#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zet n LEU 5 N 0.00 2.54 -4.25 2.89 7.94 -1.26 -4.89 117.00 119.97 2zet n LEU 5 Ca 0.00 0.73 -0.43 0.00 -1.11 0.00 0.00 56.01 55.20 2zet n LEU 5 Cb 0.00 -1.26 -0.06 0.00 0.53 0.00 0.00 43.42 42.63 2zet n LEU 5 CO 0.00 -0.48 0.15 1.51 -1.11 0.00 0.00 177.39 177.46 2zet s ASP 6 N 5.52 6.05 0.00 1.96 3.84 -1.26 -4.84 116.67 127.94 2zet s ASP 6 Ca 1.02 -2.25 0.07 0.00 -0.00 0.00 0.00 52.55 51.40 2zet s ASP 6 Cb -0.87 -2.09 0.24 0.00 -1.38 0.00 0.00 42.92 38.81 2zet s ASP 6 CO 0.54 -0.65 1.18 0.18 -0.00 0.00 0.00 175.17 176.42 2zet n LEU 7 N 4.51 0.96 -0.23 2.11 4.77 -1.26 -4.36 117.00 123.51 2zet n LEU 7 Ca -0.01 -0.48 0.00 0.00 -0.03 0.00 0.00 56.01 55.50 2zet n LEU 7 Cb 0.42 -0.12 0.12 0.00 -2.33 0.00 0.00 43.42 41.51 2zet n LEU 7 CO 0.41 0.24 1.05 0.77 -1.33 0.00 0.00 177.39 178.53 2zet h SER 8 N 1.07 0.42 -0.98 -1.43 4.64 -1.92 -0.21 113.55 115.15 2zet h SER 8 Ca 0.00 0.06 0.34 0.00 -0.47 0.00 0.00 61.79 61.71 2zet h SER 8 Cb 0.24 -0.02 -0.17 0.00 -0.31 0.00 0.00 62.40 62.15 2zet h SER 8 CO 0.00 0.25 0.41 0.74 -0.87 0.00 0.00 176.83 177.36 2zet h THR 9 N 0.57 0.14 -1.78 2.95 2.02 -2.03 -3.41 112.91 111.37 2zet h THR 9 Ca 0.32 -0.04 -0.68 0.00 0.77 0.00 0.00 66.41 66.78 2zet h THR 9 Cb 0.32 0.00 0.03 0.00 -1.74 0.00 0.00 68.15 66.76 2zet h THR 9 CO -0.25 0.02 0.79 0.18 0.37 0.00 0.00 175.52 176.63 2zet n LEU 10 N -5.24 2.45 -4.73 2.58 7.99 -0.09 -4.96 117.00 115.01 2zet n LEU 10 Ca 0.31 1.07 -0.29 0.00 -0.01 0.00 0.00 56.01 57.09 2zet n LEU 10 Cb 1.01 -1.24 0.14 0.00 -0.11 0.00 0.00 43.42 43.22 2zet n LEU 10 CO 0.03 -0.53 0.67 0.42 -1.51 0.00 0.00 177.39 176.47 2zet s THR 11 N 2.34 2.53 0.14 -5.08 -4.23 -1.26 -4.79 115.64 105.30 2zet s THR 11 Ca 0.90 0.17 -0.11 0.00 -1.18 0.00 0.00 61.69 61.48 2zet s THR 11 Cb -0.91 -2.72 -0.04 0.00 1.34 0.00 0.00 72.50 70.17 2zet s THR 11 CO 0.53 -0.22 1.48 0.44 -0.54 0.00 0.00 174.62 176.31 2zet h ASP 12 N -1.56 1.00 -0.86 3.99 3.32 -1.95 -0.98 116.42 119.39 2zet h ASP 12 Ca -0.50 -0.45 0.12 0.00 0.02 0.00 0.00 57.03 56.21 2zet h ASP 12 Cb 1.30 -0.28 -0.06 0.00 0.22 0.00 0.00 39.33 40.50 2zet h ASP 12 CO 0.57 1.25 0.56 -0.33 -1.72 0.00 0.00 179.24 179.56 2zet h GLU 13 N 0.77 0.71 0.70 3.56 3.07 -1.99 0.26 114.58 121.66 2zet h GLU 13 Ca 0.07 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 58.85 2zet h GLU 13 Cb 0.95 -0.16 0.01 0.00 -0.84 0.00 0.00 28.75 28.70 2zet h GLU 13 CO 0.09 0.47 -0.34 0.93 -1.40 0.00 0.00 179.01 178.77 2zet h GLU 14 N 0.73 -0.91 -0.81 2.33 5.08 -1.92 -2.68 114.58 116.42 2zet h GLU 14 Ca 0.41 0.06 0.13 0.00 -1.00 0.00 0.00 59.36 58.96 2zet h GLU 14 Cb 0.58 0.21 -0.14 0.00 0.50 0.00 0.00 28.75 29.89 2zet h GLU 14 CO -0.18 -0.60 -0.38 0.00 -1.00 0.00 0.00 179.01 176.85 2zet h ALA 15 N -1.24 0.01 -0.93 3.43 0.00 0.05 0.66 119.26 121.25 2zet h ALA 15 Ca -0.10 0.21 0.18 0.00 0.00 0.00 0.00 54.91 55.21 2zet h ALA 15 Cb 0.72 0.94 -0.08 0.00 0.00 0.00 0.00 17.79 19.38 2zet h ALA 15 CO 0.16 -0.68 0.60 1.49 0.00 0.00 0.00 179.25 180.82 2zet h GLU 16 N -0.08 0.58 0.34 0.00 4.81 -0.55 -2.39 114.58 117.28 2zet h GLU 16 Ca 0.28 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.46 2zet h GLU 16 Cb 0.57 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.82 2zet h GLU 16 CO -0.85 0.38 -0.16 1.25 -0.73 0.00 0.00 179.01 178.91 2zet h HIS 17 N 0.60 -0.42 -0.36 0.92 2.76 0.64 -3.04 115.15 116.25 2zet h HIS 17 Ca 0.49 -0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.71 2zet h HIS 17 Cb 0.95 0.14 -0.09 0.00 1.55 0.00 0.00 27.41 29.96 2zet h HIS 17 CO -0.00 -0.08 -0.44 0.28 -1.30 0.00 0.00 177.93 176.39 2zet h VAL 18 N -0.86 0.10 -0.68 5.26 2.07 -0.79 -1.21 116.25 120.14 2zet h VAL 18 Ca -0.05 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.61 2zet h VAL 18 Cb 0.53 0.10 -0.13 0.00 -1.52 0.00 0.00 31.29 30.27 2zet h VAL 18 CO 0.08 0.00 -0.18 -0.25 0.02 0.00 0.00 177.57 177.24 2zet h TRP 19 N -0.37 -0.38 0.02 1.57 -0.00 -1.55 0.13 115.95 115.38 2zet h TRP 19 Ca 0.12 0.06 0.02 0.00 -0.00 0.00 0.00 58.89 59.09 2zet h TRP 19 Cb 0.59 0.27 -0.05 0.00 -0.00 0.00 0.00 29.16 29.97 2zet h TRP 19 CO -0.61 -0.30 -0.52 0.00 -0.00 0.00 0.00 178.44 177.01 2zet h ALA 20 N 1.66 -0.92 -0.64 2.65 0.00 -1.12 0.63 119.26 121.52 2zet h ALA 20 Ca 0.32 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 55.28 2zet h ALA 20 Cb 0.50 0.92 -0.11 0.00 0.00 0.00 0.00 17.79 19.10 2zet h ALA 20 CO -0.70 -1.10 -0.02 0.28 0.00 0.00 0.00 179.25 177.71 2zet h VAL 21 N -0.68 0.46 -0.78 0.00 2.07 -0.43 0.21 116.25 117.10 2zet h VAL 21 Ca 0.01 -0.03 0.03 0.00 0.82 0.00 0.00 66.70 67.53 2zet h VAL 21 Cb 0.72 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 2zet h VAL 21 CO -0.34 0.02 0.51 0.58 0.02 0.00 0.00 177.57 178.36 2zet h VAL 22 N 0.10 1.13 0.24 2.57 2.07 0.14 -1.63 116.25 120.87 2zet h VAL 22 Ca 0.33 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2zet h VAL 22 Cb 0.54 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2zet h VAL 22 CO -0.56 0.18 -0.11 1.56 0.02 0.00 0.00 177.57 178.65 2zet h GLN 23 N 0.97 -0.31 -0.94 1.57 4.20 0.33 -0.87 115.11 120.06 2zet h GLN 23 Ca 0.31 0.02 0.16 0.00 0.06 0.00 0.00 58.65 59.20 2zet h GLN 23 Cb 0.03 0.07 -0.08 0.00 0.30 0.00 0.00 27.48 27.80 2zet h GLN 23 CO -0.09 -0.19 0.60 0.00 -0.67 0.00 0.00 178.83 178.48 2zet h ARG 24 N -0.33 0.68 -0.53 1.46 3.08 -0.70 0.20 114.38 118.23 2zet h ARG 24 Ca -0.03 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 2zet h ARG 24 Cb 0.26 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 2zet h ARG 24 CO 0.05 0.45 0.08 0.22 -1.07 0.00 0.00 179.97 179.70 2zet h ASP 25 N 0.70 0.86 -0.49 7.04 -0.00 -0.43 -1.29 116.42 122.80 2zet h ASP 25 Ca 0.49 -0.27 -0.06 0.00 -0.00 0.00 0.00 57.03 57.20 2zet h ASP 25 Cb 0.82 -0.23 -0.02 0.00 -0.00 0.00 0.00 39.33 39.91 2zet h ASP 25 CO -0.25 0.91 0.09 -0.26 -0.00 0.00 0.00 179.24 179.73 2zet h PHE 26 N 0.77 0.86 -0.64 0.28 -1.00 0.48 -0.68 116.94 117.01 2zet h PHE 26 Ca 0.16 -0.11 0.12 0.00 2.81 0.00 0.00 57.97 60.94 2zet h PHE 26 Cb 0.42 -0.24 -0.08 0.00 3.61 0.00 0.00 35.95 39.66 2zet h PHE 26 CO 0.03 0.78 0.20 -0.44 -1.61 0.00 0.00 178.31 177.27 2zet h ASP 27 N 0.69 0.13 0.34 2.17 3.45 -0.40 -0.31 116.42 122.49 2zet h ASP 27 Ca 0.15 0.10 -0.01 0.00 0.43 0.00 0.00 57.03 57.71 2zet h ASP 27 Cb 0.38 0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 39.25 2zet h ASP 27 CO 0.01 0.06 -0.27 0.25 -1.57 0.00 0.00 179.24 177.73 2zet h LEU 28 N 0.34 -0.70 -0.48 1.55 5.85 -0.70 -2.04 115.31 119.14 2zet h LEU 28 Ca 0.34 0.05 0.07 0.00 0.84 0.00 0.00 57.88 59.19 2zet h LEU 28 Cb 0.49 0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.68 2zet h LEU 28 CO -0.38 -0.40 0.13 0.03 -0.34 0.00 0.00 178.44 177.48 2zet h ARG 29 N -0.61 0.27 0.15 1.25 3.08 -0.40 -0.27 114.38 117.84 2zet h ARG 29 Ca -0.03 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.02 2zet h ARG 29 Cb 0.53 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.48 2zet h ARG 29 CO -0.01 0.18 -0.52 -0.09 -1.07 0.00 0.00 179.97 178.47 2zet h ARG 30 N 0.28 -0.74 -0.62 0.04 2.43 -0.94 -1.89 114.38 112.96 2zet h ARG 30 Ca 0.24 0.05 0.13 0.00 -0.81 0.00 0.00 59.98 59.58 2zet h ARG 30 Cb 0.28 0.17 -0.10 0.00 -0.42 0.00 0.00 29.97 29.90 2zet h ARG 30 CO -0.28 -0.49 0.02 0.00 -1.51 0.00 0.00 179.97 177.71 2zet h ARG 31 N -0.76 0.13 0.00 0.20 3.08 -0.71 -0.79 114.38 115.53 2zet h ARG 31 Ca -0.01 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 2zet h ARG 31 Cb 0.76 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.78 2zet h ARG 31 CO -0.27 0.09 -0.14 1.49 -1.07 0.00 0.00 179.97 180.07 2zet h GLU 32 N 0.13 0.00 0.01 0.04 4.57 -0.61 -0.55 114.58 118.17 2zet h GLU 32 Ca 0.32 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 58.31 2zet h GLU 32 Cb 0.52 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.09 2zet h GLU 32 CO -0.51 0.14 -0.92 0.93 -1.18 0.00 0.00 179.01 177.46 2zet h GLU 33 N 0.00 0.04 0.03 1.92 4.39 -0.36 -2.59 114.58 118.00 2zet h GLU 33 Ca -0.00 -0.05 -0.21 0.00 0.34 0.00 0.00 59.36 59.44 2zet h GLU 33 Cb 0.27 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 2zet h GLU 33 CO 0.02 0.93 -0.97 0.93 -1.16 0.00 0.00 179.01 178.75 2zet h GLU 34 N 0.02 0.13 -0.16 2.33 5.08 -0.97 -0.58 114.58 120.42 2zet h GLU 34 Ca -0.02 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.16 2zet h GLU 34 Cb 1.61 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.91 2zet h GLU 34 CO 0.12 1.00 0.07 -0.09 -1.00 0.00 0.00 179.01 179.11 2zet h ARG 35 N 0.05 0.23 -0.46 2.33 2.43 -1.08 -0.52 114.38 117.37 2zet h ARG 35 Ca -0.05 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.00 2zet h ARG 35 Cb 1.66 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 31.15 2zet h ARG 35 CO 0.14 0.29 -0.08 -0.07 -1.51 0.00 0.00 179.97 178.75 2zet h LEU 36 N 0.12 0.80 0.65 3.80 3.38 -1.43 -2.55 115.31 120.08 2zet h LEU 36 Ca 0.05 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 2zet h LEU 36 Cb 0.14 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 2zet h LEU 36 CO -0.01 0.91 -0.44 