#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zug n GLN 2 N 0.00 2.39 -3.92 2.12 7.27 -1.26 -3.57 117.38 120.42 1zug n GLN 2 Ca 0.00 -2.61 -0.10 0.00 0.07 0.00 0.00 57.00 54.36 1zug n GLN 2 Cb 0.00 -3.37 -0.09 0.00 2.41 0.00 0.00 30.24 29.19 1zug n GLN 2 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 1zug s THR 3 N 5.59 0.12 0.27 1.69 -4.23 -1.26 -4.94 115.64 112.88 1zug s THR 3 Ca 0.56 -0.99 -0.01 0.00 -1.18 0.00 0.00 61.69 60.07 1zug s THR 3 Cb 0.08 -0.76 0.27 0.00 1.34 0.00 0.00 72.50 73.43 1zug s THR 3 CO 0.06 -0.55 1.68 -0.07 -0.54 0.00 0.00 174.62 175.20 1zug h LEU 4 N 3.84 0.09 0.32 4.79 4.07 -1.83 -1.05 115.31 125.55 1zug h LEU 4 Ca -0.32 0.16 -0.02 0.00 0.08 0.00 0.00 57.88 57.78 1zug h LEU 4 Cb 1.19 0.20 0.00 0.00 1.08 0.00 0.00 40.66 43.13 1zug h LEU 4 CO 0.48 -0.05 -0.15 0.77 -1.08 0.00 0.00 178.44 178.40 1zug h SER 5 N 0.29 -0.37 -0.06 -0.43 4.64 -1.88 -2.71 113.55 113.04 1zug h SER 5 Ca 0.48 -0.15 -0.01 0.00 -0.47 0.00 0.00 61.79 61.65 1zug h SER 5 Cb 0.89 0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 63.07 1zug h SER 5 CO -0.55 0.10 0.01 -0.33 -0.87 0.00 0.00 176.83 175.18 1zug h GLU 6 N -0.99 0.09 -0.39 4.77 5.08 -1.68 0.11 114.58 121.57 1zug h GLU 6 Ca -0.04 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1zug h GLU 6 Cb 0.49 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 1zug h GLU 6 CO 0.07 0.32 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.30 1zug h ARG 7 N -0.15 0.69 -0.39 2.33 2.43 -1.26 -2.53 114.38 115.51 1zug h ARG 7 Ca 0.02 -0.23 -0.10 0.00 -0.81 0.00 0.00 59.98 58.86 1zug h ARG 7 Cb 0.27 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1zug h ARG 7 CO 0.00 0.80 -0.15 1.25 -1.51 0.00 0.00 179.97 180.36 1zug h LEU 8 N 0.52 0.80 -0.55 3.80 5.85 -1.27 -2.80 115.31 121.65 1zug h LEU 8 Ca 0.11 -0.39 0.10 0.00 0.84 0.00 0.00 57.88 58.54 1zug h LEU 8 Cb 0.49 -0.22 -0.11 0.00 0.37 0.00 0.00 40.66 41.19 1zug h LEU 8 CO 0.02 1.01 -0.28 0.50 -0.34 0.00 0.00 178.44 179.35 1zug h LYS 9 N 0.59 -0.14 -0.48 1.25 3.64 -0.90 -1.34 116.57 119.18 1zug h LYS 9 Ca 0.09 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1zug h LYS 9 Cb 0.69 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.52 1zug h LYS 9 CO 0.05 -0.09 0.27 -0.22 -2.27 0.00 0.00 179.45 177.18 1zug h LYS 10 N -0.14 0.67 -0.66 1.90 3.64 -1.38 -2.45 116.57 118.15 1zug h LYS 10 Ca 0.24 -0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 1zug h LYS 10 Cb 0.53 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.18 1zug h LYS 10 CO -0.63 0.52 0.29 -0.09 -2.27 0.00 0.00 179.45 177.27 1zug h ARG 11 N 0.64 0.96 -0.95 1.90 9.65 -1.19 -1.32 114.38 124.06 1zug h ARG 11 Ca 0.17 -0.14 0.04 0.00 -1.10 0.00 0.00 59.98 58.95 1zug h ARG 11 Cb 0.04 -0.17 -0.06 0.00 -1.39 0.00 0.00 29.97 28.40 1zug h ARG 11 CO -0.03 0.76 0.62 -0.09 2.80 0.00 0.00 179.97 184.04 1zug h ARG 12 N 0.95 1.14 -0.32 0.20 2.43 -0.96 -2.26 114.38 115.56 1zug h ARG 12 Ca 0.23 -0.07 -0.07 0.00 -0.81 0.00 0.00 59.98 59.26 1zug h ARG 12 Cb 0.15 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 1zug h ARG 12 CO -0.02 0.75 -0.09 0.82 -1.51 0.00 0.00 179.97 179.92 1zug h ILE 13 N 1.17 1.28 -1.00 1.20 2.04 -0.92 -0.77 117.51 120.50 1zug h ILE 13 Ca 0.38 -1.15 0.15 0.00 1.00 0.00 0.00 64.86 65.25 1zug h ILE 13 Cb 0.05 1.37 -0.09 0.00 -0.74 0.00 0.00 36.82 37.40 1zug h ILE 13 CO -0.12 0.37 0.62 0.00 0.00 0.00 0.00 178.15 179.02 1zug h ALA 14 N 0.79 1.58 -0.01 1.87 0.00 -0.68 -0.24 119.26 122.58 1zug h ALA 14 Ca 0.08 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1zug h ALA 14 Cb 0.59 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1zug h ALA 14 CO 0.03 0.11 -0.06 1.28 0.00 0.00 0.00 179.25 180.61 1zug n LEU 15 N -4.68 1.04 -3.76 0.00 4.32 -1.06 -4.95 117.00 107.91 1zug n LEU 15 Ca 0.21 -0.31 -0.27 0.00 -0.02 0.00 0.00 56.01 55.62 1zug n LEU 15 Cb 0.45 -0.05 0.05 0.00 -1.62 0.00 0.00 43.42 42.26 1zug n LEU 15 CO 0.25 0.18 0.18 0.29 -1.22 0.00 0.00 177.39 177.06 1zug n LYS 16 N -0.30 -6.71 -4.22 3.23 4.76 -0.10 -5.00 118.16 109.81 1zug n LYS 16 Ca 0.18 0.71 -0.34 0.00 -2.87 0.00 0.00 58.31 55.99 1zug n LYS 16 Cb 0.30 -5.69 -0.08 0.00 -1.84 0.00 0.00 35.03 27.73 1zug n LYS 16 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 1zug s MET 17 N -6.47 2.99 0.35 1.97 -1.94 -0.33 -5.02 119.30 110.86 1zug s MET 17 Ca 0.63 -0.47 -0.04 0.00 -1.71 0.00 0.00 55.69 54.10 1zug s MET 17 Cb -0.30 -2.81 -0.04 0.00 2.01 0.00 0.00 34.83 33.69 1zug s MET 17 CO 0.78 0.67 0.61 0.95 -0.01 0.00 0.00 175.02 178.02 1zug s THR 18 N -1.06 5.01 0.33 2.05 -4.23 -1.26 -4.46 115.64 112.01 1zug s THR 18 Ca 0.18 -0.03 0.03 0.00 -1.18 0.00 0.00 61.69 60.69 1zug s THR 18 Cb -0.12 -3.80 0.28 0.00 1.34 0.00 0.00 72.50 70.21 1zug s THR 18 CO 0.09 -0.51 1.94 1.56 -0.54 0.00 0.00 174.62 177.16 1zug h GLN 19 N 1.09 0.89 -0.40 3.99 4.20 -1.98 -0.96 115.11 121.94 1zug h GLN 19 Ca -0.48 -0.05 0.06 0.00 0.06 0.00 0.00 58.65 58.24 1zug h GLN 19 Cb 1.20 -0.20 -0.06 0.00 0.30 0.00 0.00 27.48 28.72 1zug h GLN 19 CO 0.64 0.59 0.06 1.15 -0.67 0.00 0.00 178.83 180.60 1zug h THR 20 N 0.92 0.77 -0.40 -0.54 2.02 -1.95 0.41 112.91 114.14 1zug h THR 20 Ca 0.34 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.46 1zug h THR 20 Cb 0.17 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 67.13 1zug h THR 20 CO -0.11 0.03 0.25 -0.33 0.37 0.00 0.00 175.52 175.73 1zug h GLU 21 N 