#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zpw s LYS 3 N 0.00 4.50 0.06 1.61 -2.85 -1.26 -4.22 119.74 117.58 1zpw s LYS 3 Ca 0.00 1.99 -0.02 0.00 -1.00 0.00 0.00 55.97 56.94 1zpw s LYS 3 Cb 0.00 -3.15 -0.04 0.00 -2.06 0.00 0.00 37.83 32.58 1zpw s LYS 3 CO 0.00 -0.00 0.01 1.03 0.10 0.00 0.00 175.35 176.48 1zpw s ARG 4 N -1.35 0.67 0.10 1.78 0.52 -0.08 -4.90 118.95 115.71 1zpw s ARG 4 Ca 0.48 -1.21 -0.30 0.00 -0.52 0.00 0.00 55.73 54.17 1zpw s ARG 4 Cb -0.35 0.23 -0.06 0.00 0.52 0.00 0.00 34.95 35.29 1zpw s ARG 4 CO 0.45 -0.15 1.04 -1.17 0.02 0.00 0.00 175.30 175.49 1zpw s LEU 5 N -2.93 4.46 -0.01 2.53 2.96 -1.26 -1.10 118.68 123.33 1zpw s LEU 5 Ca 0.09 1.89 0.06 0.00 -0.22 0.00 0.00 54.13 55.94 1zpw s LEU 5 Cb 0.08 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 43.16 1zpw s LEU 5 CO -0.09 -0.20 -0.20 -0.31 -1.32 0.00 0.00 176.35 174.24 1zpw s TYR 6 N 0.24 1.77 -0.17 5.38 1.51 0.31 -0.83 117.35 125.56 1zpw s TYR 6 Ca 0.50 -0.34 -0.15 0.00 -1.01 0.00 0.00 57.07 56.07 1zpw s TYR 6 Cb -0.25 -1.12 -0.04 0.00 -0.11 0.00 0.00 41.96 40.43 1zpw s TYR 6 CO 0.31 -0.01 0.35 0.00 -1.11 0.00 0.00 175.55 175.09 1zpw s ALA 7 N -0.52 3.56 -0.26 3.71 0.00 -0.22 -1.27 121.76 126.76 1zpw s ALA 7 Ca 0.08 -0.44 0.01 0.00 0.00 0.00 0.00 51.96 51.61 1zpw s ALA 7 Cb -0.08 -2.50 0.05 0.00 0.00 0.00 0.00 23.12 20.59 1zpw s ALA 7 CO -0.00 -0.03 -0.09 0.08 0.00 0.00 0.00 175.76 175.71 1zpw s VAL 8 N 0.73 2.44 -0.07 0.00 1.01 0.50 -0.69 120.40 124.32 1zpw s VAL 8 Ca 0.19 -1.42 0.04 0.00 0.00 0.00 0.00 61.98 60.78 1zpw s VAL 8 Cb -0.14 -2.36 -0.02 0.00 0.00 0.00 0.00 36.38 33.86 1zpw s VAL 8 CO 0.06 0.05 -0.18 0.00 0.00 0.00 0.00 175.10 175.02 1zpw s ALA 9 N 1.19 2.46 0.06 5.51 0.00 -0.20 -0.97 121.76 129.81 1zpw s ALA 9 Ca -0.05 -0.99 0.03 0.00 0.00 0.00 0.00 51.96 50.95 1zpw s ALA 9 Cb -0.19 -0.90 -0.03 0.00 0.00 0.00 0.00 23.12 22.00 1zpw s ALA 9 CO -0.05 0.44 -0.10 1.52 0.00 0.00 0.00 175.76 177.58 1zpw s TYR 10 N -0.29 0.85 -0.32 0.00 1.13 -0.48 -0.17 117.35 118.07 1zpw s TYR 10 Ca 0.01 -0.52 -0.02 0.00 -1.41 0.00 0.00 57.07 55.13 1zpw s TYR 10 Cb -0.13 -0.49 0.11 0.00 -1.10 0.00 0.00 41.96 40.35 1zpw s TYR 10 CO 0.03 -0.04 0.14 0.34 -2.51 0.00 0.00 175.55 173.51 1zpw s ASP 11 N -1.77 3.59 -0.24 -0.18 -1.08 0.16 -4.80 116.67 112.35 1zpw s ASP 11 Ca -0.06 -1.65 0.01 0.00 -0.52 0.00 0.00 52.55 50.34 1zpw s ASP 11 Cb -0.09 -0.56 0.06 0.00 -1.46 0.00 0.00 42.92 40.88 1zpw s ASP 11 CO 0.01 -0.40 -0.06 -0.63 0.52 0.00 0.00 175.17 174.61 1zpw s ILE 12 N 1.65 1.65 0.37 4.11 1.01 -1.26 -0.90 121.20 127.83 1zpw s ILE 12 Ca 0.11 -1.32 0.16 0.00 0.00 0.00 0.00 60.65 59.60 1zpw s ILE 12 Cb -0.18 -1.90 0.15 0.00 0.01 0.00 0.00 42.46 40.54 1zpw s ILE 12 CO -0.24 -0.10 1.89 1.55 0.00 0.00 0.00 174.94 178.03 1zpw h PRO 13 N 7.92 0.00 -5.92 2.79 0.13 -1.99 -3.43 132.00 131.49 1zpw h PRO 13 Ca -0.18 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.37 1zpw h PRO 13 Cb 1.06 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.12 1zpw h PRO 13 CO 0.42 0.30 0.34 0.34 -0.23 0.00 0.00 178.00 179.17 1zpw s ASP 14 N -6.78 6.92 0.18 1.44 2.15 -1.26 -4.97 116.67 114.37 1zpw s ASP 14 Ca -0.03 1.13 -0.11 0.00 0.43 0.00 0.00 52.55 53.97 1zpw s ASP 14 Cb 0.14 -2.44 0.10 0.00 -0.30 0.00 0.00 42.92 40.42 1zpw s ASP 14 CO 0.69 -0.37 1.78 0.44 -0.17 0.00 0.00 175.17 177.55 1zpw h ASP 15 N 7.32 0.83 -0.24 -0.34 3.32 -2.00 -0.96 116.42 124.36 1zpw h ASP 15 Ca -0.30 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 56.62 1zpw h ASP 15 Cb 1.14 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.46 1zpw h ASP 15 CO 0.82 0.71 0.10 0.74 -1.72 0.00 0.00 179.24 179.90 1zpw h THR 16 N 0.89 1.16 -0.66 0.35 2.02 -1.97 -0.70 112.91 113.99 1zpw h THR 16 Ca 0.22 -0.48 -0.01 0.00 0.77 0.00 0.00 66.41 66.91 1zpw h THR 16 Cb 0.09 1.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.51 1zpw h THR 16 CO -0.03 0.16 0.36 0.03 0.37 0.00 0.00 175.52 176.41 1zpw h ARG 17 N 0.24 0.92 -0.55 6.66 3.08 -1.89 -1.84 114.38 121.00 1zpw h ARG 17 Ca 0.08 -0.10 -0.12 0.00 0.07 0.00 0.00 59.98 59.92 1zpw h ARG 17 Cb 0.16 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 1zpw h ARG 17 CO -0.01 0.67 -0.11 -0.09 -1.07 0.00 0.00 179.97 179.36 1zpw h ARG 18 N 0.92 1.04 -0.42 0.04 2.43 -0.73 -0.43 114.38 117.23 1zpw h ARG 18 Ca 0.24 -0.39 -0.02 0.00 -0.81 0.00 0.00 59.98 58.99 1zpw h ARG 18 Cb 0.03 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1zpw h ARG 18 CO -0.04 1.08 0.17 0.28 -1.51 0.00 0.00 179.97 179.96 1zpw h VAL 19 N 0.92 1.19 -0.81 0.20 2.07 -0.87 0.05 116.25 119.00 1zpw h VAL 19 Ca 0.14 -0.59 -0.04 0.00 0.82 0.00 0.00 66.70 67.03 1zpw h VAL 19 Cb 0.69 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 1zpw h VAL 19 CO 0.05 0.22 0.34 0.11 0.02 0.00 0.00 177.57 178.31 1zpw h LYS 20 N 0.53 1.20 -0.35 1.57 1.57 -1.04 -1.15 116.57 118.90 1zpw h LYS 20 Ca 0.14 -0.21 -0.08 0.00 -1.87 0.00 0.00 60.65 58.64 1zpw h LYS 20 Cb 0.17 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1zpw h LYS 20 CO -0.01 0.96 -0.07 1.25 -0.57 0.00 0.00 179.45 181.00 1zpw h LEU 21 N 1.17 0.67 -0.93 2.94 5.85 -0.79 -0.90 115.31 123.33 1zpw h LEU 21 Ca 0.27 -0.36 0.01 0.00 0.84 0.00 0.00 57.88 58.64 1zpw h LEU 21 Cb 0.19 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.99 1zpw h LEU 21 CO -0.03 0.87 0.61 0.00 -0.34 0.00 0.00 178.44 179.56 1zpw h ALA 22 N 0.82 1.17 -0.70 1.25 0.00 -0.77 -0.45 119.26 120.60 1zpw h ALA 22 Ca 0.09 