASP 42 N -1.28 -0.64 -0.19 4.18 3.58 -0.29 0.66 116.42 122.44 2h4c h ASP 42 Ca -0.13 0.24 0.04 0.00 0.42 0.00 0.00 57.03 57.61 2h4c h ASP 42 Cb 0.95 0.47 -0.07 0.00 1.72 0.00 0.00 39.33 42.40 2h4c h ASP 42 CO 0.21 -0.26 -0.49 0.03 -2.88 0.00 0.00 179.24 175.85 2h4c h ARG 43 N 0.02 -0.49 -0.86 0.28 2.47 -0.15 0.85 114.38 116.50 2h4c h ARG 43 Ca 0.43 0.03 0.19 0.00 -1.26 0.00 0.00 59.98 59.37 2h4c h ARG 43 Cb 0.71 0.11 -0.16 0.00 -1.65 0.00 0.00 29.97 28.98 2h4c h ARG 43 CO -0.82 -0.32 -0.14 0.00 0.56 0.00 0.00 179.97 179.25 2h4c h PHE 46 N -0.48 -1.23 -0.38 0.00 3.57 0.46 0.73 116.94 119.62 2h4c h PHE 46 Ca 0.00 0.07 0.03 0.00 3.53 0.00 0.00 57.97 61.60 2h4c h PHE 46 Cb 0.51 0.59 -0.02 0.00 2.79 0.00 0.00 35.95 39.82 2h4c h PHE 46 CO 0.10 -0.32 0.25 0.28 -2.23 0.00 0.00 178.31 176.40 2h4c h VAL 47 N -0.20 1.03 0.10 1.41 2.07 -1.12 -2.15 116.25 117.39 2h4c h VAL 47 Ca 0.07 -0.14 0.01 0.00 0.82 0.00 0.00 66.70 67.46 2h4c h VAL 47 Cb 0.38 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 2h4c h VAL 47 CO -0.48 0.07 -0.16 -0.74 0.02 0.00 0.00 177.57 176.28 2h4c h HIS 48 N 0.41 -0.41 0.51 1.57 -0.00 -0.06 0.59 115.15 117.76 2h4c h HIS 48 Ca 0.15 0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.51 2h4c h HIS 48 Cb 0.11 0.17 -0.02 0.00 -0.00 0.00 0.00 27.41 27.67 2h4c h HIS 48 CO -0.00 -0.24 -0.47 -0.44 -0.00 0.00 0.00 177.93 176.79 2h4c h ASP 49 N -0.31 -1.27 -0.05 3.26 3.32 -0.58 0.30 116.42 121.09 2h4c h ASP 49 Ca 0.02 0.10 0.02 0.00 0.02 0.00 0.00 57.03 57.18 2h4c h ASP 49 Cb 0.33 0.41 -0.00 0.00 0.22 0.00 0.00 39.33 40.29 2h4c h ASP 49 CO -0.08 -0.63 0.47 0.00 -1.72 0.00 0.00 179.24 177.28 2h4c h TYR 52 N 0.20 -0.16 0.00 0.00 0.05 -0.32 -1.91 116.97 114.83 2h4c h TYR 52 Ca -0.15 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.62 2h4c h TYR 52 Cb 1.74 0.05 0.00 0.00 1.01 0.00 0.00 36.73 39.53 2h4c h TYR 52 CO 0.12 -0.09 0.52 0.00 -1.05 0.00 0.00 178.16 177.66 2h4c n ALA 53 N -2.17 0.22 -1.92 3.88 0.00 -0.92 -0.34 120.51 119.26 2h4c n ALA 53 Ca -0.08 0.03 -0.26 0.00 0.00 0.00 0.00 53.44 53.12 2h4c n ALA 53 Cb 0.10 -0.26 0.03 0.00 0.00 0.00 0.00 19.45 19.32 2h4c n ALA 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2h4c n ARG 54 N -1.58 3.43 -4.16 0.00 1.74 -0.72 -4.95 116.66 110.41 2h4c n ARG 54 Ca -0.00 -4.02 -0.30 0.00 -0.77 0.00 0.00 57.85 52.76 2h4c n ARG 54 Cb 0.52 -2.28 -0.16 0.00 -1.02 0.00 0.00 32.46 29.52 