#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rzw s THR 2 N 0.00 4.78 -0.11 2.03 -1.32 -1.26 -5.00 115.64 114.77 1rzw s THR 2 Ca 0.00 -1.64 -0.03 0.00 -1.21 0.00 0.00 61.69 58.81 1rzw s THR 2 Cb 0.00 -4.76 -0.03 0.00 -1.51 0.00 0.00 72.50 66.19 1rzw s THR 2 CO 0.00 -1.48 0.01 -0.76 -2.21 0.00 0.00 174.62 170.18 1rzw s LEU 3 N 2.53 3.62 -0.12 9.08 1.02 -1.25 -3.81 118.68 129.74 1rzw s LEU 3 Ca 0.32 0.13 -0.08 0.00 0.02 0.00 0.00 54.13 54.52 1rzw s LEU 3 Cb -0.05 -1.85 0.04 0.00 0.02 0.00 0.00 46.19 44.36 1rzw s LEU 3 CO -0.09 0.34 0.31 -0.75 0.02 0.00 0.00 176.35 176.17 1rzw s LYS 4 N -0.63 0.31 -0.22 1.70 2.47 0.79 -4.67 119.74 119.50 1rzw s LYS 4 Ca 0.10 0.55 -0.05 0.00 -1.56 0.00 0.00 55.97 55.01 1rzw s LYS 4 Cb -0.12 0.03 -0.02 0.00 -1.46 0.00 0.00 37.83 36.26 1rzw s LYS 4 CO 0.02 -0.11 -0.01 -1.14 0.16 0.00 0.00 175.35 174.27 1rzw s GLN 5 N 0.83 3.49 -0.11 4.03 -0.44 -1.07 0.26 119.66 126.66 1rzw s GLN 5 Ca -0.05 -0.57 -0.08 0.00 -2.50 0.00 0.00 55.36 52.15 1rzw s GLN 5 Cb -0.06 -3.07 0.04 0.00 -1.64 0.00 0.00 33.01 28.27 1rzw s GLN 5 CO -0.06 -0.12 0.27 0.08 0.50 0.00 0.00 175.29 175.97 1rzw s VAL 6 N 1.32 -0.02 -0.27 1.34 1.01 -1.14 -2.56 120.40 120.08 1rzw s VAL 6 Ca 0.04 0.06 -0.08 0.00 0.00 0.00 0.00 61.98 62.00 1rzw s VAL 6 Cb -0.14 -0.40 -0.02 0.00 0.00 0.00 0.00 36.38 35.82 1rzw s VAL 6 CO -0.00 0.02 0.09 -0.63 0.00 0.00 0.00 175.10 174.58 1rzw s ILE 7 N 0.64 4.37 0.02 2.22 1.09 -1.14 -2.11 121.20 126.29 1rzw s ILE 7 Ca -0.04 -0.26 -0.11 0.00 -1.10 0.00 0.00 60.65 59.13 1rzw s ILE 7 Cb -0.05 -3.11 -0.05 0.00 -1.06 0.00 0.00 42.46 38.18 1rzw s ILE 7 CO -0.04 0.25 0.37 -0.69 -0.10 0.00 0.00 174.94 174.74 1rzw s VAL 8 N 1.61 5.12 -0.13 2.92 1.01 -0.57 -2.93 120.40 127.42 1rzw s VAL 8 Ca 0.06 0.57 0.01 0.00 0.00 0.00 0.00 61.98 62.62 1rzw s VAL 8 Cb -0.16 -3.65 0.02 0.00 0.00 0.00 0.00 36.38 32.60 1rzw s VAL 8 CO 0.04 0.44 -0.15 0.68 0.00 0.00 0.00 175.10 176.12 1rzw s VAL 9 N -1.23 1.55 -0.79 2.92 -7.23 0.30 -0.87 120.40 115.06 1rzw s VAL 9 Ca 0.27 -0.65 -0.22 0.00 -1.81 0.00 0.00 61.98 59.58 1rzw s VAL 9 Cb -0.15 -1.44 0.08 0.00 0.56 0.00 0.00 36.38 35.44 1rzw s VAL 9 CO 0.15 0.45 1.10 -0.60 -0.31 0.00 0.00 175.10 175.89 1rzw s ARG 10 N 1.24 3.32 0.40 4.82 3.52 -0.46 -2.44 118.95 129.35 1rzw s ARG 10 Ca -0.01 -1.11 0.01 0.00 -0.13 0.00 0.00 55.73 54.50 1rzw s ARG 10 Cb -0.14 -4.57 -0.01 0.00 -1.56 0.00 0.00 34.95 28.67 1rzw s ARG 10 CO -0.06 -1.88 0.60 0.34 -0.81 0.00 0.00 175.30 173.49 1rzw s ASP 11 N 3.82 6.02 0.00 -2.12 -1.08 -1.26 -3.30 116.67 118.75 1rzw s ASP 11 Ca 0.29 0.29 0.00 0.00 -0.52 0.00 0.00 52.55 52.61 1rzw s ASP 11 Cb -0.10 -1.68 0.00 0.00 -1.46 0.00 0.00 42.92 39.67 1rzw s ASP 11 CO 0.02 -0.52 0.00 -0.67 0.52 0.00 0.00 175.17 174.53 1rzw n ASP 12 N -1.92 -1.38 -4.42 -0.34 -0.08 -1.26 -4.98 116.55 102.17 1rzw n ASP 12 Ca -0.01 0.00 -0.44 0.00 -1.51 0.00 0.00 54.79 52.83 1rzw n ASP 12 Cb 0.57 -0.36 -0.06 0.00 2.34 0.00 0.00 41.12 43.61 1rzw n ASP 12 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 1rzw s LEU 13 N -2.04 5.16 0.65 -2.67 2.96 -1.26 -4.91 118.68 116.57 1rzw s LEU 13 Ca 0.00 -1.09 0.06 0.00 -0.22 0.00 0.00 54.13 52.88 1rzw s LEU 13 Cb 0.00 -2.38 0.26 0.00 0.50 0.00 0.00 46.19 44.57 1rzw s LEU 13 CO 0.00 -0.91 1.12 0.11 -1.32 0.00 0.00 176.35 175.35 1rzw h LYS 14 N 9.01 0.00 -7.15 1.98 1.57 -2.00 -3.39 116.57 116.59 1rzw h LYS 14 Ca -0.28 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.01 1rzw h LYS 14 Cb 1.10 0.00 0.05 0.00 0.08 0.00 0.00 32.23 33.46 1rzw h LYS 14 CO 0.99 0.00 0.24 -0.51 -0.57 0.00 0.00 179.45 179.60 1rzw s LEU 15 N -5.26 3.34 -0.27 2.94 1.43 -1.26 -4.92 118.68 114.68 1rzw s LEU 15 Ca -0.01 1.02 -0.38 0.00 -1.03 0.00 0.00 54.13 53.73 1rzw s LEU 15 Cb 0.03 -3.95 -0.14 0.00 0.03 0.00 0.00 46.19 42.15 1rzw s LEU 15 CO 0.08 -0.86 1.87 -1.20 0.23 0.00 0.00 176.35 176.47 1rzw n SER 16 N -2.55 2.46 -0.54 2.29 7.64 -1.26 -4.80 113.62 116.85 1rzw n SER 16 Ca 0.04 0.92 0.04 0.00 1.01 0.00 0.00 58.87 60.87 1rzw n SER 16 Cb 0.56 -1.19 0.12 0.00 -1.01 0.00 0.00 64.21 62.68 1rzw n SER 16 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1rzw