0.19 0.54 -0.25 6.66 5.08 -1.74 -1.30 114.58 123.76 1zug h GLU 21 Ca 0.19 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 1zug h GLU 21 Cb 0.24 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1zug h GLU 21 CO -0.27 0.38 0.10 1.25 -1.00 0.00 0.00 179.01 179.47 1zug h LEU 22 N 0.54 0.34 -0.42 1.33 5.85 -0.78 -1.95 115.31 120.21 1zug h LEU 22 Ca 0.15 -0.16 0.09 0.00 0.84 0.00 0.00 57.88 58.79 1zug h LEU 22 Cb -0.03 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 40.83 1zug h LEU 22 CO -0.03 0.41 -0.17 0.00 -0.34 0.00 0.00 178.44 178.31 1zug h ALA 23 N 0.94 0.17 0.39 1.25 0.00 0.09 0.24 119.26 122.33 1zug h ALA 23 Ca 0.08 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1zug h ALA 23 Cb 0.17 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1zug h ALA 23 CO -0.01 -0.52 -0.40 1.15 0.00 0.00 0.00 179.25 179.47 1zug h THR 24 N -0.08 0.18 -0.44 0.00 2.02 -0.96 -0.15 112.91 113.48 1zug h THR 24 Ca 0.20 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.41 1zug h THR 24 Cb 0.39 0.18 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 1zug h THR 24 CO -0.47 0.00 0.24 0.11 0.37 0.00 0.00 175.52 175.76 1zug h LYS 25 N -0.82 0.46 0.00 6.66 1.57 -0.96 -1.53 116.57 121.95 1zug h LYS 25 Ca -0.03 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1zug h LYS 25 Cb 0.73 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.94 1zug h LYS 25 CO -0.07 0.31 0.00 0.00 -0.57 0.00 0.00 179.45 179.11 1zug n ALA 26 N -2.28 1.53 -3.04 3.86 0.00 0.80 -4.79 120.51 116.60 1zug n ALA 26 Ca 0.02 0.04 -0.19 0.00 0.00 0.00 0.00 53.44 53.31 1zug n ALA 26 Cb 0.09 -1.28 0.04 0.00 0.00 0.00 0.00 19.45 18.30 1zug n ALA 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zug n GLY 27 N -0.29 -0.29 3.14 0.00 0.00 -0.58 -4.70 105.19 102.48 1zug n GLY 27 Ca 0.02 -0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 1zug n GLY 27 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1zug n VAL 28 N -4.37 0.00 -3.08 1.61 3.14 -0.15 -5.04 118.33 110.43 1zug n VAL 28 Ca -0.06 -2.29 -0.30 0.00 -2.96 0.00 0.00 64.34 58.73 1zug n VAL 28 Cb 0.58 0.95 -0.03 0.00 -1.06 0.00 0.00 33.84 34.28 1zug n VAL 28 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1zug s LYS 29 N -3.41 3.73 0.08 1.45 1.02 -1.26 -4.13 119.74 117.22 1zug s LYS 29 Ca 0.27 0.29 -0.18 0.00 0.02 0.00 0.00 55.97 56.37 1zug s LYS 29 Cb 0.01 -2.50 -0.09 0.00 -0.52 0.00 0.00 37.83 34.73 1zug s LYS 29 CO 0.19 0.09 1.49 0.37 -0.92 0.00 0.00 175.35 176.56 1zug h GLN 30 N 1.53 0.47 -0.93 1.68 4.15 -1.91 -2.83 115.11 117.27 1zug h GLN 30 Ca -0.47 -0.17 0.23 0.00 0.77 0.00 0.00 58.65 59.00 1zug h GLN 30 Cb 1.19 -0.03 -0.17 0.00 0.21 0.00 0.00 27.48 28.68 1zug h GLN 30 CO 