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1zpw h ALA 22 Cb 0.57 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1zpw h ALA 22 CO 0.03 0.58 0.23 -0.97 0.00 0.00 0.00 179.25 179.12 1zpw h ASN 23 N 1.26 0.99 -0.28 0.00 -0.73 -1.00 -2.10 115.58 113.72 1zpw h ASN 23 Ca 0.34 -0.17 -0.00 0.00 1.87 0.00 0.00 56.30 58.33 1zpw h ASN 23 Cb -0.14 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 38.18 1zpw h ASN 23 CO -0.07 0.91 0.16 0.25 -0.37 0.00 0.00 177.43 178.31 1zpw h LEU 24 N 1.03 0.34 -1.88 0.34 5.85 -0.54 -3.02 115.31 117.43 1zpw h LEU 24 Ca 0.23 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 1zpw h LEU 24 Cb 0.27 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 1zpw h LEU 24 CO -0.01 0.32 -0.08 -0.07 -0.34 0.00 0.00 178.44 178.25 1zpw h LEU 25 N 0.34 0.00 -2.11 2.25 3.38 -0.68 -0.88 115.31 117.61 1zpw h LEU 25 Ca 0.10 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.14 1zpw h LEU 25 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1zpw h LEU 25 CO -0.02 0.08 0.22 0.11 0.09 0.00 0.00 178.44 178.92 1zpw h LYS 26 N 0.00 0.00 0.00 1.13 1.79 -1.25 -0.09 116.57 118.15 1zpw h LYS 26 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1zpw h LYS 26 Cb 0.15 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.80 1zpw h LYS 26 CO 0.01 0.00 0.00 -1.13 -1.08 0.00 0.00 179.45 177.25 1zpw n SER 27 N -4.14 0.16 -0.00 0.86 3.41 -0.33 -3.57 113.62 110.01 1zpw n SER 27 Ca 0.03 0.53 0.00 0.00 -0.26 0.00 0.00 58.87 59.17 1zpw n SER 27 Cb 0.37 -0.57 -0.00 0.00 -0.26 0.00 0.00 64.21 63.75 1zpw n SER 27 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1zpw n TYR 28 N -1.66 0.00 -2.72 7.33 4.01 -0.16 -5.12 117.16 118.83 1zpw n TYR 28 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 1zpw n TYR 28 Cb 0.27 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.30 1zpw n TYR 28 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1zpw n GLY 29 N 1.27 -0.58 3.13 2.72 0.00 -0.51 -3.55 105.19 107.67 1zpw n GLY 29 Ca 0.00 -0.59 -0.18 0.00 0.00 0.00 0.00 46.02 45.25 1zpw n GLY 29 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1zpw s GLU 30 N -0.15 0.80 0.36 1.61 0.41 -0.63 -4.22 118.70 116.88 1zpw s GLU 30 Ca 0.00 -0.80 -0.28 0.00 -0.41 0.00 0.00 54.97 53.48 1zpw s GLU 30 Cb 0.00 -0.77 -0.10 0.00 -1.78 0.00 0.00 34.13 31.48 1zpw s GLU 30 CO 0.00 0.18 1.38 0.50 -0.49 0.00 0.00 175.26 176.83 1zpw s ARG 31 N -1.37 4.20 -0.00 1.61 3.52 -1.26 -0.44 118.95 125.21 1zpw s ARG 31 Ca -0.02 2.35 0.00 0.00 -0.13 0.00 0.00 55.73 57.94 1zpw s ARG 31 Cb -0.09 -2.99 -0.01 0.00 -1.56 0.00 0.00 34.95 30.31 1zpw s ARG 31 CO 0.01 -0.37 0.01 1.33 -0.81 0.00 0.00 175.30 175.47 1zpw n VAL 32 N 0.57 0.02 -4.04 7.11 0.24 -0.26 -4.85 118.33 117.13 1zpw n VAL 