n ARG 17 N 6.22 1.70 0.00 1.43 1.74 -1.26 -4.07 116.66 122.42 1rzw n ARG 17 Ca 0.30 -0.96 0.00 0.00 -0.77 0.00 0.00 57.85 56.41 1rzw n ARG 17 Cb 0.17 -1.27 0.00 0.00 -1.02 0.00 0.00 32.46 30.34 1rzw n ARG 17 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rzw n GLY 18 N 0.83 -0.01 0.21 -0.13 0.00 -1.26 -3.01 105.19 101.83 1rzw n GLY 18 Ca 0.09 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.04 1rzw n GLY 18 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1rzw h LYS 19 N 0.00 0.48 -0.89 1.61 3.64 -2.00 -2.83 116.57 116.58 1rzw h LYS 19 Ca 0.00 -0.27 -0.01 0.00 -1.27 0.00 0.00 60.65 59.10 1rzw h LYS 19 Cb 0.00 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.79 1rzw h LYS 19 CO 0.00 0.85 0.53 -0.07 -2.27 0.00 0.00 179.45 178.50 1rzw h LEU 20 N 0.39 1.08 -1.04 5.20 -0.00 -1.75 0.11 115.31 119.29 1rzw h LEU 20 Ca 0.02 -0.07 -0.08 0.00 -0.00 0.00 0.00 57.88 57.75 1rzw h LEU 20 Cb 0.97 -0.27 -0.02 0.00 -0.00 0.00 0.00 40.66 41.35 1rzw h LEU 20 CO 0.09 0.83 -0.15 0.00 -0.00 0.00 0.00 178.44 179.21 1rzw h ALA 21 N 1.29 1.20 0.22 1.53 0.00 -1.44 -1.54 119.26 120.51 1rzw h ALA 21 Ca 0.32 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1rzw h ALA 21 Cb -0.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1rzw h ALA 21 CO -0.06 0.52 -0.10 0.28 0.00 0.00 0.00 179.25 179.88 1rzw h VAL 22 N 0.47 0.87 -0.60 0.00 2.07 -0.88 0.46 116.25 118.64 1rzw h VAL 22 Ca 0.08 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1rzw h VAL 22 Cb 0.54 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 1rzw h VAL 22 CO 0.03 0.13 0.38 -0.61 0.02 0.00 0.00 177.57 177.52 1rzw h GLN 23 N -0.58 0.80 -0.71 1.57 5.75 -0.96 -2.25 115.11 118.73 1rzw h GLN 23 Ca -0.03 -0.06 -0.04 0.00 -0.15 0.00 0.00 58.65 58.36 1rzw h GLN 23 Cb 0.43 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.77 1rzw h GLN 23 CO 0.05 0.56 0.27 0.28 -2.65 0.00 0.00 178.83 177.34 1rzw h VAL 24 N 0.81 1.25 -0.71 2.39 2.07 -1.24 0.78 116.25 121.60 1rzw h VAL 24 Ca 0.22 -0.80 0.04 0.00 0.82 0.00 0.00 66.70 66.98 1rzw h VAL 24 Cb -0.05 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 30.11 1rzw h VAL 24 CO -0.04 0.32 0.44 0.00 0.02 0.00 0.00 177.57 178.30 1rzw h ALA 25 N 1.13 0.94 -0.06 1.67 0.00 -0.46 2.06 119.26 124.54 1rzw h ALA 25 Ca 0.24 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1rzw h ALA 25 Cb 0.23 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1rzw h ALA 25 CO -0.02 0.19 0.01 0.45 0.00 0.00 0.00 179.25 179.89 1rzw h HIS 26 N 0.84 0.10 -0.32 0.00 -0.00 -0.91 -2.55 115.15 112.31 1rzw h HIS 26 Ca 0.29 -0.01 -0.03 0.00 -0.00 0.00 0.00 60.37 60.62 1rzw h HIS 26 Cb 0.06 -0.03 -0.02 0.00 -0.00 0.00 0.00 27.41 27.43 1rzw h HIS 26 CO -0.05 0.31 0.07 0.00 -0.00 0.00 0.00 177.93 178.26 1rzw h ALA 27 N 0.78 1.53 -0.78 2.45 0.00 0.08 -1.36 119.26 121.97 1rzw h ALA 27 Ca 0.02 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 54.85 1rzw h ALA 27 Cb 0.26 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 1rzw h ALA 27 CO 0.00 0.35 0.51 0.00 0.00 0.00 0.00 179.25 180.11 1rzw h ALA 28 N 1.63 1.61 -0.06 0.00 0.00 0.37 0.77 119.26 123.59 1rzw h ALA 28 Ca 0.11 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1rzw h ALA 28 Cb 0.19 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1rzw h ALA 28 CO -0.00 0.28 -0.15 0.82 0.00 0.00 0.00 179.25 180.20 1rzw h ILE 29 N 0.87 1.43 -0.83 0.00 2.04 -0.94 0.34 117.51 120.41 1rzw h ILE 29 Ca 0.33 -1.49 -0.01 0.00 1.00 0.00 0.00 64.86 64.69 1rzw h ILE 29 Cb 0.19 2.25 -0.04 0.00 -0.74 0.00 0.00 36.82 38.48 1rzw h ILE 29 CO -0.11 0.42 0.49 0.40 0.00 0.00 0.00 178.15 179.35 1rzw h ILE 30 N -0.29 1.23 -0.25 -0.67 1.08 -0.77 0.87 117.51 118.70 1rzw h ILE 30 Ca -0.00 -0.52 -0.05 0.00 -0.39 0.00 0.00 64.86 63.91 1rzw h ILE 30 Cb 0.75 0.08 -0.01 0.00 -3.07 0.00 0.00 36.82 34.57 1rzw h ILE 30 CO 0.03 0.24 -0.03 1.23 -0.69 0.00 0.00 178.15 178.94 1rzw h GLY 31 N 1.14 0.51 0.90 5.37 0.00 0.59 0.50 103.07 112.07 1rzw h GLY 31 Ca 0.30 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 47.23 1rzw h GLY 31 CO -0.05 0.36 -0.01 -1.82 0.00 0.00 0.00 176.54 175.02 1rzw