#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nbw s PRO 6 N 0.00 3.24 0.10 0.54 0.04 -1.26 -5.01 135.00 132.65 1nbw s PRO 6 Ca 0.00 2.13 -0.25 0.00 0.04 0.00 0.00 61.00 62.91 1nbw s PRO 6 Cb 0.00 -2.26 0.09 0.00 0.04 0.00 0.00 34.50 32.36 1nbw s PRO 6 CO 0.00 -1.08 1.13 0.20 0.04 0.00 0.00 177.00 177.29 1nbw s GLY 7 N -1.07 -0.08 0.11 0.56 0.00 -1.26 -4.63 107.32 100.95 1nbw s GLY 7 Ca 0.71 -0.02 -0.28 0.00 0.00 0.00 0.00 44.72 45.13 1nbw s GLY 7 CO 0.44 2.45 0.90 0.14 0.00 0.00 0.00 173.10 177.03 1nbw s VAL 8 N -2.34 4.50 -0.08 1.40 1.01 -0.79 -4.33 120.40 119.77 1nbw s VAL 8 Ca 0.21 1.94 -0.11 0.00 0.00 0.00 0.00 61.98 64.02 1nbw s VAL 8 Cb -0.01 -4.26 -0.05 0.00 0.00 0.00 0.00 36.38 32.07 1nbw s VAL 8 CO 0.02 0.36 0.26 -0.13 0.00 0.00 0.00 175.10 175.61 1nbw s ARG 9 N -0.23 3.74 -0.34 2.72 3.00 -1.19 -0.97 118.95 125.69 1nbw s ARG 9 Ca 0.43 0.10 0.03 0.00 0.00 0.00 0.00 55.73 56.30 1nbw s ARG 9 Cb -0.23 -3.24 0.10 0.00 0.00 0.00 0.00 34.95 31.58 1nbw s ARG 9 CO 0.28 0.67 0.06 -1.17 0.00 0.00 0.00 175.30 175.14 1nbw s LEU 10 N -0.82 4.41 -0.20 2.53 0.20 -0.47 -0.80 118.68 123.52 1nbw s LEU 10 Ca 0.18 -2.11 -0.23 0.00 0.69 0.00 0.00 54.13 52.66 1nbw s LEU 10 Cb -0.14 -1.52 -0.02 0.00 -0.43 0.00 0.00 46.19 44.08 1nbw s LEU 10 CO 0.07 -0.38 0.75 -0.36 -0.29 0.00 0.00 176.35 176.14 1nbw s PHE 11 N 0.97 3.37 0.11 5.38 0.40 0.42 -0.93 117.98 127.71 1nbw s PHE 11 Ca 0.11 1.09 0.06 0.00 -0.60 0.00 0.00 56.93 57.59 1nbw s PHE 11 Cb -0.19 -2.94 -0.04 0.00 0.51 0.00 0.00 43.02 40.36 1nbw s PHE 11 CO -0.10 -0.27 -0.14 1.52 0.70 0.00 0.00 175.22 176.93 1nbw s TYR 12 N 2.28 1.36 -0.40 0.36 -0.85 -1.00 -0.65 117.35 118.44 1nbw s TYR 12 Ca 0.33 -0.55 -0.23 0.00 -0.52 0.00 0.00 57.07 56.10 1nbw s TYR 12 Cb -0.16 -0.72 0.02 0.00 0.38 0.00 0.00 41.96 41.48 1nbw s TYR 12 CO 0.10 0.12 0.80 0.34 -1.52 0.00 0.00 175.55 175.39 1nbw s ASP 13 N -2.33 6.50 0.59 -0.18 -1.08 -0.39 -1.33 116.67 118.46 1nbw s ASP 13 Ca 0.07 0.18 0.29 0.00 -0.52 0.00 0.00 52.55 52.57 1nbw s ASP 13 Cb -0.06 -2.40 1.62 0.00 -1.46 0.00 0.00 42.92 40.63 1nbw s ASP 13 CO 0.03 -0.83 2.04 1.55 0.52 0.00 0.00 175.17 178.48 1nbw h PRO 14 N 8.70 0.00 0.00 4.34 0.13 -1.91 0.40 132.00 143.66 1nbw h PRO 14 Ca -0.25 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.88 1nbw h PRO 14 Cb 1.09 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 1nbw h PRO 14 CO 0.94 0.00 -0.04 0.00 -0.23 0.00 0.00 178.00 178.67 1nbw h ARG 15 N 0.00 0.00 -6.48 0.86 3.08 -1.95 -3.40 114.38 106.49 1nbw h ARG 15 Ca 0.11 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.63 1nbw h ARG 15 Cb 0.68 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.70 1nbw h ARG 15 CO -0.00 0.04 -0.05 0.20 -1.07 0.00 0.00 179.97 179.08 1nbw s GLY 16 N -4.14 2.34 -0.63 0.04 0.00 0.13 -4.99 107.32 100.08 1nbw s GLY 16 Ca -0.04 -0.16 0.05 0.00 0.00 0.00 0.00 44.72 44.57 1nbw s GLY 16 CO 0.56 0.03 0.51 1.42 0.00 0.00 0.00 173.10 175.62 1nbw n HIS 17 N 0.04 2.45 -2.58 1.90 8.25 -1.26 -4.92 115.22 119.10 1nbw n HIS 17 Ca -0.00 -4.08 -0.25 0.00 -0.26 0.00 0.00 57.72 53.12 1nbw n HIS 17 Cb 0.52 -0.45 -0.00 0.00 1.12 0.00 0.00 29.99 31.18 1nbw n HIS 17 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1nbw n HIS 18 N 1.90 3.26 -0.33 4.41 8.25 -1.26 -4.87 115.22 126.58 1nbw n HIS 18 Ca 0.23 -3.25 0.08 0.00 -0.26 0.00 0.00 57.72 54.53 1nbw n HIS 18 Cb 0.39 -0.18 0.25 0.00 1.12 0.00 0.00 29.99 31.57 1nbw n HIS 18 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1nbw h ALA 19 N 2.69 1.44 -0.32 -1.41 0.00 -2.00 -2.10 119.26 117.56 1nbw h ALA 19 Ca 0.23 0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.27 1nbw h ALA 19 Cb 0.88 