#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 3.55 -3.96 3.17 3.00 -1.26 -2.35 117.38 119.53 1zug n GLN 2 Ca 0.00 -3.19 -0.09 0.00 -0.01 0.00 0.00 57.00 53.70 1zug n GLN 2 Cb 0.00 -2.97 -0.11 0.00 0.00 0.00 0.00 30.24 27.16 1zug n GLN 2 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.06 176.98 1zug s THR 3 N 1.02 0.11 0.07 5.09 -1.32 -1.26 -4.92 115.64 114.43 1zug s THR 3 Ca 0.45 -0.87 -0.09 0.00 -1.21 0.00 0.00 61.69 59.97 1zug s THR 3 Cb 0.12 -0.29 0.03 0.00 -1.51 0.00 0.00 72.50 70.85 1zug s THR 3 CO -0.04 -0.48 0.57 0.18 -2.21 0.00 0.00 174.62 172.64 1zug n LEU 4 N 1.57 -0.32 0.29 9.08 4.32 -1.26 -0.95 117.00 129.73 1zug n LEU 4 Ca -0.24 0.65 -0.11 0.00 -0.02 0.00 0.00 56.01 56.28 1zug n LEU 4 Cb 0.55 -0.11 -0.05 0.00 -1.62 0.00 0.00 43.42 42.18 1zug n LEU 4 CO 0.20 -0.55 0.44 -1.28 -1.22 0.00 0.00 177.39 174.99 1zug h SER 5 N 0.00 -0.63 0.13 -1.43 0.87 -1.85 -0.78 113.55 109.86 1zug h SER 5 Ca 0.09 0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.69 1zug h SER 5 Cb 0.18 0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.28 1zug h SER 5 CO -0.35 -0.40 -0.24 -0.33 -0.53 0.00 0.00 176.83 174.98 1zug h GLU 6 N -0.85 -0.43 -0.54 2.24 5.08 -1.60 -0.58 114.58 117.90 1zug h GLU 6 Ca -0.08 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1zug h GLU 6 Cb 0.57 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.89 1zug h GLU 6 CO 0.13 -0.29 0.34 -0.09 -1.00 0.00 0.00 179.01 178.10 1zug h ARG 7 N -0.45 0.72 0.14 2.33 2.43 -0.65 -2.30 114.38 116.60 1zug h ARG 7 Ca 0.02 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1zug h ARG 7 Cb 0.46 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 1zug h ARG 7 CO -0.12 0.50 -0.07 1.25 -1.51 0.00 0.00 179.97 180.02 1zug h LEU 8 N 0.73 -0.16 -1.19 3.80 5.85 -0.92 -3.21 115.31 120.22 1zug h LEU 8 Ca 0.20 -0.31 0.02 0.00 0.84 0.00 0.00 57.88 58.62 1zug h LEU 8 Cb -0.05 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 1zug h LEU 8 CO -0.04 0.25 0.55 0.07 -0.34 0.00 0.00 178.44 178.93 1zug h LYS 9 N -0.60 1.07 -0.05 1.25 2.10 -1.02 -2.22 116.57 117.10 1zug h LYS 9 Ca -0.02 -0.06 -0.10 0.00 -2.00 0.00 0.00 60.65 58.47 1zug h LYS 9 Cb 0.46 -0.24 -0.01 0.00 -0.90 0.00 0.00 32.23 31.53 1zug h LYS 9 CO 0.03 0.71 -0.43 1.57 -2.00 0.00 0.00 179.45 179.33 1zug h LYS 10 N 1.10 0.11 -0.26 0.07 2.10 -1.52 -2.85 116.57 115.32 1zug h LYS 10 Ca 0.31 -0.05 -0.09 0.00 -2.00 0.00 0.00 60.65 58.83 1zug h LYS 10 Cb -0.08 -0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.24 1zug h LYS 10 CO -0.08 0.53 -0.17 -0.09 -2.00 0.00 0.00 179.45 177.64 1zug h ARG 11 N 0.10 0.57 -0.89 0.07 9.65 -1.41 -1.81 114.38 120.65 1zug h