2h4c n ARG 54 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2h4c s VAL 55 N -4.70 1.65 -0.10 1.55 1.01 0.54 -5.06 120.40 115.28 2h4c s VAL 55 Ca 0.53 -0.70 -0.13 0.00 0.00 0.00 0.00 61.98 61.68 2h4c s VAL 55 Cb 0.43 -1.53 -0.05 0.00 0.00 0.00 0.00 36.38 35.23 2h4c s VAL 55 CO 0.01 0.47 0.32 -0.54 0.00 0.00 0.00 175.10 175.37 2h4c s LYS 56 N 1.32 4.04 0.00 2.72 1.02 -1.26 -4.84 119.74 122.74 2h4c s LYS 56 Ca 0.02 0.19 0.00 0.00 0.02 0.00 0.00 55.97 56.20 2h4c s LYS 56 Cb -0.13 -3.33 0.00 0.00 -0.52 0.00 0.00 37.83 33.85 2h4c s LYS 56 CO -0.09 0.45 0.00 0.41 -0.92 0.00 0.00 175.35 175.20 2h4c n GLY 58 N 2.70 1.00 3.22 -3.33 0.00 -1.26 -4.45 105.19 103.07 2h4c n GLY 58 Ca -0.13 -0.94 -0.33 0.00 0.00 0.00 0.00 46.02 44.61 2h4c n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h4c s ASN 61 N -1.69 4.36 0.29 0.00 3.84 -1.26 -5.02 114.94 115.45 2h4c s ASN 61 Ca 0.52 -0.29 0.01 0.00 0.21 0.00 0.00 52.86 53.31 2h4c s ASN 61 Cb -0.07 -1.71 0.69 0.00 -0.55 0.00 0.00 41.25 39.61 2h4c s ASN 61 CO 0.65 0.10 1.62 -0.65 -2.79 0.00 0.00 177.10 176.04 2h4c h PRO 68 N 7.20 0.13 0.00 0.43 0.11 -1.94 -0.36 132.00 137.57 2h4c h PRO 68 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2h4c h PRO 68 Cb 1.19 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2h4c h PRO 68 CO 0.59 0.09 -1.04 1.17 -0.21 0.00 0.00 178.00 178.60 2h4c n LYS 69 N -5.31 0.39 -0.07 1.05 4.81 -1.26 -3.43 118.16 114.34 2h4c n LYS 69 Ca 0.21 0.02 -0.15 0.00 -0.87 0.00 0.00 58.31 57.52 2h4c n LYS 69 Cb 0.68 -1.65 -0.13 0.00 0.02 0.00 0.00 35.03 33.95 2h4c n LYS 69 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 2h4c h LEU 70 N 0.00 0.01 -9.54 3.14 3.38 -1.85 -3.36 115.31 107.08 2h4c h LEU 70 Ca 0.00 -0.92 -0.56 0.00 0.09 0.00 0.00 57.88 56.49 2h4c h LEU 70 Cb 0.82 -0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.62 2h4c h LEU 70 CO 0.00 1.08 0.94 1.33 0.09 0.00 0.00 178.44 181.88 2h4c n VAL 71 N -4.57 0.09 -3.34 1.22 0.24 -0.19 -4.65 118.33 107.13 2h4c n VAL 71 Ca -0.14 -0.02 -0.47 0.00 -2.04 0.00 0.00 64.34 61.68 2h4c n VAL 71 Cb 0.52 -1.79 -0.02 0.00 -1.47 0.00 0.00 33.84 31.07 2h4c n VAL 71 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2h4c s GLU 72 N 1.47 3.53 0.89 7.34 2.12 -1.26 -0.41 118.70 132.37 2h4c s GLU 72 Ca 0.79 -2.40 -0.12 0.00 0.36 0.00 0.00 54.97 53.60 2h4c s GLU 72 Cb -0.59 -4.40 0.12 0.00 0.26 0.00 0.00 34.13 29.52 2h4c s GLU 