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.52 1nbw h ALA 19 CO 0.81 0.01 -0.08 0.78 0.00 0.00 0.00 179.25 180.77 1nbw h GLY 20 N 0.77 0.24 1.38 0.00 0.00 -2.00 -0.34 103.07 103.11 1nbw h GLY 20 Ca 0.50 0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.88 1nbw h GLY 20 CO -0.34 -0.12 0.12 0.00 0.00 0.00 0.00 176.54 176.21 1nbw h ALA 21 N 1.32 1.26 -0.72 3.60 0.00 -1.75 -1.85 119.26 121.11 1nbw h ALA 21 Ca 0.16 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1nbw h ALA 21 Cb 0.24 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1nbw h ALA 21 CO -0.33 0.52 0.21 0.82 0.00 0.00 0.00 179.25 180.47 1nbw h ILE 22 N 0.75 1.26 0.14 0.00 2.04 -0.91 -1.01 117.51 119.79 1nbw h ILE 22 Ca 0.17 -0.93 -0.01 0.00 1.00 0.00 0.00 64.86 65.09 1nbw h ILE 22 Cb 0.28 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 1nbw h ILE 22 CO -0.00 0.36 -0.07 0.78 0.00 0.00 0.00 178.15 179.22 1nbw h ASN 23 N 1.08 -0.16 -0.34 1.72 2.35 -0.47 -0.69 115.58 119.08 1nbw h ASN 23 Ca 0.23 -0.07 0.05 0.00 -0.55 0.00 0.00 56.30 55.95 1nbw h ASN 23 Cb 0.33 0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.70 1nbw h ASN 23 CO -0.00 -0.03 0.08 -0.33 -1.65 0.00 0.00 177.43 175.50 1nbw h GLU 24 N -0.28 0.20 0.24 0.81 4.39 -1.21 0.26 114.58 119.00 1nbw h GLU 24 Ca -0.02 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.67 1nbw h GLU 24 Cb 0.22 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 1nbw h GLU 24 CO 0.03 0.13 -0.18 -0.07 -1.16 0.00 0.00 179.01 177.76 1nbw h LEU 25 N 0.21 -0.47 -1.47 1.33 3.38 -1.08 -0.35 115.31 116.85 1nbw h LEU 25 Ca 0.16 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.13 1nbw h LEU 25 Cb 0.16 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1nbw h LEU 25 CO -0.19 -0.28 -0.05 0.00 0.09 0.00 0.00 178.44 178.00 1nbw h TRP 27 N 0.27 0.75 -0.68 0.00 6.55 -0.09 -0.48 115.95 122.27 1nbw h TRP 27 Ca 0.06 -0.18 0.01 0.00 0.95 0.00 0.00 58.89 59.73 1nbw h TRP 27 Cb 0.28 -0.18 -0.04 0.00 -0.86 0.00 0.00 29.16 28.36 1nbw h TRP 27 CO 0.01 0.87 0.44 0.78 -1.05 0.00 0.00 178.44 179.48 1nbw h GLY 28 N 1.00 0.97 1.20 1.49 0.00 -0.22 -0.91 103.07 106.58 1nbw h GLY 28 Ca 0.07 -0.35 -0.11 0.00 0.00 0.00 0.00 47.33 46.95 1nbw h GLY 28 CO 0.06 0.32 -0.13 1.41 0.00 0.00 0.00 176.54 178.20 1nbw h LEU 29 N 0.89 0.94 -0.36 3.11 3.38 -1.09 -3.20 115.31 118.99 1nbw h LEU 29 Ca 0.26 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1nbw h LEU 29 Cb -0.07 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.41 1nbw h LEU 29 CO -0.07 1.07 0.22 -0.08 0.09 0.00 0.00 178.44 179.66 1nbw h GLU 30 N 0.83 0.49 -0.11 1.13 4.81 -0.32 -1.57 114.58 119.84 1nbw h GLU 30 Ca 0.13 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.35 1nbw h GLU 30 Cb 0.67 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.95 1nbw h GLU 30 CO 0.05 0.37 0.11 1.49 -0.73 0.00 0.00 179.01 180.29 1nbw h GLU 31 N 0.47 0.00 -0.01 1.92 4.57 -1.19 0.26 114.58 120.60 1nbw h GLU 31 Ca 0.13 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 1nbw h GLU 31 Cb 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.60 1nbw h GLU 31 CO -0.02 0.00 -0.07 1.04 -1.18 0.00 0.00 179.01 178.77 1nbw n GLN 32 N -4.05 1.21 -1.01 1.92 1.13 -0.70 -4.93 117.38 110.95 1nbw n GLN 32 Ca -0.00 -0.59 -0.00 0.00 -1.94 0.00 0.00 57.00 54.47 1nbw n GLN 32 Cb 0.22 -1.49 -0.00 0.00 0.11 0.00 0.00 30.24 29.08 1nbw n GLN 32 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1nbw n GLY 33 N 1.20 0.46 3.49 1.08 0.00 0.93 -5.04 105.19 107.31 1nbw n GLY 33 Ca 0.17 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 1nbw n GLY 33 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nbw s VAL 34 N -1.99 3.69 0.76 1.61 1.01 -0.67 -5.00 120.40 