32 Ca 0.01 -0.02 -0.12 0.00 -2.04 0.00 0.00 64.34 62.17 1zpw n VAL 32 Cb 0.41 -0.31 -0.04 0.00 -1.47 0.00 0.00 33.84 32.42 1zpw n VAL 32 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1zpw s GLN 33 N -2.02 1.77 0.50 7.34 -0.21 -1.08 -4.52 119.66 121.43 1zpw s GLN 33 Ca -0.00 -1.54 0.21 0.00 0.02 0.00 0.00 55.36 54.05 1zpw s GLN 33 Cb 0.00 0.46 1.28 0.00 1.00 0.00 0.00 33.01 35.75 1zpw s GLN 33 CO 0.02 -0.74 2.00 1.25 -2.12 0.00 0.00 175.29 175.70 1zpw h LEU 34 N 2.18 0.11 -2.53 2.90 5.85 -2.01 -2.89 115.31 118.92 1zpw h LEU 34 Ca -0.28 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.44 1zpw h LEU 34 Cb 1.25 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.26 1zpw h LEU 34 CO 0.39 0.06 -0.23 -1.20 -0.34 0.00 0.00 178.44 177.12 1zpw n SER 35 N -4.42 1.27 -3.81 1.25 7.64 -1.26 -5.05 113.62 109.23 1zpw n SER 35 Ca 0.09 -2.58 -0.15 0.00 1.01 0.00 0.00 58.87 57.25 1zpw n SER 35 Cb 0.50 -0.32 -0.16 0.00 -1.01 0.00 0.00 64.21 63.23 1zpw n SER 35 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1zpw s VAL 36 N -1.54 0.01 0.14 0.44 1.01 -1.09 -1.39 120.40 117.99 1zpw s VAL 36 Ca 0.17 0.13 0.08 0.00 0.00 0.00 0.00 61.98 62.36 1zpw s VAL 36 Cb 0.15 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 36.38 1zpw s VAL 36 CO 0.02 0.08 -0.08 -0.36 0.00 0.00 0.00 175.10 174.76 1zpw s PHE 37 N 0.80 2.72 -0.17 5.22 0.40 -0.14 -1.10 117.98 125.71 1zpw s PHE 37 Ca -0.07 -0.18 -0.03 0.00 -0.60 0.00 0.00 56.93 56.05 1zpw s PHE 37 Cb -0.10 -1.37 -0.02 0.00 0.51 0.00 0.00 43.02 42.04 1zpw s PHE 37 CO -0.02 0.47 -0.04 -1.21 0.70 0.00 0.00 175.22 175.12 1zpw s GLU 38 N -2.57 3.56 -0.03 0.44 2.02 0.42 -0.37 118.70 122.17 1zpw s GLU 38 Ca 0.24 -0.57 0.02 0.00 0.02 0.00 0.00 54.97 54.68 1zpw s GLU 38 Cb -0.10 -2.92 0.01 0.00 0.10 0.00 0.00 34.13 31.22 1zpw s GLU 38 CO 0.15 0.11 -0.09 0.00 0.02 0.00 0.00 175.26 175.45 1zpw s TYR 40 N 0.38 3.24 0.03 0.00 2.02 -1.23 -0.53 117.35 121.26 1zpw s TYR 40 Ca -0.06 0.49 0.03 0.00 -0.37 0.00 0.00 57.07 57.15 1zpw s TYR 40 Cb -0.11 -2.71 -0.02 0.00 -0.40 0.00 0.00 41.96 38.72 1zpw s TYR 40 CO 0.01 -0.31 -0.08 -0.51 -1.57 0.00 0.00 175.55 173.09 1zpw s LEU 41 N 2.25 2.18 0.00 -1.29 1.43 -0.26 -4.86 118.68 118.13 1zpw s LEU 41 Ca 0.19 -0.42 0.03 0.00 -1.03 0.00 0.00 54.13 52.90 1zpw s LEU 41 Cb -0.16 -0.27 0.03 0.00 0.03 0.00 0.00 46.19 45.82 1zpw s LEU 41 CO 0.10 -0.09 0.26 -0.90 0.23 0.00 0.00 176.35 175.94 1zpw n ASP 42 N 1.91 1.80 -0.27 2.29 3.85 -1.26 -0.90 116.55 123.97 1zpw n ASP 42 Ca -0.19 -1.99 0.04 0.00 -0.71 0.00 0.00 54.79 51.94 1zpw n ASP 42 Cb 0.56 -0.06 0.18 0.00 -1.35 0.00 0.00 41.12 40.45 1zpw n ASP 42 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 1zpw h GLU 43 N 0.00 0.55 -0.27 0.11 