ARG 11 Ca 0.01 -0.27 0.15 0.00 -1.10 0.00 0.00 59.98 58.77 1zug h ARG 11 Cb 0.80 -0.01 -0.10 0.00 -1.39 0.00 0.00 29.97 29.28 1zug h ARG 11 CO 0.06 0.85 0.49 -0.09 2.80 0.00 0.00 179.97 184.08 1zug h ARG 12 N 0.29 0.66 -0.38 0.20 2.43 -1.31 -0.68 114.38 115.59 1zug h ARG 12 Ca 0.05 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.14 1zug h ARG 12 Cb 0.70 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1zug h ARG 12 CO 0.05 0.44 0.06 0.82 -1.51 0.00 0.00 179.97 179.82 1zug h ILE 13 N 0.68 1.24 -0.73 1.20 2.04 -1.36 -0.86 117.51 119.73 1zug h ILE 13 Ca 0.49 -0.85 0.04 0.00 1.00 0.00 0.00 64.86 65.54 1zug h ILE 13 Cb 0.70 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.80 1zug h ILE 13 CO -0.36 0.29 0.48 0.00 0.00 0.00 0.00 178.15 178.56 1zug h ALA 14 N 0.91 1.61 -0.08 1.87 0.00 -0.25 0.30 119.26 123.63 1zug h ALA 14 Ca 0.11 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1zug h ALA 14 Cb 0.36 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1zug h ALA 14 CO 0.01 0.31 0.00 1.28 0.00 0.00 0.00 179.25 180.85 1zug n LEU 15 N -4.46 0.90 -2.35 0.00 4.77 -0.87 -4.94 117.00 110.06 1zug n LEU 15 Ca 0.10 -0.36 -0.20 0.00 -0.03 0.00 0.00 56.01 55.51 1zug n LEU 15 Cb 0.15 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.18 1zug n LEU 15 CO 0.34 0.18 -0.25 0.29 -1.33 0.00 0.00 177.39 176.62 1zug n LYS 16 N -0.21 -1.72 -3.87 3.23 4.01 0.09 -5.01 118.16 114.70 1zug n LYS 16 Ca 0.16 0.99 -0.33 0.00 -0.51 0.00 0.00 58.31 58.62 1zug n LYS 16 Cb 0.22 -5.63 -0.05 0.00 -0.51 0.00 0.00 35.03 29.06 1zug n LYS 16 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 1zug s MET 17 N -4.96 3.48 0.28 1.97 -1.94 -0.34 -5.00 119.30 112.79 1zug s MET 17 Ca 0.00 -0.28 0.02 0.00 -1.71 0.00 0.00 55.69 53.72 1zug s MET 17 Cb 0.00 -3.07 -0.03 0.00 2.01 0.00 0.00 34.83 33.74 1zug s MET 17 CO 0.00 0.65 0.44 0.95 -0.01 0.00 0.00 175.02 177.05 1zug s THR 18 N -1.37 5.19 0.32 2.05 -4.23 -1.26 -4.31 115.64 112.04 1zug s THR 18 Ca 0.29 -0.70 0.01 0.00 -1.18 0.00 0.00 61.69 60.11 1zug s THR 18 Cb -0.13 -3.85 0.27 0.00 1.34 0.00 0.00 72.50 70.13 1zug s THR 18 CO 0.20 -0.40 1.98 1.56 -0.54 0.00 0.00 174.62 177.41 1zug h GLN 19 N 1.10 0.95 -0.74 3.99 4.20 -1.97 0.34 115.11 122.98 1zug h GLN 19 Ca -0.51 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.14 1zug h GLN 19 Cb 1.22 -0.22 -0.04 0.00 0.30 0.00 0.00 27.48 28.75 1zug h GLN 19 CO 0.62 0.63 0.43 1.79 -0.67 0.00 0.00 178.83 181.63 1zug h THR 20 N 0.98 1.22 0.01 -0.54 1.35 -1.96 0.37 112.91 114.34 1zug h THR 20 Ca 0.29 -0.51 0.02 0.00 -0.55 0.00 0.00 66.41 65.67 1zug h THR 20 Cb -0.05 0.20 -0.03 0.00 -1.73 0.00 0.00 68.15 66.54 1zug