72 CO 0.37 -1.29 1.13 1.52 -0.54 0.00 0.00 175.26 176.45 2h4c s TYR 73 N 0.28 2.58 -0.11 5.30 -0.85 -1.26 -5.00 117.35 118.29 2h4c s TYR 73 Ca 0.17 0.91 0.03 0.00 -0.52 0.00 0.00 57.07 57.66 2h4c s TYR 73 Cb -0.12 -3.34 -0.00 0.00 0.38 0.00 0.00 41.96 38.88 2h4c s TYR 73 CO -0.08 -2.24 -0.22 -1.54 -1.52 0.00 0.00 175.55 169.95 2h4c s SER 74 N -4.01 3.24 0.45 -0.18 1.04 -1.26 -4.98 113.70 107.99 2h4c s SER 74 Ca 0.63 -0.53 0.03 0.00 0.48 0.00 0.00 55.95 56.56 2h4c s SER 74 Cb -0.15 -1.45 -0.02 0.00 0.10 0.00 0.00 66.02 64.51 2h4c s SER 74 CO 0.53 0.15 0.10 -0.72 0.98 0.00 0.00 173.24 174.28 2h4c s TYR 75 N 0.39 1.80 -0.39 5.02 1.13 -1.26 -3.27 117.35 120.76 2h4c s TYR 75 Ca -0.17 -1.22 0.07 0.00 -1.41 0.00 0.00 57.07 54.35 2h4c s TYR 75 Cb -0.17 -1.28 0.18 0.00 -1.10 0.00 0.00 41.96 39.58 2h4c s TYR 75 CO 0.07 -0.17 0.59 0.45 -2.51 0.00 0.00 175.55 173.99 2h4c s SER 76 N -3.70 -1.22 -0.47 -0.18 0.15 -0.76 -4.95 113.70 102.57 2h4c s SER 76 Ca 0.17 -0.74 -0.27 0.00 0.70 0.00 0.00 55.95 55.81 2h4c s SER 76 Cb 0.02 1.81 -0.02 0.00 -1.71 0.00 0.00 66.02 66.11 2h4c s SER 76 CO 0.11 -0.20 1.87 -0.47 1.20 0.00 0.00 173.24 175.75 2h4c s TYR 77 N 1.94 1.69 -0.02 3.44 5.04 -1.25 -1.69 117.35 126.49 2h4c s TYR 77 Ca 0.15 0.77 0.05 0.00 -2.44 0.00 0.00 57.07 55.60 2h4c s TYR 77 Cb -0.06 -4.07 -0.03 0.00 0.35 0.00 0.00 41.96 38.15 2h4c s TYR 77 CO -0.09 -2.62 -0.15 1.03 -1.34 0.00 0.00 175.55 172.38 2h4c s ARG 78 N 6.48 2.39 -0.79 4.97 0.52 0.44 -4.77 118.95 128.18 2h4c s ARG 78 Ca 0.75 -0.78 -0.09 0.00 -0.52 0.00 0.00 55.73 55.09 2h4c s ARG 78 Cb -0.17 -2.33 0.09 0.00 0.52 0.00 0.00 34.95 33.06 2h4c s ARG 78 CO 0.27 0.60 0.23 0.25 0.02 0.00 0.00 175.30 176.67 2h4c n THR 79 N 2.06 -0.04 -0.12 0.02 -2.24 -1.26 0.19 114.28 112.89 2h4c n THR 79 Ca -0.17 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 2h4c n THR 79 Cb 0.52 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 2h4c n THR 79 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2h4c n GLY 80 N -0.83 0.93 2.94 3.38 0.00 -1.26 -5.09 105.19 105.26 2h4c n GLY 80 Ca 0.03 -0.06 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 2h4c n GLY 80 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2h4c s LYS 81 N -0.58 0.10 -0.67 1.61 2.20 0.51 -5.10 119.74 117.81 2h4c s LYS 81 Ca 0.00 0.28 -0.27 0.00 -0.36 0.00 0.00 55.97 55.62 2h4c s LYS 81 Cb 0.00 -0.10 0.04 0.00 -1.51 0.00 0.00 