h TYR 32 N 0.23 -0.02 -0.35 5.60 5.03 0.32 -2.47 116.97 125.30 1rzw h TYR 32 Ca 0.07 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.37 1rzw h TYR 32 Cb 0.47 0.01 -0.02 0.00 1.55 0.00 0.00 36.73 38.74 1rzw h TYR 32 CO 0.04 0.09 0.17 -0.07 -1.32 0.00 0.00 178.16 177.07 1rzw h LEU 33 N -0.13 0.42 -0.40 2.82 3.38 0.81 0.95 115.31 123.17 1rzw h LEU 33 Ca -0.00 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 57.98 1rzw h LEU 33 Cb 0.12 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1rzw h LEU 33 CO 0.00 0.37 0.16 0.50 0.09 0.00 0.00 178.44 179.56 1rzw h LYS 34 N 0.48 0.32 0.13 1.13 3.64 -0.42 -1.10 116.57 120.76 1rzw h LYS 34 Ca 0.12 -0.02 -0.36 0.00 -1.27 0.00 0.00 60.65 59.13 1rzw h LYS 34 Cb 0.05 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1rzw h LYS 34 CO -0.02 0.21 -1.92 1.03 -2.27 0.00 0.00 179.45 176.49 1rzw h SER 35 N 0.33 0.44 0.25 4.20 0.87 -1.24 -3.35 113.55 115.05 1rzw h SER 35 Ca 0.18 -0.94 0.00 0.00 -1.23 0.00 0.00 61.79 59.80 1rzw h SER 35 Cb 0.15 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1rzw h SER 35 CO -0.17 1.83 0.00 -0.78 -0.53 0.00 0.00 176.83 177.18 1rzw h ASP 36 N 0.04 0.00 0.00 6.23 1.82 0.97 -2.71 116.42 122.76 1rzw h ASP 36 Ca -0.40 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.24 1rzw h ASP 36 Cb 2.02 0.00 0.00 0.00 0.68 0.00 0.00 39.33 42.03 1rzw h ASP 36 CO 0.10 0.00 0.00 -0.24 -1.61 0.00 0.00 179.24 177.49 1rzw n SER 37 N -2.45 0.00 0.01 2.28 2.88 -0.42 -3.43 113.62 112.49 1rzw n SER 37 Ca -0.01 0.24 0.11 0.00 -1.33 0.00 0.00 58.87 57.88 1rzw n SER 37 Cb 0.11 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.44 1rzw n SER 37 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1rzw n SER 38 N -0.38 0.25 -0.06 -3.46 2.88 -1.26 -4.22 113.62 107.37 1rzw n SER 38 Ca 0.00 -0.04 -0.14 0.00 -1.33 0.00 0.00 58.87 57.36 1rzw n SER 38 Cb 0.00 1.60 -0.07 0.00 -0.75 0.00 0.00 64.21 64.99 1rzw n SER 38 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1rzw h LEU 39 N 0.00 0.59 -0.56 2.46 5.85 -1.64 -2.63 115.31 119.38 1rzw h LEU 39 Ca 0.00 -0.54 -0.08 0.00 0.84 0.00 0.00 57.88 58.09 1rzw h LEU 39 Cb 0.94 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 1rzw h LEU 39 CO 0.00 1.02 0.03 0.03 -0.34 0.00 0.00 178.44 179.18 1rzw h ARG 40 N 0.17 0.97 0.00 1.25 -0.00 -1.59 -1.61 114.38 113.57 1rzw h ARG 40 Ca 0.01 -0.29 -0.00 0.00 -0.50 0.00 0.00 59.98 59.19 1rzw h ARG 40 Cb 0.91 -0.10 -0.00 0.00 0.00 0.00 0.00 29.97 30.79 1rzw h ARG 40 CO 0.07 0.96 -0.01 -0.09 0.00 0.00 0.00 179.97 180.90 1rzw h ARG 41 N 0.86 0.00 0.00 0.04 1.12 -1.71 0.40 114.38 115.09 1rzw h ARG 41 Ca 0.16 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.03 1rzw h ARG 41 Cb 0.50 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.46 1rzw h ARG 41 CO 0.02 0.01 0.00 1.17 -3.11 0.00 0.00 179.97 178.06 1rzw n LYS 42 N -3.58 0.00 -0.13 0.20 4.81 -0.61 -4.10 118.16 114.74 1rzw n LYS 42 Ca -0.03 0.40 -0.22 0.00 -0.87 0.00 0.00 58.31 57.59 1rzw n LYS 42 Cb 0.10 -1.21 -0.11 0.00 0.02 0.00 0.00 35.03 33.83 1rzw n LYS 42 CO 0.00 0.00 0.00 -2.67 1.17 0.00 0.00 177.40 175.90 1rzw n TRP 43 N -1.70 0.03 0.04 5.64 2.14 -1.15 -4.30 117.44 118.15 1rzw n TRP 43 Ca 0.00 0.01 0.02 0.00 2.07 0.00 0.00 57.50 59.60 1rzw n TRP 43 Cb 0.00 -1.00 0.11 0.00 -0.81 0.00 0.00 31.31 29.61 1rzw n TRP 43 CO 0.00 0.00 0.00 -0.11 2.07 0.00 0.00 177.69 179.65 1rzw n LEU 44 N -3.59 0.11 -0.53 5.67 0.00 0.12 -2.73 117.00 116.05 1rzw n LEU 44 Ca -0.48 0.49 0.43 0.00 0.00 0.00 0.00 56.01 56.45 1rzw n LEU 44 Cb 0.96 -0.50 0.70 0.00 0.00 0.00 0.00 43.42 44.58 1rzw n LEU 44 CO 0.19 -0.53 1.26 -0.67 0.00 0.00 0.00 177.39 177.64 1rzw n ASP 45 N -1.60 0.14 -0.11 1.96 2.03 -0.08 0.24 116.55 119.13 1rzw n ASP 45 Ca -0.00 1.21 -0.11 0.00 0.52 0.00 0.00 54.79 56.40 1rzw n ASP 45 Cb 0.08 -0.60 -0.03 0.00 -0.72 0.00 0.00 41.12 39.85 1rzw n ASP 45 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1rzw h GLU 46 N 0.00 0.64 -0.45 -0.67 5.08 -1.83 -3.47 114.58 113.88 1rzw h GLU 46 Ca 0.87 -0.25 -0.15 0.00 -1.00 0.00 0.00 59.36 58.83 1rzw h GLU 46 Cb 3.04 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 