1.56 0.09 0.00 0.00 178.44 180.56 2zet h GLN 37 N 0.74 -0.99 -0.82 1.13 4.20 -0.82 -0.52 115.11 118.04 2zet h GLN 37 Ca 0.13 0.07 0.15 0.00 0.06 0.00 0.00 58.65 59.06 2zet h GLN 37 Cb 0.56 0.22 -0.15 0.00 0.30 0.00 0.00 27.48 28.41 2zet h GLN 37 CO 0.03 -0.66 -0.27 0.78 -0.67 0.00 0.00 178.83 178.05 2zet h GLY 38 N -1.03 0.37 0.99 3.46 0.00 -1.03 0.44 103.07 106.28 2zet h GLY 38 Ca -0.09 0.36 -0.02 0.00 0.00 0.00 0.00 47.33 47.58 2zet h GLY 38 CO 0.06 -0.28 0.30 1.41 0.00 0.00 0.00 176.54 178.03 2zet h LEU 39 N -0.03 0.75 -1.93 3.11 3.38 -1.30 0.12 115.31 119.42 2zet h LEU 39 Ca 0.36 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 2zet h LEU 39 Cb 0.60 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 2zet h LEU 39 CO -0.86 0.66 -0.11 0.11 0.09 0.00 0.00 178.44 178.32 2zet h LYS 40 N 0.80 0.00 -0.21 1.13 1.57 0.84 -0.52 116.57 120.17 2zet h LYS 40 Ca 0.20 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.79 2zet h LYS 40 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.41 2zet h LYS 40 CO -0.03 0.11 -0.61 0.78 -0.57 0.00 0.00 179.45 179.14 2zet h GLY 41 N 0.55 0.86 1.46 3.86 0.00 0.17 -2.84 103.07 107.13 2zet h GLY 41 Ca -0.00 -1.11 -0.09 0.00 0.00 0.00 0.00 47.33 46.13 2zet h GLY 41 CO 0.01 0.99 -0.16 0.50 0.00 0.00 0.00 176.54 177.89 2zet h LYS 42 N 0.53 0.64 -0.16 4.80 1.57 0.51 -2.25 116.57 122.21 2zet h LYS 42 Ca -0.02 -0.21 -0.09 0.00 -1.87 0.00 0.00 60.65 58.46 2zet h LYS 42 Cb 1.23 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.48 2zet h LYS 42 CO 0.13 0.77 -0.30 0.82 -0.57 0.00 0.00 179.45 180.29 2zet h ILE 43 N 0.58 1.27 -0.07 1.86 2.04 -1.09 -1.91 117.51 120.18 2zet h ILE 43 Ca 0.10 -1.29 -0.13 0.00 1.00 0.00 0.00 64.86 64.54 2zet h ILE 43 Cb 0.60 1.49 0.01 0.00 -0.74 0.00 0.00 36.82 38.17 2zet h ILE 43 CO 0.04 0.39 -0.45 1.56 0.00 0.00 0.00 178.15 179.69 2zet h GLN 44 N 0.27 0.42 0.68 2.37 4.20 -1.32 -1.09 115.11 120.65 2zet h GLN 44 Ca 0.04 -0.37 -0.03 0.00 0.06 0.00 0.00 58.65 58.35 2zet h GLN 44 Cb 0.68 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.53 2zet h GLN 44 CO 0.05 1.01 -0.48 -0.22 -0.67 0.00 0.00 178.83 178.52 2zet h LYS 45 N -0.04 -1.07 -0.89 1.46 3.64 -1.32 0.10 116.57 118.44 2zet h LYS 45 Ca -0.04 0.07 0.09 0.00 -1.27 0.00 0.00 60.65 59.50 2zet h LYS 45 Cb 1.11 0.24 -0.06 0.00 -0.41 0.00 0.00 32.23 33.11 2zet h LYS 45 CO 0.09 -0.71 0.58 0.93 -2.27 0.00 0.00 179.45 178.07 2zet h GLU 46 N -1.11 0.89 -0.49 1.90 4.39 -1.45 -1.54 114.58 117.17 2zet h GLU 46 Ca -0.09 -0.05 -0.09 0.00 0.34 0.00 0.00 59.36 59.46 2zet h GLU 46 Cb 0.91 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 29.34 2zet h GLU 46 CO 0.05 0.59 -0.06 0.66 -1.16 0.00 0.00 179.01 179.09 2zet h SER 47 N 0.92 0.85 0.41 1.42 4.64 -0.75 -2.65 113.55 118.39 2zet h SER 47 Ca 0.41 -0.24 -0.16 0.00 -0.47 0.00 0.00 61.79 61.32 2zet h SER 47 Cb 0.36 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.21 2zet h SER 47 CO -0.17 0.95 -0.70 0.77 -0.87 0.00 0.00 176.83 176.81 2zet h SER 48 N 0.79 0.29 -0.85 4.97 4.64 -0.01 -2.75 113.55 120.64 2zet h SER 48 Ca 0.14 -0.19 0.06 0.00 -0.47 0.00 0.00 61.79 61.33 2zet h SER 48 Cb 0.56 -0.09 -0.06 0.00 -0.31 0.00 0.00 62.40 62.50 2zet h SER 48 CO 0.03 0.89 0.52 0.50 -0.87 0.00 0.00 176.83 177.91 2zet h LYS 49 N 0.17 0.93 -0.94 4.77 3.64 -1.07 -0.26 116.57 123.80 2zet h LYS 49 Ca -0.02 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.31 2zet h LYS 49 Cb 1.24 -0.21 -0.05 0.00 -0.41 0.00 0.00 32.23 32.81 2zet h LYS 49 CO 0.11 0.61 0.61 0.00 -2.27 0.00 0.00 179.45 178.52 2zet h ARG 50 N 0.95 1.25 0.00 1.90 3.08 -1.21 -1.77 114.38 118.58 2zet h ARG 50 Ca 0.37 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.34 2zet h ARG 50 Cb 0.17 -0.28 0.00 0.00 0.08 0.00 0.00 29.97 29.94 2zet h ARG 50 CO -0.17 0.84 0.00 1.49 -1.07 0.00 0.00 179.97 181.05 2zet h GLU 51 N 1.28 0.00 0.00 0.04 4.81 -0.79 -1.17 114.58 118.76 2zet h GLU 51 Ca 0.34 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.44 2zet h GLU 51 Cb -0.13 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.23 2zet h GLU 51 CO -0.07 0.00 -1.03 1.28 -0.73 0.00 0.00 179.01 178.46 2zet n LEU 52 N -2.56 1.85 0.00 1.64 4.77 -0.73 -4.01 117.00 117.96 2zet n LEU 52 Ca 0.01 0.50 0.05 0.00 -0.03 0.00 0.00 56.01 56.54 2zet n LEU 52 Cb 0.20 -0.90 0.27 0.00 -2.33 0.00 0.00 43.42 40.66 2zet n LEU 52 CO 0.20 -0.06 0.62 0.18 -1.33 0.00 0.00 177.39 177.01 2zet n LEU 53 N -4.50 0.00 0.30 2.23 4.77 -0.81 -2.75 117.00 116.24 2zet n LEU 53 Ca -0.22 0.29 0.19 0.00 -0.03 0.00 0.00 56.01 