#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zw2 s LEU 5 N 0.00 2.05 0.06 4.03 2.96 -1.26 -1.82 118.68 124.70 2zw2 s LEU 5 Ca 0.00 -0.47 0.08 0.00 -0.22 0.00 0.00 54.13 53.51 2zw2 s LEU 5 Cb 0.00 -1.31 -0.03 0.00 0.50 0.00 0.00 46.19 45.35 2zw2 s LEU 5 CO 0.00 0.27 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.78 2zw2 s TYR 6 N -0.35 1.81 -0.32 5.38 2.02 0.63 -1.26 117.35 125.25 2zw2 s TYR 6 Ca 0.03 -0.39 -0.11 0.00 -0.37 0.00 0.00 57.07 56.23 2zw2 s TYR 6 Cb -0.12 -1.05 -0.01 0.00 -0.40 0.00 0.00 41.96 40.38 2zw2 s TYR 6 CO 0.01 0.12 0.20 0.50 -1.57 0.00 0.00 175.55 174.81 2zw2 s ARG 7 N -1.37 3.42 -0.20 -0.62 3.52 0.10 0.07 118.95 123.86 2zw2 s ARG 7 Ca 0.07 -0.68 -0.02 0.00 -0.13 0.00 0.00 55.73 54.97 2zw2 s ARG 7 Cb -0.09 -3.68 0.00 0.00 -1.56 0.00 0.00 34.95 29.62 2zw2 s ARG 7 CO 0.02 -0.43 -0.11 0.08 -0.81 0.00 0.00 175.30 174.05 2zw2 s VAL 8 N 1.67 2.78 -0.00 7.11 1.01 0.42 -1.58 120.40 131.80 2zw2 s VAL 8 Ca 0.05 -0.70 -0.09 0.00 0.00 0.00 0.00 61.98 61.24 2zw2 s VAL 8 Cb -0.17 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 33.93 2zw2 s VAL 8 CO 0.08 0.47 0.31 -1.61 0.00 0.00 0.00 175.10 174.35 2zw2 s GLU 9 N 1.39 3.67 -0.18 2.72 2.02 0.12 -0.25 118.70 128.20 2zw2 s GLU 9 Ca 0.05 0.08 -0.01 0.00 0.02 0.00 0.00 54.97 55.12 2zw2 s GLU 9 Cb -0.14 -3.11 0.05 0.00 0.10 0.00 0.00 34.13 31.03 2zw2 s GLU 9 CO -0.08 0.66 -0.01 -1.17 0.02 0.00 0.00 175.26 174.68 2zw2 s LEU 10 N -1.50 1.50 -0.21 1.80 2.96 0.94 -1.68 118.68 122.49 2zw2 s LEU 10 Ca 0.26 -0.75 -0.05 0.00 -0.22 0.00 0.00 54.13 53.36 2zw2 s LEU 10 Cb -0.14 -0.78 -0.02 0.00 0.50 0.00 0.00 46.19 45.74 2zw2 s LEU 10 CO 0.14 -0.24 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.29 2zw2 s ILE 11 N 1.72 3.85 -0.20 6.68 1.01 0.03 -1.41 121.20 132.87 2zw2 s ILE 11 Ca -0.01 -0.34 -0.03 0.00 0.00 0.00 0.00 60.65 60.27 2zw2 s ILE 11 Cb -0.16 -2.75 -0.00 0.00 0.01 0.00 0.00 42.46 39.56 2zw2 s ILE 11 CO -0.07 0.42 -0.08 -0.63 0.00 0.00 0.00 174.94 174.58 2zw2 s ILE 12 N 1.13 3.07 0.28 2.92 1.01 -0.32 -0.95 121.20 128.34 2zw2 s ILE 12 Ca 0.02 -0.60 0.02 0.00 0.00 0.00 0.00 60.65 60.10 2zw2 s ILE 12 Cb -0.14 -2.37 -0.05 0.00 0.01 0.00 0.00 42.46 39.90 2zw2 s ILE 12 CO 0.01 0.46 0.09 0.42 0.00 0.00 0.00 174.94 175.92 2zw2 s THR 13 N 1.35 0.69 0.43 2.92 -4.23 -0.52 -1.04 115.64 115.24 2zw2 s THR 13 Ca 0.04 -2.00 -0.20 0.00 -1.18 0.00 0.00 61.69 58.35 2zw2 s THR 13 Cb -0.14 -2.66 -0.10 0.00 1.34 0.00 0.00 72.50 70.93 2zw2 s THR 13 CO -0.05 0.00 0.93 0.20 -0.54 0.00 0.00 174.62 175.17 2zw2 s ASN 14 N -3.36 6.89 0.68 3.99 0.02 -1.26 0.09 114.94 121.98 2zw2 s ASN 14 Ca 0.37 1.64 -0.16 0.00 -1.02 0.00 0.00 52.86 53.69 2zw2 s ASN 14 Cb 0.08 -2.52 0.01 0.00 0.02 0.00 0.00 41.25 38.84 2zw2 s ASN 14 CO 0.14 -0.37 1.16 -0.54 0.02 0.00 0.00 177.10 177.51 2zw2 s LYS 15 N -3.27 2.57 0.43 -0.60 1.02 -0.18 -4.62 119.74 115.10 2zw2 s LYS 15 Ca 0.61 1.59 0.20 0.00 0.02 0.00 0.00 55.97 58.39 2zw2 s LYS 15 Cb -0.09 -1.90 1.15 0.00 -0.52 0.00 0.00 37.83 36.46 2zw2 s LYS 15 CO 0.15 -1.47 1.84 0.93 -0.92 0.00 0.00 175.35 175.89 2zw2 h GLU 16 N 0.03 0.34 -0.57 1.68 5.08 -1.95 -1.28 114.58 117.90 2zw2 h GLU 16 Ca -0.48 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 2zw2 h GLU 16 Cb 1.27 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2zw2 h GLU 16 CO 0.52 0.22 0.00 0.41 -1.00 0.00 0.00 179.01 179.17 2zw2 n GLY 17 N -1.54 1.69 3.21 -3.84 0.00 -1.26 -4.84 105.19 98.61 2zw2 n GLY 17 Ca 0.21 -0.56 -0.33 0.00 0.00 0.00 0.00 46.02 45.33 2zw2 n GLY 17 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2zw2 s VAL 18 N -1.60 2.41 0.18 1.61 1.01 -0.49 -5.09 120.40 118.42 2zw2 s VAL 18 Ca 0.34 -0.85 -0.33 0.00 0.00 0.00 0.00 61.98 61.14 2zw2 s VAL 18 Cb 0.21 -2.01 -0.15 0.00 0.00 0.00 0.00 36.38 34.43 2zw2 s VAL 18 CO 0.19 0.52 1.37 -1.14 0.00 0.00 0.00 175.10 176.04 2zw2 n ARG 19 N 4.25 1.67 -3.74 2.72 0.63 -1.26 -4.63 116.66 116.30 2zw2 n ARG 19 Ca -0.20 0.60 -0.36 0.00 -0.92 0.00 0.00 57.85 56.97 2zw2 n ARG 19 Cb 0.51 -2.24 -0.10 0.00 0.45 0.00 0.00 32.46 31.08 2zw2 n ARG 19 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 2zw2 s ASP 20 N 0.39 5.24 0.32 6.15 2.15 -1.26 -4.98 116.67 124.68 2zw2 s ASP 20 Ca 0.75 -2.59 0.03 0.00 0.43 0.00 0.00 52.55 51.17 2zw2 s ASP 20 Cb -0.77 -1.85 0.62 0.00 -0.30 0.00 0.00 42.92 40.63 2zw2 s ASP 20 CO 0.47 -0.43 1.92 -0.65 -0.17 0.00 0.00 175.17 176.31 2zw2 h PRO 21 N 7.36 0.89 0.21 4.34 0.11 -1.98 -0.63 132.00 142.29 2zw2 h PRO 21 Ca -0.06 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.99 2zw2 h PRO 21 Cb 0.98 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.89 2zw2 h PRO 21 CO 0.71 0.59 -0.10 1.49 -0.21 0.00 0.00 178.00 180.48 2zw2 h GLU 22 N 0.91 -0.27 -0.62 1.05 4.81 -1.95 -1.21 