4.57 -2.00 0.90 114.58 118.44 1zpw h GLU 43 Ca -0.18 -0.03 -0.06 0.00 -1.18 0.00 0.00 59.36 57.91 1zpw h GLU 43 Cb 0.68 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.14 1zpw h GLU 43 CO 0.28 0.36 -0.06 -0.09 -1.18 0.00 0.00 179.01 178.32 1zpw h ARG 44 N 0.56 0.52 -0.16 1.92 2.43 -1.98 -1.59 114.38 116.08 1zpw h ARG 44 Ca 0.41 -0.20 -0.13 0.00 -0.81 0.00 0.00 59.98 59.25 1zpw h ARG 44 Cb 0.54 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 1zpw h ARG 44 CO -0.34 0.73 -0.45 -0.07 -1.51 0.00 0.00 179.97 178.33 1zpw h LEU 45 N 0.28 0.42 -0.21 3.80 3.38 -1.87 -1.45 115.31 119.66 1zpw h LEU 45 Ca 0.07 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1zpw h LEU 45 Cb 0.54 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1zpw h LEU 45 CO 0.03 0.81 0.09 0.25 0.09 0.00 0.00 178.44 179.71 1zpw h LEU 46 N 0.32 0.28 -1.03 1.67 5.85 -0.69 0.31 115.31 122.02 1zpw h LEU 46 Ca 0.02 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.61 1zpw h LEU 46 Cb 0.92 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.83 1zpw h LEU 46 CO 0.08 0.34 0.63 -0.08 -0.34 0.00 0.00 178.44 179.07 1zpw h GLU 47 N 0.20 1.28 -0.37 1.25 4.81 -1.14 -0.78 114.58 119.82 1zpw h GLU 47 Ca 0.07 -0.09 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 1zpw h GLU 47 Cb 0.14 -0.29 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 1zpw h GLU 47 CO -0.01 0.86 0.10 0.22 -0.73 0.00 0.00 179.01 179.45 1zpw h ASP 48 N 1.32 0.56 -0.19 1.04 -0.00 -0.96 -0.34 116.42 117.85 1zpw h ASP 48 Ca 0.35 -0.23 0.03 0.00 -0.00 0.00 0.00 57.03 57.19 1zpw h ASP 48 Cb -0.13 -0.15 -0.03 0.00 -0.00 0.00 0.00 39.33 39.02 1zpw h ASP 48 CO -0.07 0.64 0.01 0.25 -0.00 0.00 0.00 179.24 180.06 1zpw h LEU 49 N 0.45 -0.06 -0.44 2.28 6.46 -0.57 -0.98 115.31 122.46 1zpw h LEU 49 Ca 0.12 0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.92 1zpw h LEU 49 Cb 0.29 0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.27 1zpw h LEU 49 CO 0.00 -0.00 0.29 0.03 -0.62 0.00 0.00 178.44 178.14 1zpw h ARG 50 N 0.07 0.59 -0.70 1.25 3.08 -0.92 0.15 114.38 117.90 1zpw h ARG 50 Ca 0.09 -0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.14 1zpw h ARG 50 Cb 0.10 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 29.97 1zpw h ARG 50 CO -0.14 0.39 0.43 -0.09 -1.07 0.00 0.00 179.97 179.49 1zpw h ARG 51 N 0.60 0.80 0.03 0.04 2.43 -0.85 0.53 114.38 117.96 1zpw h ARG 51 Ca 0.16 -0.05 -0.24 0.00 -0.81 0.00 0.00 59.98 59.04 1zpw h ARG 51 Cb -0.07 -0.18 0.01 0.00 -0.42 0.00 0.00 29.97 29.31 1zpw h ARG 51 CO -0.03 0.53 -1.02 0.00 -1.51 0.00 0.00 179.97 177.94 1zpw h ARG 52 N 0.82 0.45 -0.57 0.20 3.08 -0.94 -3.13 114.38 114.29 1zpw h ARG 52 Ca 0.29 -0.52 -0.08 0.00 0.07 0.00 0.00 59.98 59.75 1zpw h ARG 