37.83 36.26 2h4c s LYS 81 CO 0.00 -0.11 1.19 0.42 -0.36 0.00 0.00 175.35 176.49 2h4c s ILE 82 N 0.76 3.94 -0.82 5.43 1.01 -1.26 0.17 121.20 130.42 2h4c s ILE 82 Ca -0.06 0.45 -0.26 0.00 0.00 0.00 0.00 60.65 60.79 2h4c s ILE 82 Cb -0.08 -4.80 0.04 0.00 0.01 0.00 0.00 42.46 37.63 2h4c s ILE 82 CO -0.03 -1.59 1.31 -0.69 0.00 0.00 0.00 174.94 173.93 2h4c s VAL 83 N 5.15 3.82 -0.70 2.92 1.01 -0.68 -4.87 120.40 127.05 2h4c s VAL 83 Ca 0.35 0.02 -0.27 0.00 0.00 0.00 0.00 61.98 62.08 2h4c s VAL 83 Cb -0.09 -4.94 0.02 0.00 0.00 0.00 0.00 36.38 31.37 2h4c s VAL 83 CO 0.18 -1.86 1.34 0.00 0.00 0.00 0.00 175.10 174.76 2h4c s GLY 85 N 4.12 -0.48 0.00 0.00 0.00 -1.20 -5.01 107.32 104.75 2h4c s GLY 85 Ca 0.40 1.89 0.00 0.00 0.00 0.00 0.00 44.72 47.01 2h4c s GLY 85 CO 0.17 1.84 0.00 0.61 0.00 0.00 0.00 173.10 175.72 2h4c n GLY 86 N 3.72 -1.49 0.00 0.20 0.00 -1.26 -4.66 105.19 101.69 2h4c n GLY 86 Ca -0.19 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.59 2h4c n GLY 86 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2h4c n ASP 88 N 3.00 0.00 -4.16 1.61 5.75 -1.26 -4.84 116.55 116.65 2h4c n ASP 88 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 54.79 54.43 2h4c n ASP 88 Cb 0.00 0.00 0.08 0.00 -1.03 0.00 0.00 41.12 40.17 2h4c n ASP 88 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2h4c n ASP 89 N 0.00 -3.91 0.35 -1.12 8.00 -1.26 -4.66 116.55 113.96 2h4c n ASP 89 Ca 0.00 0.16 -0.18 0.00 0.71 0.00 0.00 54.79 55.48 2h4c n ASP 89 Cb 0.00 -0.88 -0.09 0.00 -0.02 0.00 0.00 41.12 40.13 2h4c n ASP 89 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 2h4c h PRO 90 N -1.31 -1.02 -0.21 -0.24 0.11 -1.96 -2.69 132.00 124.69 2h4c h PRO 90 Ca -0.44 0.07 0.04 0.00 0.11 0.00 0.00 66.00 65.77 2h4c h PRO 90 Cb 1.32 0.23 -0.04 0.00 0.11 0.00 0.00 31.00 32.62 2h4c h PRO 90 CO 0.28 -0.68 -0.07 0.00 -0.21 0.00 0.00 178.00 177.32 2h4c h LEU 92 N 0.00 0.01 -0.80 0.00 3.38 -1.91 -2.23 115.31 113.76 2h4c h LEU 92 Ca 0.08 -0.80 0.15 0.00 0.09 0.00 0.00 57.88 57.40 2h4c h LEU 92 Cb 0.13 -0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.78 2h4c h LEU 92 CO -0.21 0.81 0.35 -0.09 0.09 0.00 0.00 178.44 179.40 2h4c h ARG 93 N -0.79 0.48 -0.00 1.13 2.43 0.68 0.51 114.38 118.81 2h4c h ARG 93 Ca -0.00 -0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 58.97 2h4c h ARG 93 Cb 0.81 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.23 2h4c h ARG 