56.24 2zet n LEU 53 Cb 0.51 -0.29 1.02 0.00 -2.33 0.00 0.00 43.42 42.33 2zet n LEU 53 CO 0.14 -0.19 1.16 0.77 -1.33 0.00 0.00 177.39 177.94 2zet h SER 54 N 0.00 0.00 -0.47 -1.43 4.64 -1.34 -0.56 113.55 114.39 2zet h SER 54 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2zet h SER 54 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2zet h SER 54 CO 0.00 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.43 2zet n ASP 55 N -3.34 4.66 -4.16 4.97 8.00 -1.11 -4.70 116.55 120.87 2zet n ASP 55 Ca -0.02 -2.77 -0.38 0.00 0.71 0.00 0.00 54.79 52.33 2zet n ASP 55 Cb 0.18 -0.58 -0.06 0.00 -0.02 0.00 0.00 41.12 40.65 2zet n ASP 55 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2zet s THR 56 N -2.42 4.63 -0.02 -3.53 2.01 -0.22 -5.05 115.64 111.04 2zet s THR 56 Ca 0.47 -3.56 -0.13 0.00 0.31 0.00 0.00 61.69 58.78 2zet s THR 56 Cb 0.35 -3.87 -0.06 0.00 0.01 0.00 0.00 72.50 68.92 2zet s THR 56 CO 0.16 -1.07 0.37 0.00 -0.69 0.00 0.00 174.62 173.39 2zet n ALA 57 N 2.69 -1.38 -2.49 7.40 0.00 -1.26 -2.67 120.51 122.79 2zet n ALA 57 Ca 0.19 0.19 -0.04 0.00 0.00 0.00 0.00 53.44 53.78 2zet n ALA 57 Cb 0.38 -0.58 -0.00 0.00 0.00 0.00 0.00 19.45 19.25 2zet n ALA 57 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2zet n HIS 58 N 0.59 -1.81 -0.02 0.00 8.25 -1.26 -4.85 115.22 116.11 2zet n HIS 58 Ca 0.07 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.52 2zet n HIS 58 Cb 0.02 -1.56 0.25 0.00 1.12 0.00 0.00 29.99 29.83 2zet n HIS 58 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2zet h LEU 59 N -0.01 0.55 -2.34 2.41 5.85 -1.87 -2.79 115.31 117.12 2zet h LEU 59 Ca -0.09 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 2zet h LEU 59 Cb 1.07 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.95 2zet h LEU 59 CO 0.11 0.64 -0.04 -1.13 -0.34 0.00 0.00 178.44 177.68 2zet h ASN 60 N 0.55 0.00 -0.31 1.25 -0.00 -1.88 -1.49 115.58 113.70 2zet h ASN 60 Ca 0.11 0.00 -0.03 0.00 -0.00 0.00 0.00 56.30 56.38 2zet h ASN 60 Cb 0.39 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 38.69 2zet h ASN 60 CO 0.02 0.04 0.10 -0.33 -0.00 0.00 0.00 177.43 177.26 2zet h GLU 61 N 0.00 0.56 0.00 6.67 5.08 -1.89 -3.30 114.58 121.69 2zet h GLU 61 Ca -0.00 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.23 2zet h GLU 61 Cb 0.16 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2zet h GLU 61 CO 0.01 0.51 -1.45 0.25 -1.00 0.00 0.00 179.01 177.32 2zet n THR 62 N -4.34 0.14 -4.98 1.13 -2.24 -0.97 -5.02 114.28 98.01 2zet n THR 62 Ca 0.02 -0.24 -0.31 0.00 -2.27 0.00 0.00 64.05 61.25 2zet n THR 62 Cb 0.18 0.02 -0.14 0.00 -2.10 0.00 0.00 70.33 68.29 2zet n THR 62 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2zet s HIS 63 N -2.52 2.42 0.28 4.78 3.76 -0.60 -2.20 115.29 121.22 2zet s HIS 63 Ca -0.03 -0.36 -0.30 0.00 -0.15 0.00 0.00 55.06 54.22 2zet s HIS 63 Cb 0.05 -1.47 -0.12 0.00 1.11 0.00 0.00 32.58 32.15 2zet s HIS 63 CO 0.37 0.11 1.52 0.00 -0.85 0.00 0.00 174.74 175.88 2zet h ALA 65 N 4.45 1.00 0.00 0.00 0.00 -1.62 -0.40 119.26 122.69 2zet h ALA 65 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2zet h ALA 65 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2zet h ALA 65 CO 0.77 0.00 -0.83 -2.13 0.00 0.00 0.00 179.25 177.06 2zet n ARG 66 N -2.89 0.44 0.00 0.00 0.00 -1.26 -4.70 116.66 108.25 2zet n ARG 66 Ca -0.01 0.17 0.12 0.00 -0.00 0.00 0.00 57.85 58.14 2zet n ARG 66 Cb 0.18 -1.27 0.30 0.00 0.00 0.00 0.00 32.46 31.67 2zet n ARG 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2zet n LEU 68 N -1.24 0.71 -4.72 0.00 4.77 -0.16 -4.95 117.00 111.41 2zet n LEU 68 Ca 0.08 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.73 2zet n LEU 68 Cb 0.34 -1.10 0.11 0.00 -2.33 0.00 0.00 43.42 40.43 2zet n LEU 68 CO 0.32 -0.36 0.74 -1.10 -1.33 0.00 0.00 177.39 175.67 2zet s GLN 69 N -0.71 1.89 0.11 3.23 -1.52 -1.26 -4.42 119.66 116.97 2zet s GLN 69 Ca 0.00 1.58 -0.30 0.00 -1.95 0.00 0.00 55.36 54.69 2zet s GLN 69 Cb 0.00 -1.82 -0.06 0.00 -0.22 0.00 0.00 33.01 30.91 2zet s GLN 69 CO 0.00 -1.99 0.96 -2.14 -0.25 0.00 0.00 175.29 171.87 2zet s PRO 70 N -4.28 4.70 0.14 2.91 0.02 -1.26 -1.79 135.00 135.43 2zet s PRO 70 Ca 0.70 1.44 -0.26 0.00 0.02 0.00 0.00 61.00 62.90 2zet s PRO 70 Cb -0.25 -3.37 -0.02 0.00 0.02 0.00 0.00 34.50 30.88 2zet s PRO 70 CO 0.50 0.23 1.60 1.88 -0.33 0.00 0.00 177.00 180.88 2zet h TYR 71 N 5.53 -0.97 0.00 6.54 0.99 -1.81 -2.07 116.97 125.18 2zet h TYR 71 Ca -0.43 0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.34 2zet h TYR 71 Cb 1.21 0.45 0.00 0.00 