52 Cb 0.06 0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1zpw h ARG 52 CO -0.13 1.17 0.05 0.00 -1.07 0.00 0.00 179.97 179.99 1zpw h ALA 53 N 0.64 1.01 -0.17 0.04 0.00 -0.36 -2.70 119.26 117.72 1zpw h ALA 53 Ca -0.10 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 1zpw h ALA 53 Cb 1.67 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1zpw h ALA 53 CO 0.18 0.62 0.08 0.00 0.00 0.00 0.00 179.25 180.13 1zpw h ARG 54 N 0.88 0.23 -0.01 0.00 3.08 -0.86 0.09 114.38 117.79 1zpw h ARG 54 Ca 0.17 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.16 1zpw h ARG 54 Cb 0.45 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 1zpw h ARG 54 CO 0.02 0.18 -0.21 0.00 -1.07 0.00 0.00 179.97 178.88 1zpw h ARG 55 N 0.23 0.02 0.03 0.04 3.08 -1.43 -3.31 114.38 113.05 1zpw h ARG 55 Ca 0.06 -0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.77 1zpw h ARG 55 Cb 0.03 -0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.02 1zpw h ARG 55 CO -0.01 0.24 -1.99 1.28 -1.07 0.00 0.00 179.97 178.42 1zpw n LEU 56 N -4.27 1.29 -4.82 3.04 4.77 -0.05 -4.98 117.00 111.98 1zpw n LEU 56 Ca -0.02 0.23 -0.34 0.00 -0.03 0.00 0.00 56.01 55.85 1zpw n LEU 56 Cb 0.28 -0.15 -0.07 0.00 -2.33 0.00 0.00 43.42 41.15 1zpw n LEU 56 CO 0.37 0.57 0.61 -0.76 -1.33 0.00 0.00 177.39 176.84 1zpw s LEU 57 N -6.22 4.06 -0.57 2.23 1.43 -0.77 -4.92 118.68 113.92 1zpw s LEU 57 Ca -0.13 1.65 -0.20 0.00 -1.03 0.00 0.00 54.13 54.42 1zpw s LEU 57 Cb 0.07 -4.32 0.08 0.00 0.03 0.00 0.00 46.19 42.05 1zpw s LEU 57 CO 0.79 -0.26 0.74 -0.62 0.23 0.00 0.00 176.35 177.24 1zpw s ASP 58 N -2.05 6.21 0.00 2.29 -1.08 -1.26 -4.94 116.67 115.84 1zpw s ASP 58 Ca 0.57 -1.10 0.25 0.00 -0.52 0.00 0.00 52.55 51.76 1zpw s ASP 58 Cb -0.12 -2.33 1.34 0.00 -1.46 0.00 0.00 42.92 40.36 1zpw s ASP 58 CO 0.16 -1.10 1.85 0.18 0.52 0.00 0.00 175.17 176.77 1zpw n LEU 59 N 6.60 0.00 0.11 -1.34 4.77 -1.26 -0.77 117.00 125.11 1zpw n LEU 59 Ca -0.07 0.19 0.12 0.00 -0.03 0.00 0.00 56.01 56.23 1zpw n LEU 59 Cb 0.44 -0.19 0.25 0.00 -2.33 0.00 0.00 43.42 41.59 1zpw n LEU 59 CO 0.58 -0.04 0.60 1.23 -1.33 0.00 0.00 177.39 178.43 1zpw h GLY 60 N 4.05 0.00 0.00 -0.72 0.00 -2.05 -3.40 103.07 100.95 1zpw h GLY 60 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1zpw h GLY 60 CO 0.00 0.00 -1.02 -1.06 0.00 0.00 0.00 176.54 174.46 1zpw n GLN 61 N -2.37 2.76 -4.04 4.80 6.02 -0.34 -5.09 117.38 119.12 1zpw n GLN 61 Ca 0.04 -0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.75 1zpw n GLN 61 Cb 0.46 -1.01 -0.05 0.00 1.02 0.00 0.00 30.24 30.66 1zpw n GLN 61 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1zpw s ASP 62 N -2.74 5.69 -0.02 1.08 1.01 0.05 -4.62 116.67 117.11 1zpw s ASP 62 Ca -0.00 -0.03 0.03 0.00 0.71 0.00 