119.80 1nbw s VAL 34 Ca 0.00 -0.44 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 1nbw s VAL 34 Cb 0.00 -2.58 0.04 0.00 0.00 0.00 0.00 36.38 33.84 1nbw s VAL 34 CO 0.00 0.52 1.14 -2.65 0.00 0.00 0.00 175.10 174.11 1nbw n PRO 35 N 3.25 0.45 -3.60 2.72 -0.02 -1.26 -3.71 135.00 132.82 1nbw n PRO 35 Ca -0.18 0.22 -0.28 0.00 -2.02 0.00 0.00 63.50 61.24 1nbw n PRO 35 Cb 0.53 -2.38 -0.16 0.00 -0.02 0.00 0.00 33.50 31.47 1nbw n PRO 35 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nbw s GLN 37 N 2.02 3.01 0.14 0.00 -0.21 -0.14 -4.98 119.66 119.49 1nbw s GLN 37 Ca 0.06 -0.94 -0.30 0.00 0.02 0.00 0.00 55.36 54.20 1nbw s GLN 37 Cb -0.16 -3.61 -0.07 0.00 1.00 0.00 0.00 33.01 30.17 1nbw s GLN 37 CO -0.26 -0.57 0.95 0.95 -2.12 0.00 0.00 175.29 174.24 1nbw s THR 38 N 1.55 4.40 -0.10 -0.19 -4.23 -1.26 -1.37 115.64 114.44 1nbw s THR 38 Ca 0.03 2.05 -0.00 0.00 -1.18 0.00 0.00 61.69 62.59 1nbw s THR 38 Cb -0.18 -4.31 0.02 0.00 1.34 0.00 0.00 72.50 69.37 1nbw s THR 38 CO 0.06 0.37 -0.07 -0.63 -0.54 0.00 0.00 174.62 173.80 1nbw s ILE 39 N -0.32 0.96 0.13 2.99 1.01 -0.10 -4.90 121.20 120.96 1nbw s ILE 39 Ca 0.45 -0.27 -0.30 0.00 0.00 0.00 0.00 60.65 60.53 1nbw s ILE 39 Cb -0.24 -0.97 -0.07 0.00 0.01 0.00 0.00 42.46 41.19 1nbw s ILE 39 CO 0.30 0.35 1.26 0.28 0.00 0.00 0.00 174.94 177.13 1nbw s THR 40 N 1.55 3.62 -0.56 2.92 -1.32 -1.26 -2.38 115.64 118.21 1nbw s THR 40 Ca 0.02 1.24 0.04 0.00 -1.21 0.00 0.00 61.69 61.77 1nbw s THR 40 Cb -0.13 -3.79 0.15 0.00 -1.51 0.00 0.00 72.50 67.22 1nbw s THR 40 CO -0.06 0.14 0.35 -0.47 -2.21 0.00 0.00 174.62 172.37 1nbw s TYR 41 N 0.59 2.83 -0.67 9.09 5.04 -0.44 -4.90 117.35 128.89 1nbw s TYR 41 Ca 0.58 -2.97 -0.26 0.00 -2.44 0.00 0.00 57.07 51.97 1nbw s TYR 41 Cb -0.33 -2.37 -0.01 0.00 0.35 0.00 0.00 41.96 39.60 1nbw s TYR 41 CO 0.33 -0.69 1.77 0.34 -1.34 0.00 0.00 175.55 175.96 1nbw s ASP 42 N -0.53 5.43 0.00 4.32 3.68 -1.26 -2.27 116.67 126.03 1nbw s ASP 42 Ca 0.22 0.07 0.00 0.00 2.13 0.00 0.00 52.55 54.97 1nbw s ASP 42 Cb -0.15 -2.54 0.00 0.00 -1.45 0.00 0.00 42.92 38.78 1nbw s ASP 42 CO -0.08 -2.31 0.00 0.61 0.13 0.00 0.00 175.17 173.52 1nbw n GLY 43 N 5.78 0.03 0.00 2.66 0.00 -1.26 -5.13 105.19 107.28 1nbw n GLY 43 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1nbw n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nbw n GLY 44 N 0.00 0.00 0.00 -0.02 0.00 -0.96 -5.06 105.19 99.15 1nbw n GLY 44 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1nbw n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nbw n GLY 45 N 0.00 5.41 3.87 -0.02 0.00 -1.26 -5.08 105.19 108.11 1nbw n GLY 45 Ca 0.00 -1.33 -0.30 0.00 0.00 0.00 0.00 46.02 44.39 1nbw n GLY 45 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1nbw s ASP 46 N 1.00 4.92 0.23 1.61 -4.77 -1.26 -4.67 116.67 113.73 1nbw s ASP 46 Ca 0.00 1.07 -0.08 0.00 -3.30 0.00 0.00 52.55 50.25 1nbw s ASP 46 Cb 0.00 -1.77 0.39 0.00 -1.09 0.00 0.00 42.92 40.45 1nbw s ASP 46 CO 0.00 -1.67 1.67 0.00 0.70 0.00 0.00 175.17 175.87 1nbw h ALA 47 N -0.89 0.79 -0.98 2.11 0.00 -1.87 -1.34 119.26 117.09 1nbw h ALA 47 Ca -0.46 0.18 0.10 0.00 0.00 0.00 0.00 54.91 54.73 1nbw h ALA 47 Cb 1.28 0.29 -0.08 0.00 0.00 0.00 0.00 17.79 19.28 1nbw h ALA 47 CO 0.63 -0.37 0.63 0.00 0.00 0.00 0.00 179.25 180.14 1nbw h ALA 48 N 1.60 1.51 -0.10 0.00 0.00 -1.88 0.38 119.26 120.76 1nbw h ALA 48 Ca 0.38 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.27 1nbw h ALA 48 Cb 0.64 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1nbw h ALA 48 CO -0.53 0.29 -0.00 0.00 0.00 0.00 0.00 179.25 179.00 1nbw h ALA 49 N 1.52 0.14 -0.60 0.00 0.00 -1.48 -0.29 119.26 118.55 1nbw h ALA 49 Ca 0.46 