1.00 0.00 0.00 36.73 39.39 2zet h TYR 71 CO 0.65 -0.42 0.36 0.07 -0.00 0.00 0.00 178.16 178.82 2zet h ARG 72 N -0.40 0.00 0.00 4.88 0.11 -1.94 -0.50 114.38 116.53 2zet h ARG 72 Ca 0.10 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.18 2zet h ARG 72 Cb 0.57 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.65 2zet h ARG 72 CO -0.39 0.00 -0.49 1.28 0.10 0.00 0.00 179.97 180.47 2zet n LEU 73 N -2.50 0.55 -4.92 0.08 4.77 -0.78 -4.95 117.00 109.25 2zet n LEU 73 Ca -0.01 0.17 -0.26 0.00 -0.03 0.00 0.00 56.01 55.87 2zet n LEU 73 Cb 0.39 -0.25 0.05 0.00 -2.33 0.00 0.00 43.42 41.28 2zet n LEU 73 CO 0.09 0.02 0.58 -0.76 -1.33 0.00 0.00 177.39 175.99 2zet s LEU 74 N -3.59 3.03 0.00 2.23 1.43 -0.20 -5.02 118.68 116.56 2zet s LEU 74 Ca 0.09 0.60 0.16 0.00 -1.03 0.00 0.00 54.13 53.95 2zet s LEU 74 Cb 0.16 -3.35 0.11 0.00 0.03 0.00 0.00 46.19 43.14 2zet s LEU 74 CO 0.69 -1.31 0.99 0.18 0.23 0.00 0.00 176.35 177.12 2zet n LEU 75 N -2.75 2.23 0.00 1.79 4.77 -1.26 -4.98 117.00 116.81 2zet n LEU 75 Ca 0.06 -0.96 0.00 0.00 -0.03 0.00 0.00 56.01 55.08 2zet n LEU 75 Cb 0.59 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 2zet n LEU 75 CO 0.52 0.40 0.00 -0.46 -1.33 0.00 0.00 177.39 176.53 2zet n ASN 76 N 0.74 1.18 -3.80 -1.43 6.94 -1.26 -5.14 115.26 112.49 2zet n ASN 76 Ca 0.09 -0.27 -0.19 0.00 -0.02 0.00 0.00 54.58 54.19 2zet n ASN 76 Cb 0.40 0.00 -0.17 0.00 -2.36 0.00 0.00 39.78 37.65 2zet n ASN 76 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 2zet s SER 77 N -0.13 0.87 0.12 0.53 0.15 -1.26 -4.96 113.70 109.01 2zet s SER 77 Ca 0.00 -0.05 -0.08 0.00 0.70 0.00 0.00 55.95 56.53 2zet s SER 77 Cb 0.00 -0.30 -0.05 0.00 -1.71 0.00 0.00 66.02 63.95 2zet s SER 77 CO 0.00 -0.13 0.07 -1.14 1.20 0.00 0.00 173.24 173.24 2zet n ARG 78 N 4.49 0.00 -3.87 5.44 0.63 -1.26 -4.50 116.66 117.59 2zet n ARG 78 Ca -0.19 0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 56.63 2zet n ARG 78 Cb 0.50 -0.34 -0.10 0.00 0.45 0.00 0.00 32.46 32.98 2zet n ARG 78 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2zet s ARG 79 N -0.34 0.51 -0.14 -0.14 0.52 -0.54 -4.97 118.95 113.85 2zet s ARG 79 Ca 0.21 -0.43 -0.08 0.00 -0.52 0.00 0.00 55.73 54.91 2zet s ARG 79 Cb -0.25 0.21 -0.04 0.00 0.52 0.00 0.00 34.95 35.39 2zet s ARG 79 CO 0.21 -0.12 0.13 -0.65 0.02 0.00 0.00 175.30 174.88 2zet s GLN 80 N -1.54 3.62 0.04 3.54 -0.21 -1.26 -1.03 119.66 122.82 2zet s GLN 80 Ca -0.14 -0.16 -0.30 0.00 0.02 0.00 0.00 55.36 54.78 2zet s GLN 80 Cb -0.07 -3.24 -0.05 0.00 1.00 0.00 0.00 33.01 30.66 2zet s GLN 80 CO 0.01 0.66 1.09 0.00 -2.12 0.00 0.00 175.29 174.92 2zet n LEU 82 N 3.80 0.36 -0.01 0.00 4.77 -0.29 -1.13 117.00 124.50 2zet n LEU 82 Ca 0.07 0.61 -0.01 0.00 -0.03 0.00 0.00 56.01 56.65 2zet n LEU 82 Cb 0.48 -0.58 -0.00 0.00 -2.33 0.00 0.00 43.42 40.99 2zet n LEU 82 CO 0.54 -0.52 -0.09 1.21 -1.33 0.00 0.00 177.39 177.20 2zet n GLU 83 N -1.92 0.09 -0.25 3.23 4.07 -1.26 -4.64 120.64 119.96 2zet n GLU 83 Ca 0.02 0.19 0.10 0.00 -0.06 0.00 0.00 57.16 57.41 2zet n GLU 83 Cb 0.15 -0.81 0.27 0.00 -0.06 0.00 0.00 31.44 30.98 2zet n GLU 83 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2zet n SER 85 N 1.19 -2.14 -4.93 0.00 3.41 -0.28 -4.94 113.62 105.93 2zet n SER 85 Ca 0.19 -0.40 -0.20 0.00 -0.26 0.00 0.00 58.87 58.21 2zet n SER 85 Cb 0.50 -1.86 -0.02 0.00 -0.26 0.00 0.00 64.21 62.57 2zet n SER 85 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2zet s LEU 86 N -6.26 3.73 0.07 1.04 1.43 -1.26 -4.71 118.68 112.73 2zet s LEU 86 Ca 0.42 -0.39 0.01 0.00 -1.03 0.00 0.00 54.13 53.14 2zet s LEU 86 Cb -0.24 -2.47 -0.04 0.00 0.03 0.00 0.00 46.19 43.47 2zet s LEU 86 CO 0.52 -0.47 0.16 -0.36 0.23 0.00 0.00 176.35 176.43 2zet s PHE 87 N -2.28 3.39 0.12 0.29 0.40 -1.26 -0.87 117.98 117.78 2zet s PHE 87 Ca 0.45 0.18 -0.13 0.00 -0.60 0.00 0.00 56.93 56.83 2zet s PHE 87 Cb -0.08 -1.70 0.02 0.00 0.51 0.00 0.00 43.02 41.77 2zet s PHE 87 CO 0.29 0.56 0.33 0.14 0.70 0.00 0.00 175.22 177.25 2zet s VAL 88 N -1.47 0.09 0.86 -0.44 -7.23 -0.19 -1.61 120.40 110.40 2zet s VAL 88 Ca 0.33 -0.84 -0.12 0.00 -1.81 0.00 0.00 61.98 59.53 2zet s VAL 88 Cb -0.13 -1.30 0.11 0.00 0.56 0.00 0.00 36.38 35.62 2zet s VAL 88 CO 0.26 -0.41 1.13 0.00 -0.31 0.00 0.00 175.10 175.77 2zet h LYS 90 N -1.30 0.27 -0.11 0.00 3.64 -1.93 -1.81 116.57 115.33 2zet h LYS 90 Ca -0.49 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 58.91 2zet h LYS 90 Cb 1.31 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 33.07 2zet h LYS 90 CO 0.62 0.18 0.10 0.77 -2.27 0.00 0.00 179.45 178.84 2zet h SER 91 N 0.27 0.00 -0.50 4.20 0.02 -1.98 -1.42 113.55 114.15 2zet h SER 91 Ca 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 2zet h SER 91 Cb 0.