0.00 52.55 53.26 1zpw s ASP 62 Cb 0.00 -1.55 -0.00 0.00 1.01 0.00 0.00 42.92 42.38 1zpw s ASP 62 CO 0.01 0.10 -0.12 0.00 0.21 0.00 0.00 175.17 175.38 1zpw s ALA 63 N -1.63 1.05 -0.06 5.23 0.00 -0.08 -4.78 121.76 121.50 1zpw s ALA 63 Ca 0.31 -0.48 -0.01 0.00 0.00 0.00 0.00 51.96 51.79 1zpw s ALA 63 Cb -0.11 -0.34 0.03 0.00 0.00 0.00 0.00 23.12 22.70 1zpw s ALA 63 CO 0.24 0.21 -0.01 -1.17 0.00 0.00 0.00 175.76 175.03 1zpw s LEU 64 N -0.01 0.83 -0.07 0.00 0.20 -1.26 -0.67 118.68 117.70 1zpw s LEU 64 Ca -0.00 -0.08 0.05 0.00 0.69 0.00 0.00 54.13 54.79 1zpw s LEU 64 Cb -0.08 -0.39 -0.01 0.00 -0.43 0.00 0.00 46.19 45.28 1zpw s LEU 64 CO 0.00 -0.15 -0.21 -0.13 -0.29 0.00 0.00 176.35 175.57 1zpw s ARG 65 N 1.58 2.67 -0.21 1.98 0.52 0.76 -4.99 118.95 121.25 1zpw s ARG 65 Ca -0.01 -0.84 0.01 0.00 -0.52 0.00 0.00 55.73 54.37 1zpw s ARG 65 Cb -0.13 -2.27 0.03 0.00 0.52 0.00 0.00 34.95 33.10 1zpw s ARG 65 CO -0.03 0.40 -0.15 0.42 0.02 0.00 0.00 175.30 175.95 1zpw s ILE 66 N -0.19 2.25 -0.26 1.52 1.01 -1.26 -1.03 121.20 123.24 1zpw s ILE 66 Ca -0.02 -1.13 -0.06 0.00 0.00 0.00 0.00 60.65 59.45 1zpw s ILE 66 Cb -0.14 -2.08 -0.00 0.00 0.01 0.00 0.00 42.46 40.25 1zpw s ILE 66 CO 0.03 0.33 0.03 -0.31 0.00 0.00 0.00 174.94 175.02 1zpw s TYR 67 N 1.25 3.06 0.06 3.97 2.02 0.13 -4.97 117.35 122.87 1zpw s TYR 67 Ca 0.01 -0.88 -0.31 0.00 -0.37 0.00 0.00 57.07 55.52 1zpw s TYR 67 Cb -0.15 -2.19 -0.06 0.00 -0.40 0.00 0.00 41.96 39.16 1zpw s TYR 67 CO -0.09 -0.53 1.22 -1.25 -1.57 0.00 0.00 175.55 173.33 1zpw s PRO 68 N 1.51 4.41 -0.12 -1.71 0.04 -1.26 -1.06 135.00 136.81 1zpw s PRO 68 Ca 0.04 1.80 -0.06 0.00 0.04 0.00 0.00 61.00 62.83 1zpw s PRO 68 Cb -0.16 -3.36 -0.04 0.00 0.04 0.00 0.00 34.50 30.99 1zpw s PRO 68 CO 0.00 -0.29 0.09 0.08 0.04 0.00 0.00 177.00 176.92 1zpw s VAL 69 N 1.17 5.05 -0.23 -0.36 1.01 -0.01 -4.95 120.40 122.09 1zpw s VAL 69 Ca 0.59 0.04 -0.03 0.00 0.00 0.00 0.00 61.98 62.58 1zpw s VAL 69 Cb -0.30 -3.20 0.12 0.00 0.00 0.00 0.00 36.38 33.00 1zpw s VAL 69 CO 0.29 0.59 0.29 0.00 0.00 0.00 0.00 175.10 176.27 1zpw s ALA 70 N -0.74 -0.64 0.00 5.51 0.00 -1.26 -4.57 121.76 120.06 1zpw s ALA 70 Ca 0.13 0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.54 1zpw s ALA 70 Cb -0.12 -1.53 0.00 0.00 0.00 0.00 0.00 23.12 21.48 1zpw s ALA 70 CO 0.03 -1.29 0.00 0.41 0.00 0.00 0.00 175.76 174.90 1zpw n GLY 71 N 5.34 0.56 3.67 0.00 0.00 -1.26 -5.04 105.19 108.45 1zpw n GLY 71 Ca -0.04 -2.17 -0.43 0.00 0.00 0.00 0.00 46.02 43.38 1zpw n GLY 71 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1zpw s GLN 72 N -0.68 4.30 0.21 1.61 2.00 -1.26 -5.02 119.66 120.82 1zpw s GLN 72 Ca 0.00 1.39 -0.30 0.00 -2.00 0.00 0.00 55.36 54.45 1zpw s GLN 72 Cb 0.00 -3.62 -0.08 