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1nbw h ALA 49 Cb 0.37 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1nbw h ALA 49 CO -0.22 -0.17 0.38 -0.07 0.00 0.00 0.00 179.25 179.17 1nbw h LEU 50 N -0.09 0.70 -0.02 0.00 3.38 -0.97 -0.76 115.31 117.54 1nbw h LEU 50 Ca 0.03 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1nbw h LEU 50 Cb 0.36 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1nbw h LEU 50 CO 0.01 0.53 -0.05 1.23 0.09 0.00 0.00 178.44 180.25 1nbw h GLY 51 N 0.81 -0.03 0.71 0.83 0.00 -0.14 0.17 103.07 105.41 1nbw h GLY 51 Ca 0.22 0.06 0.06 0.00 0.00 0.00 0.00 47.33 47.67 1nbw h GLY 51 CO -0.04 -0.06 0.50 0.00 0.00 0.00 0.00 176.54 176.94 1nbw h ALA 52 N 0.94 1.12 -0.24 3.60 0.00 -0.70 0.17 119.26 124.15 1nbw h ALA 52 Ca 0.03 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1nbw h ALA 52 Cb 0.11 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1nbw h ALA 52 CO -0.06 0.22 -0.01 -0.07 0.00 0.00 0.00 179.25 179.33 1nbw h LEU 53 N 0.90 0.42 -0.31 0.00 3.38 -0.74 -2.49 115.31 116.48 1nbw h LEU 53 Ca 0.36 -0.31 0.03 0.00 0.09 0.00 0.00 57.88 58.04 1nbw h LEU 53 Cb 0.18 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1nbw h LEU 53 CO -0.18 0.63 0.13 0.00 0.09 0.00 0.00 178.44 179.12 1nbw h ALA 54 N 0.80 0.37 -0.81 1.53 0.00 0.00 -0.46 119.26 120.71 1nbw h ALA 54 Ca 0.07 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1nbw h ALA 54 Cb 0.42 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1nbw h ALA 54 CO 0.01 -0.26 0.46 0.00 0.00 0.00 0.00 179.25 179.47 1nbw h ALA 55 N 1.18 1.03 0.00 0.00 0.00 -0.97 0.64 119.26 121.14 1nbw h ALA 55 Ca 0.14 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1nbw h ALA 55 Cb 0.08 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.54 1nbw h ALA 55 CO -0.12 0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.66 1nbw h ARG 56 N 1.11 0.00 0.00 0.00 3.08 -1.12 -2.79 114.38 114.66 1nbw h ARG 56 Ca 0.29 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 60.10 1nbw h ARG 56 Cb 0.01 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.02 1nbw h ARG 56 CO -0.05 0.00 -1.45 1.03 -1.07 0.00 0.00 179.97 178.43 1nbw h SER 57 N 0.00 0.00 -3.57 7.04 0.87 -0.21 -3.47 113.55 114.22 1nbw h SER 57 Ca 0.00 0.00 -0.52 0.00 -1.23 0.00 0.00 61.79 60.04 1nbw h SER 57 Cb 0.61 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 1nbw h SER 57 CO 0.00 0.88 0.47 -0.55 -0.53 0.00 0.00 176.83 177.10 1nbw s SER 58 N -6.16 7.27 0.30 6.23 0.15 0.13 -4.92 113.70 116.71 1nbw s SER 58 Ca -0.03 2.08 0.26 0.00 0.70 0.00 0.00 55.95 58.96 1nbw s SER 58 Cb 0.08 -2.60 0.92 0.00 -1.71 0.00 0.00 66.02 62.71 1nbw s SER 58 CO 0.82 -0.21 1.76 1.55 1.20 0.00 0.00 173.24 178.36 1nbw h PRO 59 N 5.09 0.00 -0.01 5.44 0.13 -1.85 -1.68 132.00 139.13 1nbw h PRO 59 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1nbw h PRO 59 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1nbw h PRO 59 CO 0.72 0.00 -0.19 1.28 -0.23 0.00 0.00 178.00 179.58 1nbw n LEU 60 N -2.44 0.90 -0.69 1.56 4.77 -1.26 -4.93 117.00 114.90 1nbw n LEU 60 Ca 0.03 -0.20 -0.09 0.00 -0.03 0.00 0.00 56.01 55.72 1nbw n LEU 60 Cb 0.33 -0.13 -0.04 0.00 -2.33 0.00 0.00 43.42 41.26 1nbw n LEU 60 CO 0.26 0.17 -0.09 0.54 -1.33 0.00 0.00 177.39 176.94 1nbw n ARG 61 N -0.68 -1.13 -5.05 3.23 5.12 -0.63 -4.97 116.66 112.56 1nbw n ARG 61 Ca 0.13 0.76 -0.29 0.00 -1.93 0.00 0.00 57.85 56.52 1nbw n ARG 61 Cb 0.33 -4.83 -0.16 0.00 -1.16 0.00 0.00 32.46 26.63 1nbw n ARG 61 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1nbw s VAL 62 N -2.08 1.75 0.10 1.55 1.01 -1.25 -1.01 120.40 120.46 1nbw s VAL 62 Ca 0.00 -0.88 -0.08 0.00 0.00 0.00 0.00 61.98 61.02 1nbw s VAL 62 Cb 0.00 -1.50 -0.01 