h THR 20 CO -0.07 0.23 -0.17 -0.33 -0.25 0.00 0.00 175.52 174.94 1zug h GLU 21 N 1.02 -0.27 -0.59 4.72 5.08 -1.86 -1.92 114.58 120.77 1zug h GLU 21 Ca 0.27 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.62 1zug h GLU 21 Cb -0.01 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 1zug h GLU 21 CO -0.05 -0.18 0.27 1.25 -1.00 0.00 0.00 179.01 179.30 1zug h LEU 22 N -0.28 0.79 -0.08 1.33 5.85 -0.56 -1.45 115.31 120.92 1zug h LEU 22 Ca 0.05 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.67 1zug h LEU 22 Cb 0.34 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 1zug h LEU 22 CO -0.15 0.72 -0.28 0.00 -0.34 0.00 0.00 178.44 178.39 1zug h ALA 23 N 1.11 -0.33 -0.04 1.25 0.00 -0.12 0.14 119.26 121.26 1zug h ALA 23 Ca 0.20 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.15 1zug h ALA 23 Cb 0.15 0.52 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1zug h ALA 23 CO -0.02 -0.76 -0.14 1.15 0.00 0.00 0.00 179.25 179.48 1zug h THR 24 N -0.38 0.65 -0.19 0.00 2.02 -0.87 -0.68 112.91 113.46 1zug h THR 24 Ca 0.08 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.25 1zug h THR 24 Cb 0.50 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 1zug h THR 24 CO -0.29 0.00 0.06 0.11 0.37 0.00 0.00 175.52 175.76 1zug h LYS 25 N -0.21 0.29 0.00 6.66 1.57 -1.10 -3.04 116.57 120.74 1zug h LYS 25 Ca 0.06 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1zug h LYS 25 Cb 0.30 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 1zug h LYS 25 CO -0.16 0.40 -0.09 0.00 -0.57 0.00 0.00 179.45 179.03 1zug h ALA 26 N 0.87 1.21 -0.23 3.86 0.00 -0.59 -3.46 119.26 120.92 1zug h ALA 26 Ca 0.06 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1zug h ALA 26 Cb 0.24 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1zug h ALA 26 CO -0.00 0.11 -0.05 0.41 0.00 0.00 0.00 179.25 179.72 1zug n GLY 27 N -0.64 0.34 0.00 0.00 0.00 -0.40 -4.67 105.19 99.83 1zug n GLY 27 Ca -0.02 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1zug n GLY 27 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1zug n VAL 28 N -3.76 0.00 -3.98 1.61 0.24 -0.43 -5.03 118.33 106.98 1zug n VAL 28 Ca -0.02 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 61.99 1zug n VAL 28 Cb 0.41 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.74 1zug n VAL 28 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1zug s LYS 29 N -1.28 3.22 0.10 7.34 -0.14 -1.26 -4.15 119.74 123.57 1zug s LYS 29 Ca 0.00 -0.60 -0.19 0.00 -1.36 0.00 0.00 55.97 53.81 1zug s LYS 29 Cb 0.00 -2.89 -0.08 0.00 -1.68 0.00 0.00 37.83 33.19 1zug s LYS 29 CO 0.00 0.56 1.65 0.37 -0.76 0.00 0.00 175.35 177.17 1zug h GLN 30 N 2.81 0.32 -0.99 1.68 -0.00 -1.92 -2.36 115.11 114.66 1zug h GLN 30 Ca -0.47 -0.05 0.18 0.00 -0.00 0.00 0.00 58.65 58.31 1zug h GLN 30 Cb 1.17 -0.05 -0.10 0.00 0.00 0.00 0.00 27.48 28.50 1zug h GLN 30 CO 0.70 0.36 0.61 1.96 0.00 0.00 0.00 178.83 182.47 1zug h GLN 31 N 0.21 0.73 -0.14 1.69 7.50 -1.96 -1.72 115.11 121.42 1zug h GLN 31 Ca 0.07 -0.04 -0.00 0.00 0.50 0.00 0.00 58.65 59.18 1zug h GLN 31 Cb 0.16 -0.17 -0.01 0.00 0.05 0.00 0.00 27.48 27.51 1zug h GLN 31 CO -0.01 0.48 0.09 0.77 -1.50 0.00 0.00 178.83 178.67 1zug h SER 32 N 0.75 0.17 -0.30 1.46 0.02 -1.84 -1.72 113.55 112.09 1zug h SER 32 Ca 0.55 -0.04 -0.09 0.00 -0.84 0.00 0.00 61.79 61.37 1zug h SER 32 Cb 0.87 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.35 1zug h SER 32 CO -0.33 0.16 -0.12 0.40 -1.14 0.00 0.00 176.83 175.80 1zug h ILE 33 N 0.17 1.26 -0.82 3.27 2.04 -1.26 -2.59 117.51 119.57 1zug h ILE 33 Ca 0.05 -1.16 0.06 0.00 1.00 0.00 0.00 64.86 64.82 1zug h ILE 33 Cb 0.02 1.07 -0.05 0.00 -0.74 0.00 0.00 36.82 37.12 1zug h ILE 33 CO -0.01 0.39 0.54 1.56 0.00 0.00 0.00 178.15 180.63 1zug h GLN 34 N 0.66 0.87 -0.07 2.37 4.20 -0.92 -2.05 115.11 120.17 1zug h GLN 34 Ca 0.11 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 58.79 1zug h GLN 34 Cb 0.59 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 28.17 1zug h GLN 34 CO 0.04 0.58 0.11 -0.07 -0.67 0.00 0.00 178.83 178.82 1zug h LEU 35 N 0.90 0.00 0.00 1.46 -0.00 -0.90 0.49 115.31 117.26 1zug h LEU 35 Ca 0.35 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 58.21 1zug h LEU 35 Cb 0.23 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.88 1zug h LEU 35 CO -0.13 0.00 -0.18 0.40 -0.00 0.00 0.00 178.44 178.54 1zug h ILE 36 N 0.00 0.73 -0.88 1.22 1.08 -1.46 0.41 117.51 118.61 1zug h ILE 36 Ca 0.03 -1.60 0.22 0.00 -0.39 0.00 0.00 64.86 63.13 1zug h ILE 36 Cb 0.25 1.43 -0.13 0.00 -3.07 0.00 0.00 36.82 35.30 1zug h ILE 36 CO -0.00 0.25 0.34 -0.08 -0.69 0.00 0.00 178.15 177.97 1zug h GLU 37 N -1.00 0.33 0.00 2.37 4.81 -0.84 0.17 114.58 120.42 1zug h GLU 37 Ca -0.03 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1zug h GLU 37 Cb 0.54 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1zug h GLU 37 CO -0.02 0.22 0.00 0.00 -0.73 0.00 0.00 179.01 178.48 1zug n ALA 38 N -2.56 1.66 -2.82 2.92 0.00 0.16 -4.70 120.51 115.18 1zug n ALA 38 Ca 0.21 -0.04 -0.09 0.00 0.00 0.00 0.00 53.44 53.52 1zug n ALA 38 Cb 0.65 -1.25 0.04 0.00 0.00 0.00 0.00 19.45 18.90 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 -0.01 0.17 0.95 0.00 0.00 0.59 -4.98 105.19 101.92 1zug n GLY 39 Ca 0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.01 0.73 -2.68 1.61 0.31 -0.79 -4.81 