0.65 0.68 -0.02 1.96 -1.93 0.00 0.00 178.83 180.17 1zug h GLN 31 N 0.23 0.03 -0.55 1.69 7.50 -1.96 0.77 115.11 122.82 1zug h GLN 31 Ca 0.07 -0.00 0.04 0.00 0.50 0.00 0.00 58.65 59.25 1zug h GLN 31 Cb 0.50 -0.01 -0.04 0.00 0.05 0.00 0.00 27.48 27.98 1zug h GLN 31 CO 0.02 0.02 0.31 0.77 -1.50 0.00 0.00 178.83 178.46 1zug h SER 32 N 0.04 0.48 0.56 1.46 0.02 -1.91 -0.05 113.55 114.14 1zug h SER 32 Ca 0.53 0.02 -0.22 0.00 -0.84 0.00 0.00 61.79 61.28 1zug h SER 32 Cb 1.01 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.47 1zug h SER 32 CO -0.87 0.33 -0.96 0.40 -1.14 0.00 0.00 176.83 174.59 1zug h ILE 33 N 0.60 1.49 -0.83 3.27 2.04 -1.14 -3.13 117.51 119.81 1zug h ILE 33 Ca 0.24 -2.70 0.02 0.00 1.00 0.00 0.00 64.86 63.41 1zug h ILE 33 Cb 0.09 2.56 -0.04 0.00 -0.74 0.00 0.00 36.82 38.69 1zug h ILE 33 CO -0.13 0.79 0.55 1.56 0.00 0.00 0.00 178.15 180.91 1zug h GLN 34 N 0.12 1.06 -0.29 2.37 4.20 -0.42 -1.41 115.11 120.75 1zug h GLN 34 Ca -0.06 -0.06 0.05 0.00 0.06 0.00 0.00 58.65 58.64 1zug h GLN 34 Cb 1.61 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 29.14 1zug h GLN 34 CO 0.15 0.70 0.20 -0.07 -0.67 0.00 0.00 178.83 179.14 1zug h LEU 35 N 1.09 0.13 0.15 1.46 3.38 -0.96 0.60 115.31 121.16 1zug h LEU 35 Ca 0.31 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.27 1zug h LEU 35 Cb -0.09 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1zug h LEU 35 CO -0.07 0.09 -0.07 0.40 0.09 0.00 0.00 178.44 178.87 1zug h ILE 36 N 0.15 0.97 -0.54 1.22 1.08 -1.39 -0.62 117.51 118.38 1zug h ILE 36 Ca 0.13 -1.01 0.07 0.00 -0.39 0.00 0.00 64.86 63.66 1zug h ILE 36 Cb 0.33 1.54 -0.03 0.00 -3.07 0.00 0.00 36.82 35.59 1zug h ILE 36 CO -0.02 0.22 0.36 -0.08 -0.69 0.00 0.00 178.15 177.94 1zug h GLU 37 N -0.73 0.42 -0.01 2.37 4.57 -0.61 0.50 114.58 121.08 1zug h GLU 37 Ca -0.02 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 1zug h GLU 37 Cb 0.52 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.01 1zug h GLU 37 CO 0.03 0.28 0.00 0.00 -1.18 0.00 0.00 179.01 178.14 1zug n ALA 38 N -2.51 2.59 -3.26 2.92 0.00 0.20 -4.82 120.51 115.64 1zug n ALA 38 Ca 0.08 -0.13 -0.24 0.00 0.00 0.00 0.00 53.44 53.16 1zug n ALA 38 Cb 0.29 -1.26 0.04 0.00 0.00 0.00 0.00 19.45 18.52 1zug n ALA 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zug n GLY 39 N 0.78 -0.52 0.22 0.00 0.00 0.17 -4.93 105.19 100.91 1zug n GLY 39 Ca 0.13 0.15 -0.08 0.00 0.00 0.00 0.00 46.02 46.22 1zug n GLY 39 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1zug n VAL 40 N -4.53 1.46 -2.19 1.61 0.31 -0.30 -4.80 118.33 109.89 1zug n VAL 40 Ca -0.06 0.17 -0.31 0.00 -0.01 0.00 0.00 64.34 64.13 1zug n VAL 40 Cb 0.59 -2.24 -0.04 0.00 -0.91 0.00 0.00 33.84 