0.00 0.00 0.00 0.00 36.38 34.87 1nbw s VAL 62 CO 0.00 0.49 0.18 -0.83 0.00 0.00 0.00 175.10 174.94 1nbw s GLY 63 N 0.05 0.20 -0.03 4.51 0.00 -0.91 -3.15 107.32 107.99 1nbw s GLY 63 Ca -0.07 -0.73 0.05 0.00 0.00 0.00 0.00 44.72 43.98 1nbw s GLY 63 CO 0.04 -0.87 -0.20 -0.42 0.00 0.00 0.00 173.10 171.65 1nbw s ILE 64 N -3.89 1.60 -0.12 0.90 1.01 0.02 -1.14 121.20 119.58 1nbw s ILE 64 Ca 0.07 -0.84 0.02 0.00 0.00 0.00 0.00 60.65 59.91 1nbw s ILE 64 Cb 0.05 -1.35 -0.00 0.00 0.01 0.00 0.00 42.46 41.17 1nbw s ILE 64 CO -0.09 0.45 -0.20 -0.83 0.00 0.00 0.00 174.94 174.27 1nbw s GLY 65 N -0.24 1.40 -0.25 6.18 0.00 0.23 -0.44 107.32 114.20 1nbw s GLY 65 Ca 0.02 -0.99 0.03 0.00 0.00 0.00 0.00 44.72 43.77 1nbw s GLY 65 CO 0.01 -0.18 -0.12 -2.27 0.00 0.00 0.00 173.10 170.54 1nbw s LEU 66 N 0.52 3.31 0.58 0.66 0.20 0.18 -0.39 118.68 123.75 1nbw s LEU 66 Ca -0.13 -1.32 -0.08 0.00 0.69 0.00 0.00 54.13 53.29 1nbw s LEU 66 Cb -0.17 -1.54 -0.02 0.00 -0.43 0.00 0.00 46.19 44.04 1nbw s LEU 66 CO 0.05 -0.17 0.93 -0.94 -0.29 0.00 0.00 176.35 175.93 1nbw s SER 67 N 1.12 5.95 0.28 3.68 1.04 -0.62 -1.26 113.70 123.89 1nbw s SER 67 Ca -0.08 1.04 -0.01 0.00 0.48 0.00 0.00 55.95 57.38 1nbw s SER 67 Cb -0.19 -2.12 0.45 0.00 0.10 0.00 0.00 66.02 64.26 1nbw s SER 67 CO -0.06 -0.91 1.90 0.00 0.98 0.00 0.00 173.24 175.15 1nbw h ALA 68 N -0.17 1.44 0.00 5.32 0.00 -1.83 -0.22 119.26 123.79 1nbw h ALA 68 Ca -0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1nbw h ALA 68 Cb 1.22 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1nbw h ALA 68 CO 0.62 0.42 0.00 -1.13 0.00 0.00 0.00 179.25 179.16 1nbw n SER 69 N -4.49 0.41 0.00 0.00 3.41 -1.26 -4.41 113.62 107.28 1nbw n SER 69 Ca 0.15 0.63 0.00 0.00 -0.26 0.00 0.00 58.87 59.38 1nbw n SER 69 Cb 0.18 -0.70 0.00 0.00 -0.26 0.00 0.00 64.21 63.43 1nbw n SER 69 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nbw n GLY 70 N -0.44 0.95 3.80 5.00 0.00 -0.10 -4.98 105.19 109.43 1nbw n GLY 70 Ca 0.01 -0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1nbw n GLY 70 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nbw s GLU 71 N -0.77 4.27 -0.07 1.61 2.02 -1.26 -1.44 118.70 123.07 1nbw s GLU 71 Ca 0.00 0.82 0.03 0.00 0.02 0.00 0.00 54.97 55.84 1nbw s GLU 71 Cb 0.00 -3.24 -0.02 0.00 0.10 0.00 0.00 34.13 30.96 1nbw s GLU 71 CO 0.00 0.62 -0.14 0.42 0.02 0.00 0.00 175.26 176.18 1nbw s ILE 72 N -1.10 3.02 -0.04 -1.63 1.01 -0.21 -1.58 121.20 120.66 1nbw s ILE 72 Ca 0.30 -0.72 0.02 0.00 0.00 0.00 0.00 60.65 60.25 1nbw s ILE 72 Cb -0.20 -2.20 0.02 0.00 0.01 0.00 0.00 42.46 40.08 1nbw s ILE 72 CO 0.20 0.57 -0.07 0.00 0.00 0.00 0.00 174.94 175.65 1nbw s ALA 73 N -0.44 0.79 -0.13 9.38 0.00 0.48 -0.86 121.76 130.98 1nbw s ALA 73 Ca 0.05 -0.17 0.01 0.00 0.00 0.00 0.00 51.96 51.85 1nbw s ALA 73 Cb -0.12 -0.41 -0.00 0.00 0.00 0.00 0.00 23.12 22.59 1nbw s ALA 73 CO 0.02 0.05 -0.18 -1.17 0.00 0.00 0.00 175.76 174.48 1nbw s LEU 74 N 0.67 2.38 0.00 0.00 2.96 0.40 0.74 118.68 125.82 1nbw s LEU 74 Ca -0.10 -0.48 -0.02 0.00 -0.22 0.00 0.00 54.13 53.31 1nbw s LEU 74 Cb -0.13 -1.52 0.01 0.00 0.50 0.00 0.00 46.19 45.05 1nbw s LEU 74 CO 0.01 0.12 0.29 1.07 -1.32 0.00 0.00 176.35 176.52 1nbw n THR 75 N 3.83 0.00 -4.86 3.68 5.66 -0.29 -1.60 114.28 120.69 1nbw n THR 75 Ca -0.19 -1.00 -0.25 0.00 -3.05 0.00 0.00 64.05 59.56 1nbw n THR 75 Cb 0.52 0.63 -0.15 0.00 -1.55 0.00 0.00 70.33 69.78 1nbw n THR 75 CO 0.00 0.00 0.00 -2.28 -3.05 0.00 0.00 175.07 169.74 1nbw s HIS 76 N -3.90 1.63 0.28 1.09 2.46 -1.26 -2.14 115.29 113.45 1nbw s HIS 76 Ca 0.16 -0.31 0.02 0.00 0.47 0.00 0.00 55.06 55.40 1nbw s HIS 76 Cb -0.01 -1.05 0.65 0.00 -0.13 0.00 0.00 32.58 32.05 1nbw s HIS 76 CO 