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.83 2zet h SER 91 CO -0.29 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.40 2zet s SER 93 N -1.12 4.59 -0.09 0.00 1.04 -0.53 0.13 113.70 117.71 2zet s SER 93 Ca 0.38 -0.79 -0.10 0.00 0.48 0.00 0.00 55.95 55.91 2zet s SER 93 Cb 0.20 -0.72 0.03 0.00 0.10 0.00 0.00 66.02 65.63 2zet s SER 93 CO 0.27 -0.25 0.28 -1.00 0.98 0.00 0.00 173.24 173.53 2zet s HIS 94 N -2.43 -0.29 -0.33 5.02 0.09 0.25 -4.79 115.29 112.81 2zet s HIS 94 Ca 0.36 0.69 -0.28 0.00 -0.00 0.00 0.00 55.06 55.83 2zet s HIS 94 Cb -0.03 0.10 0.02 0.00 -0.00 0.00 0.00 32.58 32.67 2zet s HIS 94 CO 0.22 -0.18 1.03 0.00 -0.00 0.00 0.00 174.74 175.80 2zet s ALA 95 N -0.05 3.48 0.40 -1.40 0.00 -1.26 0.22 121.76 123.15 2zet s ALA 95 Ca -0.02 -0.17 -0.12 0.00 0.00 0.00 0.00 51.96 51.65 2zet s ALA 95 Cb -0.03 -3.62 -0.07 0.00 0.00 0.00 0.00 23.12 19.40 2zet s ALA 95 CO 0.01 -1.50 0.80 -3.38 0.00 0.00 0.00 175.76 171.69 2zet s HIS 96 N 3.58 3.44 0.08 0.00 -3.43 -1.26 -4.92 115.29 112.79 2zet s HIS 96 Ca 0.43 1.15 -0.07 0.00 -0.80 0.00 0.00 55.06 55.77 2zet s HIS 96 Cb -0.12 -2.52 0.08 0.00 -1.43 0.00 0.00 32.58 28.58 2zet s HIS 96 CO 0.16 -0.10 0.57 -2.30 -2.00 0.00 0.00 174.74 171.06 2zet n PRO 97 N -1.14 -0.09 -3.39 -0.38 -0.02 -1.26 -4.09 135.00 124.63 2zet n PRO 97 Ca 0.03 0.56 -0.25 0.00 -2.02 0.00 0.00 63.50 61.82 2zet n PRO 97 Cb 0.54 -0.83 -0.10 0.00 -0.02 0.00 0.00 33.50 33.09 2zet n PRO 97 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2zet s GLU 98 N -5.33 0.72 0.00 -0.52 2.02 -1.26 -5.08 118.70 109.26 2zet s GLU 98 Ca -0.05 -1.56 0.00 0.00 0.02 0.00 0.00 54.97 53.38 2zet s GLU 98 Cb 0.07 -1.20 0.00 0.00 0.10 0.00 0.00 34.13 33.10 2zet s GLU 98 CO 0.26 -1.29 0.00 0.39 0.02 0.00 0.00 175.26 174.64 2zet n GLU 99 N 3.54 0.00 -1.63 1.61 1.02 -1.26 -5.09 120.64 118.83 2zet n GLU 99 Ca 0.19 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.92 2zet n GLU 99 Cb 0.43 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.82 2zet n GLU 99 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2zet s GLN 100 N -0.28 2.91 0.00 3.49 -0.21 -1.26 -4.69 119.66 119.62 2zet s GLN 100 Ca 0.00 1.83 0.00 0.00 0.02 0.00 0.00 55.36 57.21 2zet s GLN 100 Cb 0.00 -4.41 0.00 0.00 1.00 0.00 0.00 33.01 29.60 2zet s GLN 100 CO 0.00 -2.36 0.00 0.41 -2.12 0.00 0.00 175.29 171.22 2zet n GLY 101 N 5.80 -0.41 3.51 3.09 0.00 -1.26 -5.09 105.19 110.81 2zet n GLY 101 Ca 0.31 -0.86 -0.13 0.00 0.00 0.00 0.00 46.02 45.34 2zet n GLY 101 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2zet s TRP 102 N -3.93 0.92 0.01 1.61 0.52 -1.26 -4.25 118.94 112.56 2zet s TRP 102 Ca 0.00 -1.19 0.00 0.00 0.02 0.00 0.00 56.10 54.93 2zet s TRP 102 Cb 0.00 -0.02 -0.01 0.00 -1.15 0.00 0.00 33.47 32.29 2zet s TRP 102 CO 0.00 -1.11 -0.02 -0.51 0.02 0.00 0.00 176.95 175.33 2zet s LEU 103 N -3.19 2.15 0.31 2.99 1.43 0.59 -1.13 118.68 121.82 2zet s LEU 103 Ca 0.29 -0.31 -0.27 0.00 -1.03 0.00 0.00 54.13 52.82 2zet s LEU 103 Cb -0.00 0.04 -0.10 0.00 0.03 0.00 0.00 46.19 46.16 2zet s LEU 103 CO 0.18 -0.17 0.96 0.00 0.23 0.00 0.00 176.35 177.55 2zet h ASP 105 N 3.34 0.05 0.10 0.00 3.32 0.79 0.16 116.42 124.19 2zet h ASP 105 Ca -0.47 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 56.62 2zet h ASP 105 Cb 1.20 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.78 2zet h ASP 105 CO 0.65 -0.06 -0.05 -0.65 -1.72 0.00 0.00 179.24 177.42 2zet h PRO 106 N 0.01 -0.14 -0.79 3.56 0.11 -1.91 -2.96 132.00 129.88 2zet h PRO 106 Ca 0.91 0.01 0.22 0.00 0.11 0.00 0.00 66.00 67.25 2zet h PRO 106 Cb 3.48 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 34.59 2zet h PRO 106 CO -0.12 0.30 0.56 0.00 -0.21 0.00 0.00 178.00 178.53 2zet h HIS 108 N 0.03 -0.07 -0.71 0.00 6.17 -1.16 -2.49 115.15 116.91 2zet h HIS 108 Ca 0.38 -0.00 -0.02 0.00 0.71 0.00 0.00 60.37 61.44 2zet h HIS 108 Cb 1.46 0.02 -0.03 0.00 2.52 0.00 0.00 27.41 31.38 2zet h HIS 108 CO -0.00 0.32 0.37 -0.07 0.71 0.00 0.00 177.93 179.26 2zet h LEU 109 N -0.47 0.90 -1.39 0.26 3.38 -0.95 -1.62 115.31 115.41 2zet h LEU 109 Ca -0.01 -0.11 0.26 0.00 0.09 0.00 0.00 57.88 58.12 2zet h LEU 109 Cb 0.42 -0.23 -0.09 0.00 0.09 0.00 0.00 40.66 40.85 2zet h LEU 109 CO 0.01 0.75 0.67 0.00 0.09 0.00 0.00 178.44 179.96 2zet h ALA 110 N 1.19 2.25 0.19 1.53 0.00 -0.70 -0.57 119.26 123.15 2zet h