32.20 1rzw h GLU 46 CO -0.30 0.82 -0.14 0.41 -1.00 0.00 0.00 179.01 178.79 1rzw n GLY 47 N -0.17 0.82 0.20 -3.84 0.00 0.67 -4.90 105.19 97.98 1rzw n GLY 47 Ca -0.02 -0.70 0.09 0.00 0.00 0.00 0.00 46.02 45.38 1rzw n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rzw n GLN 48 N -2.64 1.43 -1.60 1.61 10.64 -1.26 -4.45 117.38 121.12 1rzw n GLN 48 Ca -0.08 -0.43 -0.12 0.00 -1.83 0.00 0.00 57.00 54.55 1rzw n GLN 48 Cb 0.29 -1.33 0.08 0.00 -0.86 0.00 0.00 30.24 28.42 1rzw n GLN 48 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59 1rzw n LYS 49 N -0.76 2.70 -3.53 2.61 -0.00 -1.26 -5.01 118.16 112.91 1rzw n LYS 49 Ca 0.05 -3.76 -0.40 0.00 -0.00 0.00 0.00 58.31 54.20 1rzw n LYS 49 Cb 0.32 -1.93 -0.10 0.00 -0.00 0.00 0.00 35.03 33.31 1rzw n LYS 49 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1rzw s LYS 50 N -3.36 3.59 0.08 -1.58 2.36 -1.26 -2.61 119.74 116.96 1rzw s LYS 50 Ca 0.45 -0.55 -0.07 0.00 -2.55 0.00 0.00 55.97 53.24 1rzw s LYS 50 Cb 0.39 -3.78 -0.01 0.00 -1.05 0.00 0.00 37.83 33.38 1rzw s LYS 50 CO -0.01 -0.40 0.14 0.08 1.55 0.00 0.00 175.35 176.71 1rzw s VAL 51 N 1.76 0.16 -0.08 4.02 1.01 -1.06 -5.06 120.40 121.16 1rzw s VAL 51 Ca 0.07 -1.30 0.03 0.00 0.00 0.00 0.00 61.98 60.78 1rzw s VAL 51 Cb -0.17 -1.37 0.01 0.00 0.00 0.00 0.00 36.38 34.85 1rzw s VAL 51 CO 0.11 -0.72 -0.18 -0.69 0.00 0.00 0.00 175.10 173.62 1rzw s VAL 52 N -3.85 1.56 0.41 2.92 1.01 -1.26 -2.91 120.40 118.28 1rzw s VAL 52 Ca 0.05 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.33 1rzw s VAL 52 Cb 0.05 -1.37 -0.03 0.00 0.00 0.00 0.00 36.38 35.03 1rzw s VAL 52 CO -0.11 0.45 0.09 -0.76 0.00 0.00 0.00 175.10 174.77 1rzw s LEU 53 N 0.42 2.11 0.28 3.92 1.43 -1.15 -5.00 118.68 120.69 1rzw s LEU 53 Ca -0.14 -1.59 0.04 0.00 -1.03 0.00 0.00 54.13 51.40 1rzw s LEU 53 Cb -0.16 -0.29 -0.03 0.00 0.03 0.00 0.00 46.19 45.74 1rzw s LEU 53 CO 0.06 -0.83 0.42 -0.54 0.23 0.00 0.00 176.35 175.68 1rzw s LYS 54 N -3.78 3.41 0.04 1.70 1.02 -1.26 -0.54 119.74 120.33 1rzw s LYS 54 Ca 0.24 -0.69 -0.09 0.00 0.02 0.00 0.00 55.97 55.45 1rzw s LYS 54 Cb 0.04 -2.83 -0.05 0.00 -0.52 0.00 0.00 37.83 34.47 1rzw s LYS 54 CO 0.13 0.31 0.35 0.08 -0.92 0.00 0.00 175.35 175.31 1rzw s VAL 55 N -2.09 5.16 -0.07 3.17 1.01 -1.02 -4.70 120.40 121.86 1rzw s VAL 55 Ca 0.37 0.40 -0.24 0.00 0.00 0.00 0.00 61.98 62.51 1rzw s VAL 55 Cb -0.09 -3.62 -0.30 0.00 0.00 0.00 0.00 36.38 32.37 1rzw s VAL 55 CO 0.31 0.35 0.86 0.07 0.00 0.00 0.00 175.10 176.69 1rzw h LYS 56 N 3.94 0.23 -2.16 2.72 2.10 -1.89 -3.46 116.57 118.04 1rzw h LYS 56 Ca -0.50 -0.39 -0.06 0.00 -2.00 0.00 0.00 60.65 57.71 1rzw h LYS 56 Cb 1.20 0.14 -0.21 0.00 -0.90 0.00 0.00 32.23 32.46 1rzw h LYS 56 CO 0.66 1.18 0.08 0.45 -2.00 0.00 0.00 179.45 179.82 1rzw s SER 57 N -6.79 -0.65 0.25 7.07 0.15 -1.26 -5.03 113.70 107.44 1rzw s SER 57 Ca -0.15 1.06 -0.04 0.00 0.70 0.00 0.00 55.95 57.51 1rzw s SER 57 Cb -0.00 1.02 0.37 0.00 -1.71 0.00 0.00 66.02 65.71 1rzw s SER 57 CO 0.80 -0.36 1.83 0.25 1.20 0.00 0.00 173.24 176.96 1rzw h LEU 58 N 4.36 0.77 -0.51 3.45 5.85 -1.99 -0.57 115.31 126.68 1rzw h LEU 58 Ca -0.28 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.44 1rzw h LEU 58 Cb 1.16 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 1rzw h LEU 58 CO 0.20 0.47 0.20 -0.08 -0.34 0.00 0.00 178.44 178.89 1rzw h GLU 59 N 0.89 0.76 -0.56 1.25 4.81 -1.99 -0.23 114.58 119.51 1rzw h GLU 59 Ca 0.39 -0.14 -0.08 0.00 -0.13 0.00 0.00 59.36 59.40 1rzw h GLU 59 Cb 0.27 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 1rzw h GLU 59 CO -0.21 0.67 0.02 1.49 -0.73 0.00 0.00 179.01 180.26 1rzw h GLU 60 N 0.68 0.95 0.10 1.92 4.57 -1.79 -1.93 114.58 119.09 1rzw h GLU 60 Ca 0.17 -0.27 -0.00 0.00 -1.18 0.00 0.00 59.36 58.07 1rzw h GLU 60 Cb 0.20 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 1rzw h GLU 60 CO -0.01 0.93 -0.05 1.25 -1.18 0.00 0.00 179.01 179.94 1rzw h LEU 61 N 0.88 -0.11 -1.67 1.64 5.85 -0.78 -0.62 115.31 120.49 1rzw h LEU 61 Ca 0.17 -0.32 0.06 0.00 0.84 0.00 0.00 57.88 58.62 1rzw h LEU 61 Cb 0.49 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.52 1rzw h LEU 61 CO 0.02 0.28 