0.12 -0.02 1.71 0.00 -2.47 0.00 0.00 174.74 174.08 1nbw h ALA 77 N 5.66 1.35 0.00 1.58 0.00 -1.32 -0.30 119.26 126.23 1nbw h ALA 77 Ca -0.37 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1nbw h ALA 77 Cb 1.15 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1nbw h ALA 77 CO 0.48 -0.27 0.00 1.04 0.00 0.00 0.00 179.25 180.50 1nbw n GLN 78 N -5.00 0.19 -3.87 0.00 6.02 -1.26 -4.75 117.38 108.71 1nbw n GLN 78 Ca 0.20 0.15 -0.26 0.00 -0.01 0.00 0.00 57.00 57.08 1nbw n GLN 78 Cb 0.57 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.31 1nbw n GLN 78 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1nbw s LEU 79 N -2.49 4.30 0.22 1.08 1.43 -0.13 -5.04 118.68 118.05 1nbw s LEU 79 Ca 0.12 0.23 -0.32 0.00 -1.03 0.00 0.00 54.13 53.13 1nbw s LEU 79 Cb 0.08 -2.99 -0.12 0.00 0.03 0.00 0.00 46.19 43.19 1nbw s LEU 79 CO 0.17 0.01 1.71 -2.16 0.23 0.00 0.00 176.35 176.31 1nbw s PRO 80 N -3.32 4.12 0.14 1.29 0.04 -1.26 -4.81 135.00 131.20 1nbw s PRO 80 Ca 0.36 2.61 0.05 0.00 0.04 0.00 0.00 61.00 64.05 1nbw s PRO 80 Cb -0.11 -3.07 0.27 0.00 0.04 0.00 0.00 34.50 31.64 1nbw s PRO 80 CO 0.29 -0.74 0.97 0.00 0.04 0.00 0.00 177.00 177.56 1nbw n ALA 81 N 3.80 0.55 0.15 8.56 0.00 -1.26 0.11 120.51 132.43 1nbw n ALA 81 Ca 0.15 0.05 0.07 0.00 0.00 0.00 0.00 53.44 53.71 1nbw n ALA 81 Cb 0.35 -0.62 0.12 0.00 0.00 0.00 0.00 19.45 19.31 1nbw n ALA 81 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1nbw n ASP 82 N -1.59 2.65 -3.27 0.00 5.75 -1.26 -4.47 116.55 114.35 1nbw n ASP 82 Ca -0.00 -1.79 -0.25 0.00 -0.01 0.00 0.00 54.79 52.73 1nbw n ASP 82 Cb 0.28 -0.15 -0.07 0.00 -1.03 0.00 0.00 41.12 40.16 1nbw n ASP 82 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1nbw n ALA 83 N 0.74 3.46 -1.77 2.12 0.00 0.30 -5.10 120.51 120.27 1nbw n ALA 83 Ca 0.11 -4.22 -0.40 0.00 0.00 0.00 0.00 53.44 48.93 1nbw n ALA 83 Cb 0.40 -0.85 0.01 0.00 0.00 0.00 0.00 19.45 19.01 1nbw n ALA 83 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1nbw n PRO 84 N 0.83 2.37 -0.29 0.00 -0.04 -1.26 -4.59 135.00 132.02 1nbw n PRO 84 Ca 0.27 0.84 -0.05 0.00 -0.04 0.00 0.00 63.50 64.52 1nbw n PRO 84 Cb 0.47 -2.65 0.07 0.00 -0.04 0.00 0.00 33.50 31.34 1nbw n PRO 84 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1nbw h LEU 85 N 2.46 1.03 -7.68 1.53 6.46 -1.80 -3.44 115.31 113.87 1nbw h LEU 85 Ca -0.51 -0.13 -0.14 0.00 -0.12 0.00 0.00 57.88 56.98 1nbw h LEU 85 Cb 1.26 -0.27 -0.21 0.00 -0.73 0.00 0.00 40.66 40.72 1nbw h LEU 85 CO 0.62 0.87 -0.44 0.00 -0.62 0.00 0.00 178.44 178.88 1nbw s ALA 86 N -5.72 -0.45 0.13 1.25 0.00 -0.63 -5.03 121.76 111.32 1nbw s ALA 86 Ca -0.13 0.01 0.04 0.00 0.00 0.00 0.00 51.96 51.88 1nbw s ALA 86 Cb 0.15 0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.32 1nbw s ALA 86 CO 0.82 -0.22 -0.11 0.95 0.00 0.00 0.00 175.76 177.21 1nbw s THR 87 N -1.32 1.14 0.10 0.00 -4.23 -1.26 -0.45 115.64 109.63 1nbw s THR 87 Ca -0.14 -1.93 -0.04 0.00 -1.18 0.00 0.00 61.69 58.40 1nbw s THR 87 Cb -0.07 -1.71 0.01 0.00 1.34 0.00 0.00 72.50 72.08 1nbw s THR 87 CO 0.02 -0.67 0.20 0.61 -0.54 0.00 0.00 174.62 174.25 1nbw n GLY 88 N 0.05 1.87 3.14 3.99 0.00 -0.04 -4.98 105.19 109.20 1nbw n GLY 88 Ca -0.12 -1.12 -0.12 0.00 0.00 0.00 0.00 46.02 44.66 1nbw n GLY 88 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1nbw s HIS 89 N -6.83 -0.04 0.39 1.61 2.46 -1.26 -1.05 115.29 110.57 1nbw s HIS 89 Ca 0.05 0.03 0.38 0.00 0.47 0.00 0.00 55.06 55.99 1nbw s HIS 89 Cb -0.01 -0.00 2.03 0.00 -0.13 0.00 0.00 32.58 34.46 1nbw s HIS 89 CO 0.03 -0.29 2.15 0.28 -2.47 0.00 0.00 174.74 174.45 1nbw h VAL 90 N 4.23 0.00 -0.00 0.89 2.07 -1.61 0.10 116.25 121.93 1nbw h VAL 90 Ca -0.30 