93 CO 0.00 0.32 -0.78 0.00 -1.51 0.00 0.00 179.97 178.00 2h4c h ALA 94 N 1.57 0.71 0.39 2.80 0.00 0.32 -1.48 119.26 123.57 2h4c h ALA 94 Ca 0.45 -0.71 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 2h4c h ALA 94 Cb 0.68 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2h4c h ALA 94 CO -0.40 0.97 -0.19 0.28 0.00 0.00 0.00 179.25 179.91 2h4c h VAL 95 N 0.00 0.41 -0.84 0.00 2.07 -0.49 1.03 116.25 118.44 2h4c h VAL 95 Ca -0.01 -0.63 0.24 0.00 0.82 0.00 0.00 66.70 67.12 2h4c h VAL 95 Cb 1.39 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 2h4c h VAL 95 CO 0.10 0.08 0.80 0.00 0.02 0.00 0.00 177.57 178.58 2h4c h GLU 97 N 0.00 -0.12 -1.17 0.00 3.07 -0.09 0.28 114.58 116.55 2h4c h GLU 97 Ca 0.40 0.01 0.36 0.00 -0.50 0.00 0.00 59.36 59.62 2h4c h GLU 97 Cb 2.00 0.03 -0.12 0.00 -0.84 0.00 0.00 28.75 29.82 2h4c h GLU 97 CO -0.00 0.31 0.75 0.00 -1.40 0.00 0.00 179.01 178.66 2h4c h ASP 99 N 0.23 0.00 0.12 0.00 3.32 -0.45 -3.03 116.42 116.61 2h4c h ASP 99 Ca 0.72 -0.18 -0.30 0.00 0.02 0.00 0.00 57.03 57.28 2h4c h ASP 99 Cb 2.06 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.60 2h4c h ASP 99 CO -0.39 0.09 -1.56 -0.09 -1.72 0.00 0.00 179.24 175.57 2h4c h ARG 100 N 0.00 0.26 -0.03 3.56 2.43 0.43 -3.31 114.38 117.72 2h4c h ARG 100 Ca 0.00 -0.45 -0.18 0.00 -0.81 0.00 0.00 59.98 58.54 2h4c h ARG 100 Cb 0.80 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.51 2h4c h ARG 100 CO 0.00 1.21 -0.79 0.28 -1.51 0.00 0.00 179.97 179.16 2h4c h VAL 101 N -0.21 1.44 0.00 0.20 2.07 -0.99 -3.05 116.25 115.72 2h4c h VAL 101 Ca -0.33 -2.36 -0.03 0.00 0.82 0.00 0.00 66.70 64.79 2h4c h VAL 101 Cb 1.84 2.29 -0.00 0.00 -1.52 0.00 0.00 31.29 33.89 2h4c h VAL 101 CO 0.07 0.70 -0.15 0.00 0.02 0.00 0.00 177.57 178.21 2h4c h ALA 102 N 1.00 1.64 0.06 1.67 0.00 -1.70 -2.84 119.26 119.09 2h4c h ALA 102 Ca -0.04 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2h4c h ALA 102 Cb 1.38 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2h4c h ALA 102 CO 0.13 0.19 -0.03 0.00 0.00 0.00 0.00 179.25 179.53 2h4c h ALA 103 N 1.85 -0.08 -0.83 0.00 0.00 -1.62 -3.02 119.26 115.55 2h4c h ALA 103 Ca -0.00 -0.30 0.15 0.00 0.00 0.00 0.00 54.91 54.76 2h4c h ALA 103 Cb 0.28 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 2h4c h ALA 103 CO 0.02 -0.18 0.55 0.82 0.00 0.00 0.00 179.25 180.46 2h4c h ILE 104 N -0.83 0.80 0.00 0.00 5.03 -1.48 0.49 117.51 121.53 2h4c