ALA 110 Ca 0.25 0.05 -0.34 0.00 0.00 0.00 0.00 54.91 54.87 2zet h ALA 110 Cb 0.06 0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.89 2zet h ALA 110 CO -0.04 -0.64 -1.67 -0.09 0.00 0.00 0.00 179.25 176.81 2zet h ARG 111 N 0.39 0.40 -0.87 0.00 2.43 -0.86 -3.04 114.38 112.83 2zet h ARG 111 Ca 0.58 -0.69 0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2zet h ARG 111 Cb 1.49 0.26 -0.05 0.00 -0.42 0.00 0.00 29.97 31.25 2zet h ARG 111 CO -0.27 1.31 0.57 0.28 -1.51 0.00 0.00 179.97 180.35 2zet h VAL 112 N 0.11 1.17 -0.32 0.20 2.07 -0.49 -1.83 116.25 117.17 2zet h VAL 112 Ca -0.31 -0.38 -0.04 0.00 0.82 0.00 0.00 66.70 66.78 2zet h VAL 112 Cb 2.10 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 2zet h VAL 112 CO 0.20 0.20 0.03 0.58 0.02 0.00 0.00 177.57 178.59 2zet h VAL 113 N 1.11 1.25 -0.42 2.57 2.07 -1.24 1.36 116.25 122.95 2zet h VAL 113 Ca 0.33 -0.89 -0.09 0.00 0.82 0.00 0.00 66.70 66.87 2zet h VAL 113 Cb -0.04 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 2zet h VAL 113 CO -0.09 0.29 -0.12 0.50 0.02 0.00 0.00 177.57 178.17 2zet h LYS 114 N 0.36 0.76 0.14 1.57 3.64 -1.34 -1.26 116.57 120.44 2zet h LYS 114 Ca 0.09 -0.26 -0.25 0.00 -1.27 0.00 0.00 60.65 58.96 2zet h LYS 114 Cb 0.40 -0.06 0.01 0.00 -0.41 0.00 0.00 32.23 32.17 2zet h LYS 114 CO 0.01 0.85 -1.23 0.82 -2.27 0.00 0.00 179.45 177.64 2zet h ILE 115 N 0.69 1.22 -0.45 2.00 2.04 -1.32 -3.38 117.51 118.32 2zet h ILE 115 Ca 0.12 -2.49 0.02 0.00 1.00 0.00 0.00 64.86 63.51 2zet h ILE 115 Cb 0.60 2.93 -0.02 0.00 -0.74 0.00 0.00 36.82 39.58 2zet h ILE 115 CO 0.04 0.73 0.30 1.23 0.00 0.00 0.00 178.15 180.45 2zet h GLY 116 N -0.05 0.59 1.06 5.37 0.00 0.19 -2.74 103.07 107.50 2zet h GLY 116 Ca -0.24 -0.21 -0.06 0.00 0.00 0.00 0.00 47.33 46.81 2zet h GLY 116 CO 0.12 0.19 0.22 1.48 0.00 0.00 0.00 176.54 178.55 2zet h SER 117 N 0.54 1.09 -3.91 0.19 4.64 -1.40 -3.47 113.55 111.23 2zet h SER 117 Ca 0.18 -0.22 -0.22 0.00 -0.47 0.00 0.00 61.79 61.06 2zet h SER 117 Cb 0.04 -0.29 0.09 0.00 -0.31 0.00 0.00 62.40 61.93 2zet h SER 117 CO -0.04 1.02 -0.41 0.18 -0.87 0.00 0.00 176.83 176.71 2zet n LEU 118 N -4.24 -2.93 -0.18 5.97 4.77 -1.04 -4.85 117.00 114.50 2zet n LEU 118 Ca 0.06 -0.33 -0.02 0.00 -0.03 0.00 0.00 56.01 55.69 2zet n LEU 118 Cb 0.24 -2.00 0.06 0.00 -2.33 0.00 0.00 43.42 39.39 2zet n LEU 118 CO 0.42 0.34 0.77 -0.08 -1.33 0.00 0.00 177.39 177.51 2zet h GLU 119 N -1.45 0.03 -0.83 3.23 4.81 -1.87 -0.65 114.58 117.85 2zet h GLU 119 Ca -0.34 -0.00 0.21 0.00 -0.13 0.00 0.00 59.36 59.10 2zet h GLU 119 Cb 1.21 -0.01 -0.13 0.00 0.63 0.00 0.00 28.75 30.45 2zet h GLU 119 CO 0.32 0.02 0.22 0.11 -0.73 0.00 0.00 179.01 178.94 2zet h TRP 120 N 0.03 0.33 0.35 0.92 5.08 -1.96 -1.47 115.95 119.23 2zet h TRP 120 Ca 0.27 0.05 -0.02 0.00 1.08 0.00 0.00 58.89 60.27 2zet h TRP 120 Cb 0.42 -0.01 0.00 0.00 -3.00 0.00 0.00 29.16 26.57 2zet h TRP 120 CO -0.43 -0.16 -0.17 -0.92 -1.28 0.00 0.00 178.44 175.48 2zet h TYR 121 N 0.24 -0.44 -0.03 0.12 3.20 -1.53 -3.08 116.97 115.45 2zet h TYR 121 Ca 0.50 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.37 2zet h TYR 121 Cb 0.96 0.14 -0.00 0.00 1.54 0.00 0.00 36.73 39.37 2zet h TYR 121 CO -0.27 -0.27 0.17 1.88 -1.64 0.00 0.00 178.16 178.03 2zet h TYR 122 N -1.06 0.00 0.12 -3.82 0.99 -1.16 -0.70 116.97 111.33 2zet h TYR 122 Ca -0.05 0.00 -0.33 0.00 2.00 0.00 0.00 58.73 60.35 2zet h TYR 122 Cb 0.36 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 38.08 2zet h TYR 122 CO 0.01 0.00 -1.74 1.96 -0.00 0.00 0.00 178.16 178.38 2zet h GLN 123 N 0.00 0.24 -0.06 4.88 1.08 -1.37 -2.10 115.11 117.79 2zet h GLN 123 Ca 0.01 -0.42 -0.10 0.00 -1.45 0.00 0.00 58.65 56.69 2zet h GLN 123 Cb 0.35 0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.92 2zet h GLN 123 CO -0.00 1.09 -0.44 0.45 -0.95 0.00 0.00 178.83 178.98 2zet h HIS 124 N 0.07 0.15 -0.07 2.96 3.86 -1.29 -0.28 115.15 120.55 2zet h HIS 124 Ca -0.32 -0.04 -0.02 0.00 -1.16 0.00 0.00 60.37 58.83 2zet h HIS 124 Cb 2.04 -0.03 -0.00 0.00 1.06 0.00 0.00 27.41 30.47 2zet h HIS 124 CO 0.07 0.55 -0.02 0.28 0.86 0.00 0.00 177.93 179.67 2zet h VAL 125 N 0.11 1.29 0.00 2.45 2.07 -1.23 -2.93 116.25 118.01 2zet h VAL 125 Ca 0.01 -0.92 -0.02 0.00 0.82 0.00 0.00 66.70 66.59 2zet h VAL 125 Cb 0.83 1.77 -0.00 0.00 -1.52 0.00 0.00 31.29 32.36 2zet h VAL 125 CO 0.06 0.25 -0.10 -0.09 0.02 0.00 0.00 177.57 177.72 2zet h ARG 126 N -0.20 0.00 -0.01 1.57 2.43 -1.10 -2.07 114.38 114.99 2zet h ARG 126 Ca 0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 2zet h