31.23 1zug n VAL 40 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1zug s THR 41 N -2.78 3.62 0.23 2.52 2.01 -0.83 -4.83 115.64 115.58 1zug s THR 41 Ca -0.25 -0.71 -0.06 0.00 0.31 0.00 0.00 61.69 60.98 1zug s THR 41 Cb 0.04 -4.44 0.19 0.00 0.01 0.00 0.00 72.50 68.30 1zug s THR 41 CO 0.37 -1.24 1.76 0.11 -0.69 0.00 0.00 174.62 174.93 1zug h LYS 42 N 10.31 0.51 -3.33 4.92 1.57 -1.89 -3.37 116.57 125.30 1zug h LYS 42 Ca 0.18 -0.03 -0.57 0.00 -1.87 0.00 0.00 60.65 58.35 1zug h LYS 42 Cb 0.98 -0.11 -0.40 0.00 0.08 0.00 0.00 32.23 32.77 1zug h LYS 42 CO 1.28 0.34 -0.76 -0.98 -0.57 0.00 0.00 179.45 178.75 1zug s ARG 43 N -6.04 0.62 -0.02 3.15 1.70 -1.26 -5.04 118.95 112.05 1zug s ARG 43 Ca -0.13 -1.01 -0.30 0.00 -0.47 0.00 0.00 55.73 53.83 1zug s ARG 43 Cb 0.19 -1.80 -0.04 0.00 -0.57 0.00 0.00 34.95 32.73 1zug s ARG 43 CO 0.76 -1.01 1.18 -1.25 -1.08 0.00 0.00 175.30 173.90 1zug s PRO 44 N 1.64 4.39 0.24 3.89 0.04 -1.26 -4.95 135.00 139.00 1zug s PRO 44 Ca 0.10 1.68 -0.04 0.00 0.04 0.00 0.00 61.00 62.78 1zug s PRO 44 Cb -0.17 -3.49 0.26 0.00 0.04 0.00 0.00 34.50 31.13 1zug s PRO 44 CO -0.26 -0.36 1.76 -0.09 0.04 0.00 0.00 177.00 178.09 1zug h ARG 45 N 7.22 0.95 -0.13 4.56 1.12 -2.00 -2.65 114.38 123.45 1zug h ARG 45 Ca -0.37 -0.23 0.00 0.00 -1.11 0.00 0.00 59.98 58.27 1zug h ARG 45 Cb 1.18 -0.12 0.00 0.00 -0.01 0.00 0.00 29.97 31.02 1zug h ARG 45 CO 0.85 0.88 0.00 1.97 -3.11 0.00 0.00 179.97 180.56 1zug n PHE 46 N -4.23 0.00 -0.36 2.20 -1.74 -1.26 -3.97 117.46 108.09 1zug n PHE 46 Ca 0.04 0.00 0.05 0.00 -0.56 0.00 0.00 57.45 56.98 1zug n PHE 46 Cb 0.27 -0.01 0.21 0.00 1.52 0.00 0.00 39.48 41.47 1zug n PHE 46 CO 0.00 0.00 0.00 1.37 -0.56 0.00 0.00 176.76 177.57 1zug h LEU 47 N 0.15 0.93 -0.17 5.98 -0.00 -1.86 -1.55 115.31 118.80 1zug h LEU 47 Ca 0.00 0.04 -0.00 0.00 -0.00 0.00 0.00 57.88 57.92 1zug h LEU 47 Cb 0.06 -0.15 -0.01 0.00 -0.00 0.00 0.00 40.66 40.57 1zug h LEU 47 CO 0.00 0.53 0.10 0.15 -0.00 0.00 0.00 178.44 179.22 1zug h PHE 48 N 1.02 0.22 0.14 0.17 3.04 -1.86 -0.57 116.94 119.11 1zug h PHE 48 Ca 0.47 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 62.41 1zug h PHE 48 Cb 0.39 -0.07 0.00 0.00 2.56 0.00 0.00 35.95 38.83 1zug h PHE 48 CO -0.01 0.18 -0.07 0.93 -2.02 0.00 0.00 178.31 177.32 1zug h GLU 49 N 0.20 -0.18 -0.26 1.11 3.07 -1.71 -0.97 114.58 115.84 1zug h GLU 49 Ca 0.06 0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.96 1zug h GLU 49 Cb 0.02 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 27.95 1zug h GLU 49 CO -0.01 0.00 0.10 0.82 -1.40 0.00 0.00 179.01 178.52 1zug h ILE 50 N -0.34 0.96 -0.11 3.13 2.04 -1.18 -0.36 117.51 121.64 1zug h ILE 50 Ca -0.02 -0.08 0.03 0.00 1.00 0.00 