h ILE 104 Ca -0.01 -0.18 -0.01 0.00 -0.12 0.00 0.00 64.86 64.54 2h4c h ILE 104 Cb 0.63 0.21 -0.00 0.00 -3.03 0.00 0.00 36.82 34.63 2h4c h ILE 104 CO 0.01 0.10 -0.05 0.00 -0.68 0.00 0.00 178.15 177.54 2h4c h PHE 106 N 0.00 0.67 -0.46 0.00 0.04 0.12 -3.24 116.94 114.07 2h4c h PHE 106 Ca -0.00 -0.49 0.02 0.00 2.80 0.00 0.00 57.97 60.30 2h4c h PHE 106 Cb 0.10 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.20 2h4c h PHE 106 CO 0.00 1.60 0.30 -0.09 -0.60 0.00 0.00 178.31 179.53 2h4c h ARG 107 N -0.04 0.55 0.00 1.51 2.43 -1.34 -2.12 114.38 115.37 2h4c h ARG 107 Ca -0.31 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 2h4c h ARG 107 Cb 1.98 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 31.41 2h4c h ARG 107 CO 0.16 0.36 0.00 0.39 -1.51 0.00 0.00 179.97 179.37 2h4c n GLU 108 N -4.47 0.00 0.00 0.20 -0.58 -1.16 -3.56 120.64 111.07 2h4c n GLU 108 Ca 0.04 0.45 0.00 0.00 -0.42 0.00 0.00 57.16 57.24 2h4c n GLU 108 Cb 0.10 -1.14 0.01 0.00 -0.57 0.00 0.00 31.44 29.84 2h4c n GLU 108 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2h4c n ASN 109 N -1.86 0.00 0.33 1.62 3.02 -1.22 -3.25 115.26 113.90 2h4c n ASN 109 Ca 0.00 -0.44 0.21 0.00 -0.03 0.00 0.00 54.58 54.32 2h4c n ASN 109 Cb 0.00 0.00 1.13 0.00 -0.61 0.00 0.00 39.78 40.30 2h4c n ASN 109 CO 0.00 0.00 0.00 -0.03 -2.62 0.00 0.00 177.26 174.61 2h4c h MET 110 N 0.00 0.00 -0.25 3.52 4.05 -1.43 0.13 114.93 120.96 2h4c h MET 110 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2h4c h MET 110 Cb 0.00 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.80 2h4c h MET 110 CO 0.00 0.00 0.00 0.09 0.23 0.00 0.00 176.91 177.23 2h4c n ASN 111 N -3.29 1.72 -0.12 1.39 5.03 -1.20 -3.21 115.26 115.59 2h4c n ASN 111 Ca -0.03 -1.83 0.02 0.00 0.87 0.00 0.00 54.58 53.61 2h4c n ASN 111 Cb 0.09 -0.16 0.00 0.00 -1.02 0.00 0.00 39.78 38.69 2h4c n ASN 111 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 2h4c n THR 112 N 0.39 0.00 -1.55 3.41 -2.24 0.46 -4.96 114.28 109.79 2h4c n THR 112 Ca 0.14 -0.45 -0.17 0.00 -2.27 0.00 0.00 64.05 61.30 2h4c n THR 112 Cb 0.31 1.06 -0.09 0.00 -2.10 0.00 0.00 70.33 69.51 2h4c n THR 112 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h4c n TYR 113 N -0.33 1.00 -2.25 4.78 4.19 -1.15 -4.82 117.16 118.58 2h4c n TYR 113 Ca 0.02 0.00 -0.33 0.00 3.31 0.00 0.00 57.90 60.90 2h4c n TYR 113 Cb 0.11 -2.30 -0.04 0.00 0.49 0.00 0.00 39.34 37.60 2h4c n TYR 113 