0.31 0.25 -0.34 0.00 0.00 178.44 178.96 1rzw h LEU 62 N -0.53 0.35 0.01 2.25 5.85 -1.01 0.26 115.31 122.49 1rzw h LEU 62 Ca -0.01 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1rzw h LEU 62 Cb 0.43 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.38 1rzw h LEU 62 CO 0.02 0.24 -0.00 1.23 -0.34 0.00 0.00 178.44 179.58 1rzw h GLY 63 N 0.41 -0.01 1.34 3.75 0.00 -1.18 -3.15 103.07 104.23 1rzw h GLY 63 Ca 0.20 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.35 1rzw h GLY 63 CO -0.05 -0.00 -0.62 0.16 0.00 0.00 0.00 176.54 176.03 1rzw h ILE 64 N -0.75 1.31 -0.83 2.60 -0.00 -0.87 -2.41 117.51 116.56 1rzw h ILE 64 Ca -0.00 -1.86 0.06 0.00 -0.00 0.00 0.00 64.86 63.05 1rzw h ILE 64 Cb 0.73 1.82 -0.05 0.00 -0.00 0.00 0.00 36.82 39.31 1rzw h ILE 64 CO 0.00 0.59 0.54 0.07 -0.00 0.00 0.00 178.15 179.35 1rzw h LYS 65 N 0.50 0.93 -0.59 0.16 5.09 -1.08 0.35 116.57 121.94 1rzw h LYS 65 Ca -0.01 -0.06 -0.09 0.00 0.09 0.00 0.00 60.65 60.59 1rzw h LYS 65 Cb 1.20 -0.21 -0.02 0.00 0.10 0.00 0.00 32.23 33.30 1rzw h LYS 65 CO 0.12 0.61 0.03 1.25 -2.09 0.00 0.00 179.45 179.37 1rzw h HIS 66 N 0.95 1.10 -0.66 0.07 2.76 -1.48 0.71 115.15 118.60 1rzw h HIS 66 Ca 0.35 -0.18 -0.01 0.00 -2.20 0.00 0.00 60.37 58.33 1rzw h HIS 66 Cb 0.16 -0.29 -0.03 0.00 1.55 0.00 0.00 27.41 28.80 1rzw h HIS 66 CO -0.00 0.97 0.39 -0.22 -1.30 0.00 0.00 177.93 177.77 1rzw h LYS 67 N 0.91 0.91 -0.23 5.26 3.64 -0.27 0.51 116.57 127.30 1rzw h LYS 67 Ca 0.17 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1rzw h LYS 67 Cb 0.51 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 1rzw h LYS 67 CO 0.02 0.67 0.05 0.00 -2.27 0.00 0.00 179.45 177.93 1rzw h ALA 68 N 1.19 0.31 0.00 5.00 0.00 -0.00 -1.73 119.26 124.03 1rzw h ALA 68 Ca 0.24 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1rzw h ALA 68 Cb 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1rzw h ALA 68 CO -0.04 -0.04 -0.01 1.49 0.00 0.00 0.00 179.25 180.65 1rzw h GLU 69 N 0.20 0.00 -0.41 0.00 4.81 -0.40 -2.40 114.58 116.38 1rzw h GLU 69 Ca 0.07 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.34 1rzw h GLU 69 Cb 0.28 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 1rzw h GLU 69 CO 0.00 0.01 0.28 1.03 -0.73 0.00 0.00 179.01 179.59 1rzw h SER 70 N 0.00 0.37 -0.38 1.04 0.87 0.06 -0.52 113.55 114.98 1rzw h SER 70 Ca -0.00 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1rzw h SER 70 Cb 0.02 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 61.89 1rzw h SER 70 CO 0.00 0.25 0.00 0.00 -0.53 0.00 0.00 176.83 176.55 1rzw n LEU 71 N -4.48 2.17 0.00 2.23 -0.00 -0.91 -4.85 117.00 111.16 1rzw n LEU 71 Ca 0.04 -1.09 0.00 0.00 -0.00 0.00 0.00 56.01 54.97 1rzw n LEU 71 Cb 0.17 -0.28 0.00 0.00 -0.00 0.00 0.00 43.42 43.30 1rzw n LEU 71 CO 0.35 0.51 0.00 0.61 -0.00 0.00 0.00 177.39 178.86 1rzw n GLY 72 N 1.06 0.80 3.80 1.47 0.00 -0.20 -5.05 105.19 107.06 1rzw n GLY 72 Ca 0.13 -0.58 -0.39 0.00 0.00 0.00 0.00 46.02 45.19 1rzw n GLY 72 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1rzw s LEU 73 N 0.00 4.54 -0.55 0.99 2.96 -1.18 -5.00 118.68 120.43 1rzw s LEU 73 Ca 0.00 1.33 -0.28 0.00 -0.22 0.00 0.00 54.13 54.96 1rzw s LEU 73 Cb 0.00 -2.98 0.01 0.00 0.50 0.00 0.00 46.19 43.73 1rzw s LEU 73 CO 0.00 0.25 1.41 -0.69 -1.32 0.00 0.00 176.35 176.00 1rzw s VAL 74 N -1.06 3.80 0.03 1.68 1.01 -1.26 -4.11 120.40 120.49 1rzw s VAL 74 Ca 0.30 0.69 0.01 0.00 0.00 0.00 0.00 61.98 62.98 1rzw s VAL 74 Cb -0.20 -4.43 -0.02 0.00 0.00 0.00 0.00 36.38 31.72 1rzw s VAL 74 CO 0.20 -1.15 -0.05 0.42 0.00 0.00 0.00 175.10 174.52 1rzw s THR 75 N 6.01 0.32 -0.21 3.92 -4.23 -1.26 -0.85 115.64 119.33 1rzw s THR 75 Ca 0.53 -1.05 -0.29 0.00 -1.18 0.00 0.00 61.69 59.70 1rzw s THR 75 Cb -0.11 -0.50 0.14 0.00 1.34 0.00 0.00 72.50 73.37 1rzw s THR 75 CO 0.25 -0.48 1.09 -0.83 -0.54 0.00 0.00 174.62 174.11 1rzw s GLY 76 N -1.61 -0.15 -0.33 3.99 0.00 -1.08 -4.94 107.32 103.20 1rzw s GLY 76 Ca -0.12 2.39 -0.26 0.00 0.00 0.00 0.00 44.72 46.73 1rzw s GLY 76 CO -0.01 1.28 0.92 0.48 0.00 0.00 0.00 173.10 175.77 1rzw s LEU 77 N -0.73 4.01 -0.16 0.66 2.34 -1.26 -2.09 118.68 121.46 1rzw s LEU 77 Ca 