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.19 1nbw h VAL 90 Cb 1.19 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 1nbw h VAL 90 CO 0.40 0.00 -0.02 0.35 0.02 0.00 0.00 177.57 178.32 1nbw n THR 91 N -2.84 0.00 -0.93 2.57 -2.24 -1.26 -4.83 114.28 104.75 1nbw n THR 91 Ca -0.02 -0.02 -0.29 0.00 -2.27 0.00 0.00 64.05 61.45 1nbw n THR 91 Cb 0.07 -0.41 0.18 0.00 -2.10 0.00 0.00 70.33 68.08 1nbw n THR 91 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1nbw s ASP 92 N -2.39 2.60 0.80 3.42 1.01 0.35 -4.99 116.67 117.47 1nbw s ASP 92 Ca 0.34 1.59 -0.11 0.00 0.71 0.00 0.00 52.55 55.08 1nbw s ASP 92 Cb 0.21 -2.25 0.07 0.00 1.01 0.00 0.00 42.92 41.96 1nbw s ASP 92 CO 0.44 -3.20 1.09 -0.94 0.21 0.00 0.00 175.17 172.76 1nbw s SER 93 N -3.04 4.33 0.19 0.27 1.04 -1.26 -4.84 113.70 110.38 1nbw s SER 93 Ca 0.66 1.63 -0.12 0.00 0.48 0.00 0.00 55.95 58.60 1nbw s SER 93 Cb -0.21 -2.36 0.16 0.00 0.10 0.00 0.00 66.02 63.72 1nbw s SER 93 CO 0.59 -2.12 1.78 0.44 0.98 0.00 0.00 173.24 174.91 1nbw h ASP 94 N -1.19 0.34 -0.91 7.02 3.32 -1.95 -1.63 116.42 121.43 1nbw h ASP 94 Ca -0.46 0.04 0.01 0.00 0.02 0.00 0.00 57.03 56.64 1nbw h ASP 94 Cb 1.25 -0.02 -0.05 0.00 0.22 0.00 0.00 39.33 40.73 1nbw h ASP 94 CO 0.54 0.23 0.60 0.44 -1.72 0.00 0.00 179.24 179.34 1nbw h ASP 95 N 0.48 1.05 -0.12 6.45 5.19 -1.99 0.16 116.42 127.65 1nbw h ASP 95 Ca 0.24 -0.03 -0.08 0.00 -0.62 0.00 0.00 57.03 56.54 1nbw h ASP 95 Cb 0.18 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 39.41 1nbw h ASP 95 CO -0.19 0.76 -0.17 1.56 -3.12 0.00 0.00 179.24 178.09 1nbw h GLN 96 N 1.24 0.50 -0.13 3.56 4.20 -1.78 0.76 115.11 123.47 1nbw h GLN 96 Ca 0.33 -0.16 -0.17 0.00 0.06 0.00 0.00 58.65 58.71 1nbw h GLN 96 Cb -0.14 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.59 1nbw h GLN 96 CO -0.07 0.66 -0.65 -0.07 -0.67 0.00 0.00 178.83 178.03 1nbw h LEU 97 N 0.46 0.56 -0.53 1.46 3.38 -0.43 -2.03 115.31 118.18 1nbw h LEU 97 Ca 0.08 -0.33 -0.04 0.00 0.09 0.00 0.00 57.88 57.67 1nbw h LEU 97 Cb 0.56 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1nbw h LEU 97 CO 0.04 1.06 0.16 -0.09 0.09 0.00 0.00 178.44 179.69 1nbw h ARG 98 N 0.35 0.82 -0.44 1.13 9.65 -0.11 -2.07 114.38 123.71 1nbw h ARG 98 Ca -0.01 -0.18 -0.04 0.00 -1.10 0.00 0.00 59.98 58.65 1nbw h ARG 98 Cb 1.21 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 29.65 1nbw h ARG 98 CO 0.12 0.76 0.10 1.15 2.80 0.00 0.00 179.97 184.89 1nbw h THR 99 N 0.72 1.20 -0.55 0.20 2.02 -0.73 0.13 112.91 115.91 1nbw h THR 99 Ca 0.17 -0.72 -0.07 0.00 0.77 0.00 0.00 66.41 66.56 1nbw h THR 99 Cb 0.28 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 1nbw h THR 99 CO -0.00 0.26 0.07 0.25 0.37 0.00 0.00 175.52 176.47 1nbw h LEU 100 N 0.64 0.83 -0.49 2.58 5.85 -0.95 0.37 115.31 124.14 1nbw h LEU 100 Ca 0.14 -0.18 -0.14 0.00 0.84 0.00 0.00 57.88 58.54 1nbw h LEU 100 Cb 0.26 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 1nbw h LEU 100 CO -0.00 0.85 -0.32 1.23 -0.34 0.00 0.00 178.44 179.86 1nbw h GLY 101 N 0.99 0.97 1.20 3.75 0.00 -0.64 -2.35 103.07 106.98 1nbw h GLY 101 Ca 0.17 -0.93 -0.00 0.00 0.00 0.00 0.00 47.33 46.57 1nbw h GLY 101 CO 0.01 0.84 0.50 0.00 0.00 0.00 0.00 176.54 177.88 1nbw h ALA 102 N 0.88 1.37 -0.98 3.60 0.00 0.25 -1.63 119.26 122.75 1nbw h ALA 102 Ca 0.08 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1nbw h ALA 102 Cb 0.89 -0.32 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 1nbw h ALA 102 CO 0.08 0.55 0.63 -0.91 0.00 0.00 0.00 179.25 179.61 1nbw h ASN 103 N 1.09 1.14 -0.98 0.00 2.35 0.20 -0.23 115.58 119.15 1nbw h ASN 103 Ca 0.29 -0.04 0.02 0.00 -0.55 0.00 0.00 56.30 56.02 1nbw h ASN 103 Cb -0.07 -0.29 -0.05 0.00 0.05 0.00 0.00 38.32 