0.00 64.86 65.80 1zug h ILE 50 Cb 0.27 0.71 -0.04 0.00 -0.74 0.00 0.00 36.82 37.02 1zug h ILE 50 CO 0.03 0.04 -0.09 0.00 0.00 0.00 0.00 178.15 178.13 1zug h ALA 51 N 1.15 -0.00 -0.30 1.87 0.00 -0.84 0.76 119.26 121.90 1zug h ALA 51 Ca 0.11 0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 1zug h ALA 51 Cb 0.06 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1zug h ALA 51 CO -0.10 -0.55 -0.26 0.52 0.00 0.00 0.00 179.25 178.86 1zug h MET 52 N -0.11 0.59 -0.83 0.00 2.86 -0.98 0.20 114.93 116.66 1zug h MET 52 Ca 0.08 -0.24 -0.02 0.00 -2.06 0.00 0.00 59.70 57.45 1zug h MET 52 Cb 0.22 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 31.82 1zug h MET 52 CO -0.18 0.80 0.43 0.00 1.06 0.00 0.00 176.91 179.01 1zug h ALA 53 N 1.20 1.07 -0.61 6.32 0.00 -0.83 -2.93 119.26 123.48 1zug h ALA 53 Ca 0.07 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1zug h ALA 53 Cb 0.73 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1zug h ALA 53 CO 0.06 0.60 0.00 -0.11 0.00 0.00 0.00 179.25 179.80 1zug n LEU 54 N -4.36 4.09 -4.22 0.00 7.94 0.24 -4.95 117.00 115.74 1zug n LEU 54 Ca 0.08 -2.06 -0.32 0.00 -1.11 0.00 0.00 56.01 52.61 1zug n LEU 54 Cb 0.12 -0.52 -0.06 0.00 0.53 0.00 0.00 43.42 43.49 1zug n LEU 54 CO 0.39 0.79 -0.28 0.59 -1.11 0.00 0.00 177.39 177.76 1zug n ASN 55 N 1.15 -0.55 -2.90 1.96 3.02 -0.04 -4.99 115.26 112.90 1zug n ASN 55 Ca 0.23 -1.15 -0.15 0.00 -0.03 0.00 0.00 54.58 53.48 1zug n ASN 55 Cb 0.73 -2.24 -0.04 0.00 -0.61 0.00 0.00 39.78 37.62 1zug n ASN 55 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1zug s ASP 57 N -2.53 6.48 0.13 0.00 -1.08 -1.26 -4.03 116.67 114.38 1zug s ASP 57 Ca 0.13 0.56 -0.26 0.00 -0.52 0.00 0.00 52.55 52.47 1zug s ASP 57 Cb 0.01 -2.21 -0.04 0.00 -1.46 0.00 0.00 42.92 39.22 1zug s ASP 57 CO 0.09 0.07 1.62 -0.65 0.52 0.00 0.00 175.17 176.82 1zug h PRO 58 N 6.75 -0.41 -0.55 4.34 0.11 -1.90 -2.09 132.00 138.26 1zug h PRO 58 Ca -0.41 0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.73 1zug h PRO 58 Cb 1.17 0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.34 1zug h PRO 58 CO 0.75 -0.27 0.32 0.28 -0.21 0.00 0.00 178.00 178.88 1zug h VAL 59 N -0.42 1.17 -0.20 3.15 2.07 -1.93 -3.08 116.25 117.01 1zug h VAL 59 Ca 0.07 -0.40 0.03 0.00 0.82 0.00 0.00 66.70 67.23 1zug h VAL 59 Cb 0.53 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 1zug h VAL 59 CO -0.28 0.18 -0.01 -0.25 0.02 0.00 0.00 177.57 177.24 1zug h TRP 60 N 0.74 -0.03 0.00 1.57 7.01 -1.50 0.21 115.95 123.95 1zug h TRP 60 Ca 0.20 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.21 1zug h TRP 60 Cb 0.00 0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.10 1zug h TRP 60 CO -0.02 -0.04 0.00 