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 2h4c s ASP 114 N 9.33 5.66 0.38 2.98 3.68 -1.26 -4.82 116.67 132.62 2h4c s ASP 114 Ca 1.00 -0.83 0.30 0.00 2.13 0.00 0.00 52.55 55.15 2h4c s ASP 114 Cb -0.27 -2.56 1.02 0.00 -1.45 0.00 0.00 42.92 39.66 2h4c s ASP 114 CO 0.18 -2.25 0.99 0.29 0.13 0.00 0.00 175.17 174.51 2h4c n LYS 115 N 8.93 0.00 0.00 4.34 5.02 -1.26 -1.06 118.16 134.13 2h4c n LYS 115 Ca 0.34 0.71 0.06 0.00 -2.02 0.00 0.00 58.31 57.39 2h4c n LYS 115 Cb 0.49 -1.66 0.33 0.00 -0.02 0.00 0.00 35.03 34.17 2h4c n LYS 115 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2h4c n LYS 116 N -3.10 0.65 0.00 1.97 4.81 -1.26 -3.44 118.16 117.80 2h4c n LYS 116 Ca 0.26 0.00 0.09 0.00 -0.87 0.00 0.00 58.31 57.79 2h4c n LYS 116 Cb 1.26 -1.26 -0.07 0.00 0.02 0.00 0.00 35.03 34.98 2h4c n LYS 116 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2h4c n TYR 117 N -0.76 0.00 -0.78 5.64 4.01 -0.22 -4.94 117.16 120.11 2h4c n TYR 117 Ca 0.08 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.49 2h4c n TYR 117 Cb 0.04 0.00 0.13 0.00 -0.31 0.00 0.00 39.34 39.20 2h4c n TYR 117 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 2h4c n MET 118 N -1.03 -0.60 -3.41 -0.72 2.81 -1.22 -1.60 117.12 111.36 2h4c n MET 118 Ca 0.05 -0.14 0.00 0.00 -1.81 0.00 0.00 57.70 55.80 2h4c n MET 118 Cb 0.32 -1.77 0.00 0.00 -0.71 0.00 0.00 33.22 31.06 2h4c n MET 118 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 2h4c n LEU 119 N -1.14 0.00 -4.83 4.03 4.77 0.38 -4.76 117.00 115.44 2h4c n LEU 119 Ca 0.05 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.70 2h4c n LEU 119 Cb 0.56 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.61 2h4c n LEU 119 CO 0.51 0.00 0.68 -0.47 -1.33 0.00 0.00 177.39 176.78 2h4c s TYR 120 N -4.49 3.39 0.72 -1.77 5.04 -1.06 -5.05 117.35 114.13 2h4c s TYR 120 Ca 0.00 1.50 -0.10 0.00 -2.44 0.00 0.00 57.07 56.04 2h4c s TYR 120 Cb 0.00 -2.82 0.05 0.00 0.35 0.00 0.00 41.96 39.53 2h4c s TYR 120 CO 0.00 -0.35 1.07 0.45 -1.34 0.00 0.00 175.55 175.38 2h4c s SER 121 N -2.83 5.01 0.10 4.32 0.15 -1.26 -4.92 113.70 114.27 2h4c s SER 121 Ca 0.60 0.79 0.25 0.00 0.70 0.00 0.00 55.95 58.29 2h4c s SER 121 Cb -0.10 -1.48 0.48 0.00 -1.71 0.00 0.00 66.02 63.20 2h4c s SER 121 CO 0.27 -1.55 1.42 2.30 1.20 0.00 0.00 173.24 176.89 2h4c n ILE 122 N -3.02 0.30 0.35 6.45 -6.64 -1.26 -3.56 119.36 111.97 2h4c n ILE 122 Ca 0.07 -0.21 0.14 