118.33 109.70 1zug n VAL 40 Ca -0.07 0.19 -0.43 0.00 -0.01 0.00 0.00 64.34 64.03 1zug n VAL 40 Cb 0.55 -1.60 -0.01 0.00 -0.91 0.00 0.00 33.84 31.88 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 -2.06 4.30 -1.28 2.52 2.01 0.07 -4.79 115.64 116.41 1zug s THR 41 Ca -0.03 -1.76 0.17 0.00 0.31 0.00 0.00 61.69 60.39 1zug s THR 41 Cb 0.01 -5.07 0.25 0.00 0.01 0.00 0.00 72.50 67.69 1zug s THR 41 CO 0.04 -1.88 1.53 2.29 -0.69 0.00 0.00 174.62 175.91 1zug n LYS 42 N 7.82 0.16 -3.78 4.92 2.85 -1.26 -4.23 118.16 124.64 1zug n LYS 42 Ca 0.41 0.15 -0.29 0.00 -1.05 0.00 0.00 58.31 57.53 1zug n LYS 42 Cb 0.47 -1.50 -0.13 0.00 -0.65 0.00 0.00 35.03 33.22 1zug n LYS 42 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 177.40 177.85 1zug s ARG 43 N -2.72 1.68 -0.46 -1.58 6.06 -1.26 -5.01 118.95 115.65 1zug s ARG 43 Ca 0.14 -2.47 -0.25 0.00 -2.50 0.00 0.00 55.73 50.64 1zug s ARG 43 Cb 0.12 -2.73 0.03 0.00 0.06 0.00 0.00 34.95 32.43 1zug s ARG 43 CO 0.28 -1.20 0.92 -1.25 -2.50 0.00 0.00 175.30 171.56 1zug s PRO 44 N -0.25 3.53 0.18 5.12 0.04 -1.26 -4.94 135.00 137.42 1zug s PRO 44 Ca 0.21 0.16 -0.12 0.00 0.04 0.00 0.00 61.00 61.28 1zug s PRO 44 Cb -0.17 -3.93 0.08 0.00 0.04 0.00 0.00 34.50 30.52 1zug s PRO 44 CO -0.06 -1.22 1.76 0.00 0.04 0.00 0.00 177.00 177.52 1zug h ARG 45 N 9.08 0.87 -0.17 4.56 -0.00 -1.98 -2.17 114.38 124.57 1zug h ARG 45 Ca -0.24 -0.13 0.00 0.00 -0.50 0.00 0.00 59.98 59.11 1zug h ARG 45 Cb 1.08 -0.15 0.00 0.00 0.00 0.00 0.00 29.97 30.89 1zug h ARG 45 CO 1.03 0.71 0.00 1.97 0.00 0.00 0.00 179.97 183.67 1zug n PHE 46 N -4.51 0.00 -0.18 3.04 1.16 -1.26 -4.19 117.46 111.52 1zug n PHE 46 Ca 0.04 0.00 0.13 0.00 -1.87 0.00 0.00 57.45 55.75 1zug n PHE 46 Cb 0.13 -0.02 0.46 0.00 -1.61 0.00 0.00 39.48 38.44 1zug n PHE 46 CO 0.00 0.00 0.00 1.37 -1.87 0.00 0.00 176.76 176.26 1zug h LEU 47 N 0.15 0.47 0.39 5.98 -0.00 -1.76 -1.95 115.31 118.60 1zug h LEU 47 Ca 0.00 0.02 -0.01 0.00 -0.00 0.00 0.00 57.88 57.89 1zug h LEU 47 Cb 0.08 -0.07 -0.02 0.00 -0.00 0.00 0.00 40.66 40.66 1zug h LEU 47 CO 0.00 0.26 -0.38 0.15 -0.00 0.00 0.00 178.44 178.47 1zug h PHE 48 N 0.51 -1.04 -0.58 0.17 3.57 -1.85 0.16 116.94 117.88 1zug h PHE 48 Ca 0.37 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.96 1zug h PHE 48 Cb 0.71 0.40 -0.11 0.00 2.79 0.00 0.00 35.95 39.74 1zug h PHE 48 CO -0.00 -0.50 -0.42 0.93 -2.23 0.00 0.00 178.31 176.09 1zug h GLU 49 N -0.76 -0.21 0.60 1.11 3.07 -1.67 0.24 114.58 116.96 1zug h GLU 49 Ca -0.05 0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 58.80 1zug h GLU 49 Cb 0.66 0.05 0.01 0.00 -0.84 0.00 0.00 28.75 28.62 1zug h GLU 49 CO -0.04 -0.14 -0.29 0.82 -1.40 0.00 0.00 179.01 177.97 1zug h ILE 50 N -0.21 0.38 -0.51 3.13 2.04 -1.32 -1.16 117.51 119.84 1zug h ILE 50 Ca 0.19 -0.15 0.02 0.00 1.00 0.00 0.00 64.86 65.91 1zug h ILE 50 Cb 0.56 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 1zug h ILE 50 CO -0.69 0.02 0.32 0.00 0.00 0.00 0.00 178.15 177.81 1zug h ALA 51 N -0.56 0.66 -0.42 1.87 0.00 -0.22 0.88 119.26 121.46 1zug h ALA 51 Ca -0.08 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1zug h ALA 51 Cb 0.65 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1zug h ALA 51 CO 0.13 0.05 0.10 0.52 0.00 0.00 0.00 179.25 180.05 1zug h MET 52 N 0.65 0.68 -0.89 0.00 2.86 -0.91 0.50 114.93 117.81 1zug h MET 52 Ca 0.20 -0.17 0.08 0.00 -2.06 0.00 0.00 59.70 57.75 1zug h MET 52 Cb -0.02 -0.09 -0.07 0.00 0.06 0.00 0.00 31.60 31.48 1zug h MET 52 CO -0.07 0.69 0.55 0.00 1.06 0.00 0.00 176.91 179.14 1zug h ALA 53 N 0.95 1.25 -0.35 6.32 0.00 -0.85 -1.77 119.26 124.82 1zug h ALA 53 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1zug h ALA 53 Cb 0.33 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1zug h ALA 53 CO 0.00 0.25 0.00 -0.11 0.00 0.00 0.00 179.25 179.39 1zug n LEU 54 N -4.63 3.62 -2.96 0.00 7.94 0.27 -4.91 117.00 116.32 1zug n LEU 54 Ca 0.14 -1.83 -0.20 0.00 -1.11 0.00 0.00 56.01 53.01 1zug n LEU 54 Cb 0.22 -0.57 0.00 0.00 0.53 0.00 0.00 43.42 43.60 1zug n LEU 54 CO 0.30 0.48 -0.08 -3.20 -1.11 0.00 0.00 177.39 173.78 1zug n ASN 55 N 0.41 -4.44 -4.52 1.96 2.85 -0.61 -4.98 115.26 105.92 1zug n ASN 55 Ca 0.16 -0.17 -0.26 0.00 -0.11 0.00 0.00 54.58 54.20 1zug n ASN 55 Cb 0.76 -3.67 -0.10 0.00 1.24 0.00 0.00 39.78 38.00 1zug n ASN 55 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1zug s ASP 57 N -3.64 7.53 0.15 0.00 -1.08 -1.17 -3.16 116.67 115.31 1zug s ASP 57 Ca 0.30 1.81 -0.20 0.00 -0.52 0.00 0.00 52.55 53.95 1zug s ASP 57 Cb 0.08 -2.57 0.05 0.00 -1.46 0.00 0.00 42.92 39.02 1zug s ASP 57 CO 0.15 0.13 1.66 -0.65 0.52 0.00 0.00 175.17 176.97 1zug h PRO 58 N 4.54 -0.10 -0.65 4.34 0.11 -1.88 -2.59 132.00 135.78 1zug h PRO 58 Ca -0.45 0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.69 1zug h PRO 58 Cb 1.20 0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.30 1zug h PRO 58 CO 0.68 -0.07 0.40 0.28 -0.21 0.00 0.00 178.00 179.09 1zug h VAL 59 N -0.10 1.09 -0.99 3.15 2.07 -1.93 -2.23 116.25 117.31 1zug h VAL 59 Ca 0.16 -0.27 0.20 0.00 0.82 0.00 0.00 66.70 67.60 1zug h VAL 59 Cb 0.34 0.23 -0.10 0.00 -1.52 0.00 0.00 31.29 30.24 1zug h VAL 59 CO -0.37 0.14 0.62 -0.25 0.02 0.00 0.00 177.57 177.73 1zug h TRP 60 N 0.79 0.94 -0.92 1.57 7.01 -1.43 0.67 115.95 124.58 1zug h TRP 60 Ca 0.26 0.03 0.22 0.00 2.11 0.00 