1.47 -2.79 0.00 0.00 178.44 177.06 1zug n LEU 61 N -5.15 0.00 -0.05 0.65 -0.00 -0.86 0.04 117.00 111.64 1zug n LEU 61 Ca -0.02 0.41 -0.06 0.00 -0.00 0.00 0.00 56.01 56.34 1zug n LEU 61 Cb 0.11 -0.41 -0.06 0.00 -0.00 0.00 0.00 43.42 43.06 1zug n LEU 61 CO 0.26 -0.28 -0.81 1.67 -0.00 0.00 0.00 177.39 178.23 1zug n GLN 62 N -1.41 1.30 -0.02 1.47 7.27 -0.78 -4.39 117.38 120.81 1zug n GLN 62 Ca 0.03 0.03 0.03 0.00 0.07 0.00 0.00 57.00 57.16 1zug n GLN 62 Cb 0.10 -1.21 -0.09 0.00 2.41 0.00 0.00 30.24 31.45 1zug n GLN 62 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1zug n TYR 63 N -2.59 0.00 -0.80 3.69 4.01 0.66 -4.67 117.16 117.46 1zug n TYR 63 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 1zug n TYR 63 Cb 0.73 -0.33 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 1zug n TYR 63 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1zug n GLY 64 N 1.97 0.57 3.81 2.72 0.00 0.11 -4.97 105.19 109.39 1zug n GLY 64 Ca -0.06 -0.27 -0.38 0.00 0.00 0.00 0.00 46.02 45.31 1zug n GLY 64 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1zug s THR 65 N -2.00 4.93 0.00 2.61 -4.23 -1.26 -0.85 115.64 114.85 1zug s THR 65 Ca 0.00 1.01 0.00 0.00 -1.18 0.00 0.00 61.69 61.52 1zug s THR 65 Cb 0.00 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 70.04 1zug s THR 65 CO 0.00 0.54 0.00 1.17 -0.54 0.00 0.00 174.62 175.79 1zug n LYS 66 N 2.02 0.00 -2.39 3.99 4.81 0.85 -3.84 118.16 123.60 1zug n LYS 66 Ca -0.12 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 56.90 1zug n LYS 66 Cb 0.52 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.57 1zug n LYS 66 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 1zug n ARG 67 N 0.00 3.21 0.00 1.64 0.63 -1.26 -4.10 116.66 116.78 1zug n ARG 67 Ca 0.00 -3.26 0.00 0.00 -0.92 0.00 0.00 57.85 53.67 1zug n ARG 67 Cb 0.00 -3.25 0.00 0.00 0.45 0.00 0.00 32.46 29.66 1zug n ARG 67 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1zug n GLY 68 N 4.33 0.54 0.00 5.14 0.00 -1.26 -4.92 105.19 109.02 1zug n GLY 68 Ca 0.46 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1zug n GLY 68 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1zug n LYS 69 N 0.00 0.00 -3.11 1.61 3.00 -1.26 -1.64 118.16 116.75 1zug n LYS 69 Ca 0.00 0.03 -0.44 0.00 -0.00 0.00 0.00 58.31 57.90 1zug n LYS 69 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 35.03 34.97 1zug n LYS 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1zug n ALA 70 N -0.57 4.44 0.06 3.14 0.00 -0.03 -5.01 120.51 122.54 1zug n ALA 70 Ca 0.00 -4.58 0.01 0.00 0.00 0.00 0.00 53.44 48.86 1zug n ALA 70 Cb 0.00 -2.60 0.03 0.00 0.00 0.00 0.00 19.45 16.88 1zug n ALA 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50