0.00 -1.77 0.00 0.00 62.75 60.98 2h4c n ILE 122 Cb 0.59 -0.14 0.43 0.00 -1.44 0.00 0.00 39.64 39.08 2h4c n ILE 122 CO 0.00 0.00 0.00 0.15 -1.77 0.00 0.00 176.55 174.93 2h4c h PHE 124 N 0.00 0.00 -0.35 4.28 3.57 -2.02 -2.85 116.94 119.57 2h4c h PHE 124 Ca 0.00 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.46 2h4c h PHE 124 Cb 0.69 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.40 2h4c h PHE 124 CO 0.00 0.00 0.02 -0.25 -2.23 0.00 0.00 178.31 175.85 2h4c n ASP 125 N -2.79 4.01 -2.92 0.41 8.00 -1.23 -4.58 116.55 117.44 2h4c n ASP 125 Ca 0.03 -3.12 -0.14 0.00 0.71 0.00 0.00 54.79 52.27 2h4c n ASP 125 Cb 0.39 -0.59 0.02 0.00 -0.02 0.00 0.00 41.12 40.92 2h4c n ASP 125 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2h4c n LYS 127 N 1.09 0.14 -1.11 0.00 2.85 -1.25 -3.96 118.16 115.93 2h4c n LYS 127 Ca 0.14 -0.68 -0.31 0.00 -1.05 0.00 0.00 58.31 56.41 2h4c n LYS 127 Cb 0.63 -0.91 0.11 0.00 -0.65 0.00 0.00 35.03 34.21 2h4c n LYS 127 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 2h4c s GLU 128 N -0.24 1.89 -0.13 -1.58 2.02 -1.26 -4.83 118.70 114.56 2h4c s GLU 128 Ca 0.00 1.31 -0.38 0.00 0.02 0.00 0.00 54.97 55.92 2h4c s GLU 128 Cb 0.00 -1.84 -0.16 0.00 0.10 0.00 0.00 34.13 32.23 2h4c s GLU 128 CO 0.00 -1.94 1.62 -1.91 0.02 0.00 0.00 175.26 173.05 2h4c n GLU 129 N -3.68 1.27 -1.36 1.61 2.13 -1.26 -4.10 120.64 115.24 2h4c n GLU 129 Ca 0.10 0.46 -0.48 0.00 0.66 0.00 0.00 57.16 57.91 2h4c n GLU 129 Cb 0.53 -2.15 -0.03 0.00 0.27 0.00 0.00 31.44 30.05 2h4c n GLU 129 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2h4c n SER 130 N 4.50 -1.06 -4.63 4.31 7.64 -1.26 -4.75 113.62 118.37 2h4c n SER 130 Ca 0.23 1.09 -0.43 0.00 1.01 0.00 0.00 58.87 60.78 2h4c n SER 130 Cb 0.17 -0.91 -0.03 0.00 -1.01 0.00 0.00 64.21 62.43 2h4c n SER 130 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2h4c s ASP 131 N -0.85 6.35 0.19 6.43 -1.08 -0.26 -4.95 116.67 122.50 2h4c s ASP 131 Ca 0.65 1.57 -0.32 0.00 -0.52 0.00 0.00 52.55 53.94 2h4c s ASP 131 Cb -0.94 -2.53 -0.11 0.00 -1.46 0.00 0.00 42.92 37.88 2h4c s ASP 131 CO 0.54 -1.29 1.69 0.00 0.52 0.00 0.00 175.17 176.63 2h4c s GLN 132 N 4.73 4.15 0.00 4.34 -2.07 -1.26 -5.05 119.66 124.51 2h4c s GLN 132 Ca 0.71 2.54 0.00 0.00 -1.82 0.00 0.00 55.36 56.80 2h4c s GLN 132 Cb -0.24 -3.13 0.00 0.00 -1.09 0.00 0.00 33.01 28.55 2h4c s GLN 132 CO 0.29 -0.72 0.17 0.00 -1.32 0.00 0.00 175.29 173.72