0.00 0.80 0.00 0.00 33.01 30.10 1zpw s GLN 72 CO 0.00 -0.56 1.12 0.08 -0.50 0.00 0.00 175.29 175.43 1zpw s VAL 73 N 2.94 3.67 -0.08 1.34 1.01 -1.26 -5.05 120.40 122.96 1zpw s VAL 73 Ca 0.46 1.50 0.02 0.00 0.00 0.00 0.00 61.98 63.96 1zpw s VAL 73 Cb -0.16 -3.96 -0.02 0.00 0.00 0.00 0.00 36.38 32.24 1zpw s VAL 73 CO 0.09 0.29 -0.13 -1.61 0.00 0.00 0.00 175.10 173.74 1zpw s GLU 74 N -0.68 2.85 -0.09 2.72 2.02 -1.26 -4.82 118.70 119.44 1zpw s GLU 74 Ca 0.49 -0.68 0.01 0.00 0.02 0.00 0.00 54.97 54.81 1zpw s GLU 74 Cb -0.31 -2.49 0.02 0.00 0.10 0.00 0.00 34.13 31.45 1zpw s GLU 74 CO 0.37 0.48 -0.11 0.08 0.02 0.00 0.00 175.26 176.09 1zpw s VAL 75 N -0.34 1.18 -0.07 2.63 1.01 -1.26 -5.07 120.40 118.48 1zpw s VAL 75 Ca 0.03 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 61.58 1zpw s VAL 75 Cb -0.13 -1.11 -0.02 0.00 0.00 0.00 0.00 36.38 35.12 1zpw s VAL 75 CO 0.02 0.38 -0.14 -0.76 0.00 0.00 0.00 175.10 174.60 1zpw s LEU 76 N 1.05 2.71 0.00 3.92 1.43 -1.26 -5.04 118.68 121.49 1zpw s LEU 76 Ca -0.07 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.79 1zpw s LEU 76 Cb -0.15 -1.56 0.00 0.00 0.03 0.00 0.00 46.19 44.51 1zpw s LEU 76 CO -0.01 0.29 0.00 0.61 0.23 0.00 0.00 176.35 177.47 1zpw n GLY 77 N 2.67 -0.33 3.84 -3.19 0.00 -1.26 -4.94 105.19 101.98 1zpw n GLY 77 Ca -0.17 -1.34 -0.29 0.00 0.00 0.00 0.00 46.02 44.21 1zpw n GLY 77 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1zpw s VAL 78 N 0.00 1.99 0.00 1.61 -7.23 -1.26 -4.99 120.40 110.52 1zpw s VAL 78 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.17 1zpw s VAL 78 Cb 0.00 -2.87 0.00 0.00 0.56 0.00 0.00 36.38 34.07 1zpw s VAL 78 CO 0.00 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 1zpw n GLY 79 N -2.79 1.75 3.75 2.32 0.00 -1.26 -5.02 105.19 103.95 1zpw n GLY 79 Ca 0.08 -2.06 -0.41 0.00 0.00 0.00 0.00 46.02 43.63 1zpw n GLY 79 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1zpw s PRO 80 N -1.99 4.16 0.43 1.61 0.02 -1.26 -4.94 135.00 133.03 1zpw s PRO 80 Ca 0.00 2.50 -0.25 0.00 0.02 0.00 0.00 61.00 63.27 1zpw s PRO 80 Cb 0.00 -3.04 -0.08 0.00 0.02 0.00 0.00 34.50 31.40 1zpw s PRO 80 CO 0.00 -0.55 1.28 -0.51 -0.33 0.00 0.00 177.00 176.89 1zpw s LEU 81 N -0.79 4.13 0.71 -5.54 1.43 -1.26 -5.00 118.68 112.37 1zpw s LEU 81 Ca 0.60 2.59 -0.11 0.00 -1.03 0.00 0.00 54.13 56.18 1zpw s LEU 81 Cb -0.46 -4.01 0.02 0.00 0.03 0.00 0.00 46.19 41.76 1zpw s LEU 81 CO 0.49 -0.94 1.08 -2.16 0.23 0.00 0.00 176.35 175.05 1zpw s PRO 82 N -2.40 2.84 0.00 1.29 0.04 -1.26 -5.15 135.00 130.35 1zpw s PRO 82 Ca 0.60 0.60 0.02 0.00 0.04 0.00 0.00 61.00 62.26 1zpw s PRO 82 Cb -0.36 -2.01 0.14 0.00 0.04 0.00 0.00 34.50 32.31 1zpw s PRO 82 CO 0.46 -1.08 0.63 -1.91 0.04 0.00 0.00 177.00 175.14