0.00 58.89 61.51 1zug h TRP 60 Cb 0.01 -0.28 -0.12 0.00 -2.10 0.00 0.00 29.16 26.67 1zug h TRP 60 CO -0.05 0.20 0.45 1.25 -2.79 0.00 0.00 178.44 177.51 1zug h LEU 61 N 0.67 0.44 0.00 0.65 7.12 -1.23 0.15 115.31 123.10 1zug h LEU 61 Ca 0.56 0.14 -0.09 0.00 0.13 0.00 0.00 57.88 58.63 1zug h LEU 61 Cb 1.00 0.10 -0.02 0.00 -0.53 0.00 0.00 40.66 41.22 1zug h LEU 61 CO -0.34 0.04 -1.99 0.00 -0.13 0.00 0.00 178.44 176.03 1zug n GLN 62 N -4.99 0.71 0.00 1.25 6.02 -0.40 -4.26 117.38 115.71 1zug n GLN 62 Ca 0.23 -0.14 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 1zug n GLN 62 Cb 0.66 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.46 1zug n GLN 62 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1zug n TYR 63 N -2.31 0.00 -0.21 1.08 4.01 0.09 -4.73 117.16 115.09 1zug n TYR 63 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 1zug n TYR 63 Cb 0.66 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.69 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 1.94 1.40 3.55 2.72 0.00 0.01 -4.94 105.19 109.86 1zug n GLY 64 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.80 4.34 -0.01 2.61 -4.23 -1.26 -4.64 115.64 109.65 1zug s THR 65 Ca 0.00 0.55 -0.01 0.00 -1.18 0.00 0.00 61.69 61.05 1zug s THR 65 Cb 0.00 -4.55 0.00 0.00 1.34 0.00 0.00 72.50 69.29 1zug s THR 65 CO 0.00 -1.08 0.01 1.17 -0.54 0.00 0.00 174.62 174.18 1zug n LYS 66 N 7.58 -0.27 0.00 3.99 3.00 -1.26 -3.19 118.16 128.00 1zug n LYS 66 Ca 0.04 0.67 0.00 0.00 -0.00 0.00 0.00 58.31 59.03 1zug n LYS 66 Cb 0.48 -1.09 0.00 0.00 0.00 0.00 0.00 35.03 34.42 1zug n LYS 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1zug n ARG 67 N 0.10 0.00 -2.31 1.64 3.00 -1.26 -3.04 116.66 114.79 1zug n ARG 67 Ca -0.02 0.00 -0.42 0.00 -0.01 0.00 0.00 57.85 57.40 1zug n ARG 67 Cb 0.03 -0.07 -0.03 0.00 0.00 0.00 0.00 32.46 32.40 1zug n ARG 67 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1zug s GLY 68 N 0.00 0.87 -0.01 -0.13 0.00 -1.26 -3.40 107.32 103.38 1zug s GLY 68 Ca 0.00 -0.43 -0.25 0.00 0.00 0.00 0.00 44.72 44.03 1zug s GLY 68 CO 0.00 2.90 1.29 1.70 0.00 0.00 0.00 173.10 178.99 1zug h LYS 69 N 11.52 0.02 -3.24 2.90 3.64 -1.21 -3.33 116.57 126.88 1zug h LYS 69 Ca -0.28 -0.01 -0.69 0.00 -1.27 0.00 0.00 60.65 58.41 1zug h LYS 69 Cb 1.11 0.00 -0.37 0.00 -0.41 0.00 0.00 32.23 32.56 1zug h LYS 69 CO 1.14 0.48 -0.18 0.00 -2.27 0.00 0.00 179.45 178.62 1zug n ALA 70 N -2.34 3.75 0.38 5.00 0.00 -1.26 -5.09 120.51 120.96 1zug n ALA 70 Ca -0.08 -4.59 0.05 0.00 0.00 0.00 0.00 53.44 48.81 1zug n ALA 70 Cb 0.25 -1.56 0.04 0.00 0.00 0.00 0.00 19.45 18.17 1zug n ALA 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50