0.01 0.75 -0.22 0.00 0.06 0.00 0.00 54.13 54.74 1rzw s LEU 77 Cb -0.02 -3.28 -0.03 0.00 -0.56 0.00 0.00 46.19 42.31 1rzw s LEU 77 CO -0.03 -0.77 0.65 -0.69 -1.06 0.00 0.00 176.35 174.45 1rzw s VAL 78 N 3.33 5.03 0.00 1.48 1.01 0.85 -4.90 120.40 127.19 1rzw s VAL 78 Ca 0.38 1.27 0.00 0.00 0.00 0.00 0.00 61.98 63.63 1rzw s VAL 78 Cb -0.13 -3.97 0.00 0.00 0.00 0.00 0.00 36.38 32.28 1rzw s VAL 78 CO 0.15 0.16 0.00 0.00 0.00 0.00 0.00 175.10 175.41 1rzw n GLN 79 N 4.63 0.00 -1.54 2.72 6.02 -1.26 -1.80 117.38 126.15 1rzw n GLN 79 Ca -0.01 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.80 1rzw n GLN 79 Cb 0.50 0.00 -0.11 0.00 1.02 0.00 0.00 30.24 31.65 1rzw n GLN 79 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1rzw n ASP 80 N -2.22 0.93 -0.05 1.08 9.92 -1.26 -4.68 116.55 120.27 1rzw n ASP 80 Ca 0.00 -1.15 -0.02 0.00 -0.53 0.00 0.00 54.79 53.09 1rzw n ASP 80 Cb 0.00 -1.34 0.24 0.00 -0.64 0.00 0.00 41.12 39.38 1rzw n ASP 80 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1rzw h ALA 81 N 12.63 1.28 -0.82 2.24 0.00 -1.91 -1.86 119.26 130.81 1rzw h ALA 81 Ca -0.00 -0.22 0.17 0.00 0.00 0.00 0.00 54.91 54.86 1rzw h ALA 81 Cb 1.06 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.62 1rzw h ALA 81 CO 1.19 0.49 0.55 0.78 0.00 0.00 0.00 179.25 182.25 1rzw h GLY 82 N 0.90 0.80 -2.00 0.00 0.00 -1.97 -3.40 103.07 97.40 1rzw h GLY 82 Ca 0.13 -0.19 -0.44 0.00 0.00 0.00 0.00 47.33 46.83 1rzw h GLY 82 CO 0.01 0.04 -0.11 1.08 0.00 0.00 0.00 176.54 177.56 1rzw s LEU 83 N -9.41 3.35 -0.41 3.11 1.02 -0.70 -5.07 118.68 110.58 1rzw s LEU 83 Ca -0.08 -0.30 0.05 0.00 0.02 0.00 0.00 54.13 53.81 1rzw s LEU 83 Cb 0.22 -2.54 0.31 0.00 0.02 0.00 0.00 46.19 44.20 1rzw s LEU 83 CO 0.77 -1.12 1.18 1.07 0.02 0.00 0.00 176.35 178.28 1rzw n THR 84 N -2.21 0.00 0.00 5.49 5.66 -1.26 -4.89 114.28 117.06 1rzw n THR 84 Ca 0.10 -1.17 0.00 0.00 -3.05 0.00 0.00 64.05 59.93 1rzw n THR 84 Cb 0.60 1.33 0.00 0.00 -1.55 0.00 0.00 70.33 70.71 1rzw n THR 84 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1rzw n GLU 85 N 0.70 0.00 -3.56 1.09 -0.58 -1.26 -5.05 120.64 111.97 1rzw n GLU 85 Ca 0.02 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.36 1rzw n GLU 85 Cb 0.71 0.00 -0.10 0.00 -0.57 0.00 0.00 31.44 31.48 1rzw n GLU 85 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 1rzw s VAL 86 N -0.32 4.42 0.24 2.62 -7.23 -1.26 -4.98 120.40 113.89 1rzw s VAL 86 Ca 0.00 -1.32 -0.04 0.00 -1.81 0.00 0.00 61.98 58.80 1rzw s VAL 86 Cb 0.00 -3.68 0.21 0.00 0.56 0.00 0.00 36.38 33.46 1rzw s VAL 86 CO 0.00 -0.51 1.77 -0.65 -0.31 0.00 0.00 175.10 175.40 1rzw h PRO 87 N 8.47 0.59 -6.98 4.82 0.11 -2.00 -3.43 132.00 133.58 1rzw h PRO 87 Ca -0.24 -0.04 -0.43 0.00 0.11 0.00 0.00 66.00 65.41 1rzw h PRO 87 Cb 1.09 -0.13 0.22 0.00 0.11 0.00 0.00 31.00 32.29 1rzw h PRO 87 CO 0.78 0.39 -0.29 -2.30 -0.21 0.00 0.00 178.00 176.36 1rzw n PRO 88 N -4.88 -2.61 0.00 1.05 -0.02 -1.26 -3.87 135.00 123.42 1rzw n PRO 88 Ca 0.14 -0.74 0.00 0.00 -2.02 0.00 0.00 63.50 60.87 1rzw n PRO 88 Cb 0.34 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1rzw n PRO 88 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rzw n GLY 89 N 1.39 2.95 3.88 -1.23 0.00 -1.26 -5.01 105.19 105.90 1rzw n GLY 89 Ca 0.02 -0.64 -0.24 0.00 0.00 0.00 0.00 46.02 45.17 1rzw n GLY 89 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1rzw s THR 90 N -1.42 2.06 1.03 2.61 -1.32 -1.25 -4.94 115.64 112.40 1rzw s THR 90 Ca 0.00 -1.46 -0.17 0.00 -1.21 0.00 0.00 61.69 58.85 1rzw s THR 90 Cb 0.00 -2.52 0.23 0.00 -1.51 0.00 0.00 72.50 68.70 1rzw s THR 90 CO 0.00 0.00 1.27 0.27 -2.21 0.00 0.00 174.62 173.95 1rzw s ILE 91 N -2.66 1.89 -0.60 5.08 -4.36 -1.26 -5.00 121.20 114.29 1rzw s ILE 91 Ca 0.40 0.00 -0.03 0.00 -0.26 0.00 0.00 60.65 60.76 1rzw s ILE 91 Cb -0.02 -2.87 0.16 0.00 1.25 0.00 0.00 42.46 40.98 1rzw s ILE 91 CO 0.24 0.00 0.42 -0.89 0.24 0.00 0.00 174.94 174.95 1rzw s THR 92 N -3.68 3.75 0.19 8.37 2.01 -1.21 -4.88 115.64 120.20 1rzw s THR 92 Ca 0.74 -2.79 -0.14 0.00 0.31 0.00 0.00 61.69 59.81 1rzw s THR 92 Cb -0.05 -3.45 -0.07 0.00 0.01 0.00 0.00 72.50 68.93 1rzw s THR 92 CO 