37.96 1nbw h ASN 103 CO -0.06 0.84 0.65 0.00 -1.65 0.00 0.00 177.43 177.21 1nbw h ALA 104 N 1.35 1.32 -0.36 -0.83 0.00 -0.81 0.19 119.26 120.12 1nbw h ALA 104 Ca 0.36 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 1nbw h ALA 104 Cb -0.13 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.27 1nbw h ALA 104 CO -0.07 0.61 -0.09 0.78 0.00 0.00 0.00 179.25 180.48 1nbw h GLY 105 N 1.30 0.75 1.01 0.00 0.00 -0.93 -2.02 103.07 103.18 1nbw h GLY 105 Ca 0.37 -0.62 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 1nbw h GLY 105 CO -0.09 0.56 0.44 1.46 0.00 0.00 0.00 176.54 178.91 1nbw h GLN 106 N 0.48 1.08 -0.88 4.80 4.20 -0.35 0.13 115.11 124.58 1nbw h GLN 106 Ca 0.09 -0.12 0.01 0.00 0.06 0.00 0.00 58.65 58.69 1nbw h GLN 106 Cb 0.60 -0.22 -0.04 0.00 0.30 0.00 0.00 27.48 28.11 1nbw h GLN 106 CO 0.04 0.79 0.58 1.25 -0.67 0.00 0.00 178.83 180.82 1nbw h LEU 107 N 1.08 1.00 -0.29 1.46 5.85 -0.47 0.59 115.31 124.53 1nbw h LEU 107 Ca 0.28 -0.02 -0.20 0.00 0.84 0.00 0.00 57.88 58.78 1nbw h LEU 107 Cb 0.02 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 1nbw h LEU 107 CO -0.05 0.72 -0.86 0.58 -0.34 0.00 0.00 178.44 178.49 1nbw h VAL 108 N 1.18 1.48 -0.00 1.05 2.07 -0.58 -3.13 116.25 118.31 1nbw h VAL 108 Ca 0.33 -2.55 0.00 0.00 0.82 0.00 0.00 66.70 65.30 1nbw h VAL 108 Cb -0.11 2.42 0.00 0.00 -1.52 0.00 0.00 31.29 32.09 1nbw h VAL 108 CO -0.08 0.75 -0.30 0.29 0.02 0.00 0.00 177.57 178.25 1nbw n LYS 109 N -3.68 0.19 -2.81 1.57 5.02 0.38 -4.97 118.16 113.86 1nbw n LYS 109 Ca -0.04 -0.09 -0.01 0.00 -2.02 0.00 0.00 58.31 56.16 1nbw n LYS 109 Cb 0.80 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.31 1nbw n LYS 109 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1nbw n VAL 110 N -1.33 -8.57 -3.88 -0.18 0.31 0.19 -5.05 118.33 99.82 1nbw n VAL 110 Ca 0.08 -0.27 -0.12 0.00 -0.01 0.00 0.00 64.34 64.02 1nbw n VAL 110 Cb 0.33 -6.32 -0.13 0.00 -0.91 0.00 0.00 33.84 26.80 1nbw n VAL 110 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1nbw s LEU 111 N -3.76 1.95 0.16 7.52 1.43 -0.36 -5.03 118.68 120.58 1nbw s LEU 111 Ca 0.03 -0.05 -0.34 0.00 -1.03 0.00 0.00 54.13 52.74 1nbw s LEU 111 Cb -0.00 0.11 -0.16 0.00 0.03 0.00 0.00 46.19 46.17 1nbw s LEU 111 CO 0.62 -0.07 1.24 -0.81 0.23 0.00 0.00 176.35 177.56 1nbw n PRO 112 N 2.76 1.27 -2.28 1.29 -0.04 -1.26 -4.40 135.00 132.34 1nbw n PRO 112 Ca -0.14 0.45 -0.41 0.00 -0.04 0.00 0.00 63.50 63.36 1nbw n PRO 112 Cb 0.59 -2.01 -0.03 0.00 -0.04 0.00 0.00 33.50 32.01 1nbw n PRO 112 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1nbw s LEU 113 N 0.58 4.45 0.51 1.53 1.43 -1.26 -4.97 118.68 120.95 1nbw s LEU 113 Ca 0.76 2.39 -0.21 0.00 -1.03 0.00 0.00 54.13 56.03 1nbw s LEU 113 Cb -0.85 -3.62 -0.06 0.00 0.03 0.00 0.00 46.19 41.69 1nbw s LEU 113 CO 0.50 -0.43 1.19 -0.44 0.23 0.00 0.00 176.35 177.40 1nbw s SER 114 N -0.04 5.79 0.00 2.29 0.01 -1.26 -5.01 113.70 115.48 1nbw s SER 114 Ca 0.53 2.35 0.00 0.00 1.31 0.00 0.00 55.95 60.13 1nbw s SER 114 Cb -0.35 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.27 1nbw s SER 114 CO 0.41 -1.18 0.00 -1.84 0.41 0.00 0.00 173.24 171.04 1nbw n GLU 115 N -0.92 0.00 0.00 12.44 0.00 -1.26 -4.94 120.64 125.96 1nbw n GLU 115 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.26 1nbw n GLU 115 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.93 1nbw n GLU 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1nbw n ARG 116 N 0.00 0.00 0.00 3.44 1.74 -1.26 -5.01 116.66 115.57 1nbw n ARG 116 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1nbw n ARG 116 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1nbw n ARG 116 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20