ARG 126 Cb 0.41 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 2zet h ARG 126 CO 0.01 0.10 -0.28 0.00 -1.51 0.00 0.00 179.97 178.28 2zet n ALA 127 N -2.20 3.14 -0.02 2.80 0.00 -0.14 -4.14 120.51 119.95 2zet n ALA 127 Ca -0.01 -0.50 -0.00 0.00 0.00 0.00 0.00 53.44 52.93 2zet n ALA 127 Cb 0.27 -1.01 -0.06 0.00 0.00 0.00 0.00 19.45 18.64 2zet n ALA 127 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2zet n ARG 128 N -0.25 1.56 -4.26 0.00 0.63 -1.05 -5.02 116.66 108.28 2zet n ARG 128 Ca 0.12 -0.04 -0.14 0.00 -0.92 0.00 0.00 57.85 56.87 2zet n ARG 128 Cb 0.40 -1.20 -0.10 0.00 0.45 0.00 0.00 32.46 32.01 2zet n ARG 128 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2zet s PHE 129 N -2.37 1.31 -0.13 -0.14 0.40 -0.81 -5.07 117.98 111.18 2zet s PHE 129 Ca -0.03 -1.22 0.21 0.00 -0.60 0.00 0.00 56.93 55.28 2zet s PHE 129 Cb 0.04 -0.73 -0.18 0.00 0.51 0.00 0.00 43.02 42.66 2zet s PHE 129 CO 0.33 -0.43 0.70 0.36 0.70 0.00 0.00 175.22 176.89 2zet n LYS 130 N -0.34 0.64 -3.97 0.44 2.85 -1.26 -4.35 118.16 112.16 2zet n LYS 130 Ca -0.01 -0.00 -0.10 0.00 -1.05 0.00 0.00 58.31 57.15 2zet n LYS 130 Cb 0.66 -1.68 -0.07 0.00 -0.65 0.00 0.00 35.03 33.29 2zet n LYS 130 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 177.40 176.37 2zet s ARG 131 N -3.29 1.20 0.58 -1.58 3.03 -1.26 -4.98 118.95 112.66 2zet s ARG 131 Ca -0.05 -1.20 -0.07 0.00 2.03 0.00 0.00 55.73 56.44 2zet s ARG 131 Cb 0.11 0.38 -0.01 0.00 -1.03 0.00 0.00 34.95 34.40 2zet s ARG 131 CO 0.85 -0.45 0.91 -0.59 -1.13 0.00 0.00 175.30 174.89 2zet s PHE 132 N -3.98 3.42 0.01 5.89 -0.12 -1.26 -4.78 117.98 117.15 2zet s PHE 132 Ca 0.19 0.85 -0.03 0.00 -0.05 0.00 0.00 56.93 57.89 2zet s PHE 132 Cb 0.03 -2.65 -0.01 0.00 -0.63 0.00 0.00 43.02 39.76 2zet s PHE 132 CO 0.02 -0.69 0.72 0.41 -0.05 0.00 0.00 175.22 175.62 2zet n GLY 133 N -2.57 -2.05 0.39 1.99 0.00 -1.26 -1.11 105.19 100.58 2zet n GLY 133 Ca 0.04 0.45 0.16 0.00 0.00 0.00 0.00 46.02 46.66 2zet n GLY 133 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2zet h SER 134 N 0.00 0.48 0.68 1.61 0.02 -1.96 -0.30 113.55 114.08 2zet h SER 134 Ca 0.01 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.97 2zet h SER 134 Cb 0.04 -0.05 0.01 0.00 0.14 0.00 0.00 62.40 62.53 2zet h SER 134 CO -0.08 0.22 -0.33 0.00 -1.14 0.00 0.00 176.83 175.50 2zet h ALA 135 N 1.62 -1.17 -0.41 3.77 0.00 -1.49 0.40 119.26 121.97 2zet h ALA 135 Ca 0.44 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 55.22 2zet h ALA 135 Cb 0.95 0.35 -0.09 0.00 0.00 0.00 0.00 17.79 19.00 2zet h ALA 135 CO -0.17 -1.11 -0.44 -0.22 0.00 0.00 0.00 179.25 177.31 2zet h LYS 136 N -0.97 -0.32 0.00 0.00 3.64 -0.61 0.34 116.57 118.66 2zet h LYS 136 Ca -0.09 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2zet h LYS 136 Cb 0.70 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 2zet h LYS 136 CO 0.15 -0.21 0.07 0.28 -2.27 0.00 0.00 179.45 177.47 2zet h VAL 137 N -0.33 0.00 0.14 2.00 2.07 -1.04 -2.65 116.25 116.43 2zet h VAL 137 Ca 0.13 0.00 -0.30 0.00 0.82 0.00 0.00 66.70 67.36 2zet h VAL 137 Cb 0.59 0.76 0.02 0.00 -1.52 0.00 0.00 31.29 31.14 2zet h VAL 137 CO -0.58 0.00 -1.28 -0.29 0.02 0.00 0.00 177.57 175.45 2zet h ILE 138 N 0.00 1.34 -0.08 4.57 6.09 0.20 -2.48 117.51 127.15 2zet h ILE 138 Ca 0.00 -2.64 -0.16 0.00 -1.37 0.00 0.00 64.86 60.69 2zet h ILE 138 Cb 0.15 2.80 -0.01 0.00 0.47 0.00 0.00 36.82 40.23 2zet h ILE 138 CO 0.00 0.79 -0.65 0.03 -3.07 0.00 0.00 178.15 175.25 2zet h ARG 139 N 0.20 0.31 0.00 2.19 3.08 -1.35 -2.53 114.38 116.28 2zet h ARG 139 Ca -0.18 -0.23 -0.10 0.00 0.07 0.00 0.00 59.98 59.53 2zet h ARG 139 Cb 1.96 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 32.03 2zet h ARG 139 CO 0.23 0.85 -0.49 1.03 -1.07 0.00 0.00 179.97 180.52 2zet h SER 140 N 0.22 0.00 0.03 7.04 0.87 -1.59 -1.42 113.55 118.70 2zet h SER 140 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2zet h SER 140 Cb 1.19 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.15 2zet h SER 140 CO 0.11 0.49 -0.02 -0.11 -0.53 0.00 0.00 176.83 176.77 2zet n LEU 141 N -3.95 0.90 0.04 2.23 7.94 -0.93 -2.83 117.00 120.41 2zet n LEU 141 Ca -0.02 -0.28 0.13 0.00 -1.11 0.00 0.00 56.01 54.73 2zet n LEU 141 Cb 0.51 -0.02 0.34 0.00 0.53 0.00 0.00 43.42 44.78 2zet n LEU 141 CO 0.40 0.15 0.62 0.00 -1.11 0.00 0.00 177.39 177.46 2zet n GLY 143 N 1.40 1.34 0.00 0.00 0.00 -1.13 -5.10 105.19 101.70 2zet n GLY 143 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2zet n GLY 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86