0.54 -0.86 0.59 0.00 -0.69 0.00 0.00 174.62 174.20 1rzw s ALA 93 N 0.14 3.53 -0.02 7.40 0.00 -0.75 -1.35 121.76 130.71 1rzw s ALA 93 Ca 0.15 -0.11 -0.06 0.00 0.00 0.00 0.00 51.96 51.94 1rzw s ALA 93 Cb -0.20 -2.56 0.01 0.00 0.00 0.00 0.00 23.12 20.36 1rzw s ALA 93 CO -0.04 0.44 0.14 0.54 0.00 0.00 0.00 175.76 176.84 1rzw s VAL 94 N -1.61 0.05 -0.15 0.00 0.11 -0.05 0.29 120.40 119.04 1rzw s VAL 94 Ca 0.42 -0.38 -0.01 0.00 -2.93 0.00 0.00 61.98 59.09 1rzw s VAL 94 Cb -0.14 -0.32 -0.01 0.00 -1.53 0.00 0.00 36.38 34.38 1rzw s VAL 94 CO 0.20 -0.21 -0.12 0.54 -3.33 0.00 0.00 175.10 172.18 1rzw s VAL 95 N -0.70 3.05 -0.10 2.04 0.11 -0.89 -1.52 120.40 122.39 1rzw s VAL 95 Ca -0.08 -0.65 0.03 0.00 -2.93 0.00 0.00 61.98 58.36 1rzw s VAL 95 Cb -0.05 -2.30 0.00 0.00 -1.53 0.00 0.00 36.38 32.51 1rzw s VAL 95 CO 0.01 0.51 -0.21 -0.63 -3.33 0.00 0.00 175.10 171.44 1rzw s ILE 96 N 0.60 1.88 0.00 7.04 1.01 -0.90 -2.62 121.20 128.21 1rzw s ILE 96 Ca -0.07 -0.90 0.00 0.00 0.00 0.00 0.00 60.65 59.68 1rzw s ILE 96 Cb -0.15 -1.64 0.00 0.00 0.01 0.00 0.00 42.46 40.67 1rzw s ILE 96 CO 0.03 0.52 0.00 0.61 0.00 0.00 0.00 174.94 176.10 1rzw n GLY 97 N 3.72 -2.60 2.86 6.18 0.00 -0.03 -2.89 105.19 112.43 1rzw n GLY 97 Ca -0.20 -1.01 -0.40 0.00 0.00 0.00 0.00 46.02 44.42 1rzw n GLY 97 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rzw n PRO 98 N 0.00 2.15 -0.74 1.61 -0.04 -1.22 -3.74 135.00 133.02 1rzw n PRO 98 Ca 0.00 -2.04 -0.30 0.00 -0.04 0.00 0.00 63.50 61.12 1rzw n PRO 98 Cb 0.00 -2.95 0.26 0.00 -0.04 0.00 0.00 33.50 30.76 1rzw n PRO 98 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1rzw s ASP 99 N 4.03 0.14 -0.48 3.54 1.47 0.74 -3.31 116.67 122.80 1rzw s ASP 99 Ca 0.53 0.83 -0.18 0.00 1.18 0.00 0.00 52.55 54.91 1rzw s ASP 99 Cb 0.14 -1.19 0.06 0.00 -0.34 0.00 0.00 42.92 41.59 1rzw s ASP 99 CO 0.02 -4.62 0.52 -1.61 0.68 0.00 0.00 175.17 170.16 1rzw s GLU 100 N -5.16 3.07 0.60 2.11 2.02 -1.25 0.28 118.70 120.37 1rzw s GLU 100 Ca 0.69 -1.01 0.29 0.00 0.02 0.00 0.00 54.97 54.96 1rzw s GLU 100 Cb -0.13 -4.09 1.19 0.00 0.10 0.00 0.00 34.13 31.21 1rzw s GLU 100 CO 0.58 -1.10 1.56 1.05 0.02 0.00 0.00 175.26 177.37 1rzw h GLU 101 N 8.87 0.00 -0.44 1.61 4.11 -1.83 0.53 114.58 127.42 1rzw h GLU 101 Ca -0.28 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.13 1rzw h GLU 101 Cb 1.10 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 1rzw h GLU 101 CO 0.91 0.00 0.17 0.00 0.07 0.00 0.00 179.01 180.16 1rzw h ARG 102 N 0.00 0.67 0.16 1.06 3.08 -1.92 -0.75 114.38 116.68 1rzw h ARG 102 Ca 0.39 -0.12 -0.32 0.00 0.07 0.00 0.00 59.98 60.00 1rzw h ARG 102 Cb 2.24 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 32.18 1rzw h ARG 102 CO -0.00 0.62 -1.60 1.57 -1.07 0.00 0.00 179.97 179.48 1rzw h LYS 103 N 0.58 0.33 0.00 0.04 5.09 -0.40 -3.27 116.57 118.94 1rzw h LYS 103 Ca 0.15 -0.56 -0.01 0.00 0.09 0.00 0.00 60.65 60.32 1rzw h LYS 103 Cb 0.20 0.21 -0.00 0.00 0.10 0.00 0.00 32.23 32.74 1rzw h LYS 103 CO -0.01 1.22 -0.03 0.97 -2.09 0.00 0.00 179.45 179.51 1rzw h ILE 104 N 0.09 0.93 0.35 0.07 2.10 -1.26 -0.67 117.51 119.12 1rzw h ILE 104 Ca -0.28 -0.10 -0.01 0.00 1.08 0.00 0.00 64.86 65.55 1rzw h ILE 104 Cb 2.06 1.06 -0.00 0.00 -1.09 0.00 0.00 36.82 38.84 1rzw h ILE 104 CO 0.18 0.03 -0.20 0.44 -1.08 0.00 0.00 178.15 177.52 1rzw h ASP 105 N 0.00 -0.49 -0.06 2.19 3.32 -1.18 0.35 116.42 120.56 1rzw h ASP 105 Ca -0.00 0.03 -0.22 0.00 0.02 0.00 0.00 57.03 56.86 1rzw h ASP 105 Cb 0.05 0.14 0.01 0.00 0.22 0.00 0.00 39.33 39.76 1rzw h ASP 105 CO 0.00 -0.32 -0.82 0.07 -1.72 0.00 0.00 179.24 176.45 1rzw h LYS 106 N -0.52 0.66 -0.02 3.56 2.10 -1.61 0.87 116.57 121.62 1rzw h LYS 106 Ca -0.04 -0.63 -0.00 0.00 -2.00 0.00 0.00 60.65 57.97 1rzw h LYS 106 Cb 0.42 0.16 -0.00 0.00 -0.90 0.00 0.00 32.23 31.91 1rzw h LYS 106 CO 0.05 1.24 -0.01 0.28 -2.00 0.00 0.00 179.45 179.01 1rzw h VAL 107 N 0.31 1.33 -0.01 0.07 2.07 -1.08 -3.27 116.25 115.67 1rzw h VAL 107 Ca -0.09 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.44 1rzw h VAL 107 Cb 1.48 1.97 0.00 0.00 -1.52 0.00 0.00 31.29 33.22 1rzw h VAL 107 CO 0.16 0.26 -0.44 0.35 0.02 0.00 0.00 177.57 177.93 1rzw n THR 108 N -4.87 0.00 -2.57 2.57 -2.24 0.12 -4.88 114.28 102.42 1rzw n THR 108 Ca -0.08 -0.17 -0.01 0.00 -2.27 0.00 0.00 64.05 61.52 1rzw n THR 108 Cb 0.22 0.84 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 1rzw n THR 108 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rzw n GLY 109 N 1.40 -3.66 0.65 3.38 0.00 0.27 -4.79 105.19 102.44 1rzw n GLY 109 Ca 0.10 0.49 0.05 0.00 0.00 0.00 0.00 46.02 46.66 1rzw n GLY 109 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1rzw n ASN 110 N 0.46 1.86 -4.77 1.61 5.15 -1.02 -4.89 115.26 113.66 1rzw n ASN 110 Ca 0.02 -2.05 -0.38 0.00 -0.60 0.00 0.00 54.58 51.57 1rzw n ASN 110 Cb 0.07 -0.26 -0.03 0.00 -0.53 0.00 0.00 39.78 39.03 1rzw n ASN 110 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1rzw s LEU 111 N -1.02 4.19 0.14 1.20 1.43 -1.26 -4.91 118.68 118.45 1rzw s LEU 111 Ca 0.22 2.21 -0.33 0.00 -1.03 0.00 0.00 54.13 55.19 1rzw s LEU 111 Cb 0.12 -4.07 -0.17 0.00 0.03 0.00 0.00 46.19 42.10 1rzw s LEU 111 CO 0.14 -0.57 0.98 -2.65 0.23 0.00 0.00 176.35 174.47 1rzw n PRO 112 N 0.07 0.57 -2.26 1.29 -0.02 -1.26 -4.85 135.00 128.55 1rzw n PRO 112 Ca 0.04 0.20 -0.41 0.00 -2.02 0.00 0.00 63.50 61.32 1rzw n PRO 112 Cb 0.48 -1.58 -0.03 0.00 -0.02 0.00 0.00 33.50 32.35 1rzw n PRO 112 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1rzw s LEU 113 N 1.06 4.45 0.40 2.45 1.43 -1.26 -4.98 118.68 122.23 1rzw s LEU 113 Ca 0.75 2.43 -0.24 0.00 -1.03 0.00 0.00 54.13 56.05 1rzw s LEU 113 Cb -0.98 -3.62 -0.09 0.00 0.03 0.00 0.00 46.19 41.53 1rzw s LEU 113 CO 0.55 -0.43 1.05 -1.48 0.23 0.00 0.00 176.35 176.27 1rzw s LEU 114 N -0.90 4.14 -0.35 1.79 2.34 -1.26 -4.94 118.68 119.49 1rzw s LEU 114 Ca 0.51 2.05 -0.29 0.00 0.06 0.00 0.00 54.13 56.46 1rzw s LEU 114 Cb -0.36 -4.19 0.00 0.00 -0.56 0.00 0.00 46.19 41.09 1rzw s LEU 114 CO 0.43 -0.51 1.43 -0.54 -1.06 0.00 0.00 176.35 176.11 1rzw s LYS 115 N -2.50 3.67 0.01 1.48 1.02 -1.26 -4.81 119.74 117.35 1rzw s LYS 115 Ca 0.58 1.14 0.28 0.00 0.02 0.00 0.00 55.97 57.99 1rzw s LYS 115 Cb -0.22 -4.00 1.07 0.00 -0.52 0.00 0.00 37.83 34.16 1rzw s LYS 115 CO 0.28 -1.44 1.82 1.47 -0.92 0.00 0.00 175.35 176.56 1rzw n LEU 116 N 8.56 0.14 0.00 3.17 -0.00 -1.26 -4.73 117.00 122.88 1rzw n LEU 116 Ca 0.17 0.41 -0.09 0.00 -0.00 0.00 0.00 56.01 56.50 1rzw n LEU 116 Cb 0.47 -0.44 0.06 0.00 -0.00 0.00 0.00 43.42 43.51 1rzw n LEU 116 CO 0.68 0.01 0.24 -0.62 -0.00 0.00 0.00 177.39 177.70 1rzw n GLU 117 N -1.55 -0.66 -2.68 1.47 1.02 -1.26 -4.93 120.64 112.06 1rzw n GLU 117 Ca 0.07 -0.59 -0.43 0.00 -0.02 0.00 0.00 57.16 56.19 1rzw n GLU 117 Cb 0.35 -0.43 -0.03 0.00 -0.02 0.00 0.00 31.44 31.31 1rzw n GLU 117 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1rzw s HIS 118 N -1.81 2.79 0.00 -0.32 3.76 -1.26 -4.92 115.29 113.53 1rzw s HIS 118 Ca 0.22 0.48 0.00 0.00 -0.15 0.00 0.00 55.06 55.61 1rzw s HIS 118 Cb -0.01 -4.31 0.00 0.00 1.11 0.00 0.00 32.58 29.38 1rzw s HIS 118 CO 0.16 -1.32 0.00 1.58 -0.85 0.00 0.00 174.74 174.31 1rzw n HIS 119 N 7.78 0.00 -3.61 1.40 -0.00 -1.26 -5.08 115.22 114.45 1rzw n HIS 119 Ca 0.09 0.00 -0.03 0.00 0.46 0.00 0.00 57.72 58.24 1rzw n HIS 119 Cb 0.49 0.00 -0.02 0.00 -0.12 0.00 0.00 29.99 30.34 1rzw n HIS 119 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 1rzw s HIS 120 N 0.00 -0.09 -0.06 1.57 2.46 -1.26 -5.07 115.29 112.84 1rzw s HIS 120 Ca 0.00 0.04 0.02 0.00 0.47 0.00 0.00 55.06 55.60 1rzw s HIS 120 Cb 0.00 0.52 0.07 0.00 -0.13 0.00 0.00 32.58 33.04 1rzw s HIS 120 CO 0.00 -0.19 0.68 0.72 -2.47 0.00 0.00 174.74 173.49 1rzw n HIS 121 N -0.16 -0.36 -0.82 3.88 8.25 -1.26 -4.92 115.22 119.83 1rzw n HIS 121 Ca -0.01 -0.30 0.00 0.00 -0.26 0.00 0.00 57.72 57.15 1rzw n HIS 121 Cb 0.59 0.73 0.00 0.00 1.12 0.00 0.00 29.99 32.43 1rzw n HIS 121 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1rzw n HIS 122 N -0.27 0.00 1.74 4.41 1.44 -1.26 -5.36 115.22 115.92 1rzw n HIS 122 Ca -0.03 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.82 1rzw n HIS 122 Cb 0.57 -1.00 0.82 0.00 0.12 0.00 0.00 29.99 30.51 1rzw n HIS 122 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25