114.58 117.30 2zw2 h GLU 22 Ca 0.37 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.68 2zw2 h GLU 22 Cb 0.27 0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.66 2zw2 h GLU 22 CO -0.14 0.07 0.34 0.78 -0.73 0.00 0.00 179.01 179.33 2zw2 h GLY 23 N -0.65 0.90 0.94 1.92 0.00 -1.77 0.84 103.07 105.26 2zw2 h GLY 23 Ca -0.03 -0.23 0.01 0.00 0.00 0.00 0.00 47.33 47.08 2zw2 h GLY 23 CO 0.05 0.14 0.25 -2.09 0.00 0.00 0.00 176.54 174.89 2zw2 h GLU 24 N 0.63 0.49 -0.30 4.80 4.81 -1.11 -1.23 114.58 122.68 2zw2 h GLU 24 Ca 0.28 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.39 2zw2 h GLU 24 Cb 0.17 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 2zw2 h GLU 24 CO -0.18 0.32 -0.17 1.15 -0.73 0.00 0.00 179.01 179.41 2zw2 h THR 25 N 0.50 1.30 -0.50 0.32 2.02 -0.74 -1.62 112.91 114.18 2zw2 h THR 25 Ca 0.16 -1.28 -0.01 0.00 0.77 0.00 0.00 66.41 66.04 2zw2 h THR 25 Cb -0.02 1.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.86 2zw2 h THR 25 CO -0.06 0.41 0.26 0.40 0.37 0.00 0.00 175.52 176.91 2zw2 h ILE 26 N 0.39 1.18 -0.37 3.11 2.04 -0.76 -1.63 117.51 121.47 2zw2 h ILE 26 Ca 0.06 -0.48 -0.01 0.00 1.00 0.00 0.00 64.86 65.43 2zw2 h ILE 26 Cb 0.70 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 2zw2 h ILE 26 CO 0.05 0.20 0.19 -0.61 0.00 0.00 0.00 178.15 177.97 2zw2 h GLN 27 N 0.67 0.53 -0.18 2.37 5.75 -1.17 0.54 115.11 123.62 2zw2 h GLN 27 Ca 0.18 -0.07 -0.02 0.00 -0.15 0.00 0.00 58.65 58.58 2zw2 h GLN 27 Cb 0.07 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.52 2zw2 h GLN 27 CO -0.03 0.46 0.02 -0.09 -2.65 0.00 0.00 178.83 176.54 2zw2 h ARG 28 N 0.47 0.30 0.00 1.69 2.43 -1.05 0.93 114.38 119.15 2zw2 h ARG 28 Ca 0.13 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2zw2 h ARG 28 Cb 0.10 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 2zw2 h ARG 28 CO -0.02 0.49 -1.70 0.66 -1.51 0.00 0.00 179.97 177.89 2zw2 n TYR 29 N -4.75 0.14 0.03 2.20 4.01 -0.64 -4.58 117.16 113.58 2zw2 n TYR 29 Ca -0.05 0.04 -0.01 0.00 -0.16 0.00 0.00 57.90 57.72 2zw2 n TYR 29 Cb 0.20 -0.50 -0.00 0.00 -0.31 0.00 0.00 39.34 38.73 2zw2 n TYR 29 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2zw2 n VAL 30 N -2.21 1.19 0.06 -0.72 0.31 -0.01 -4.67 118.33 112.28 2zw2 n VAL 30 Ca -0.02 0.35 -0.13 0.00 -0.01 0.00 0.00 64.34 64.53 2zw2 n VAL 30 Cb 0.53 -1.67 -0.08 0.00 -0.91 0.00 0.00 33.84 31.71 2zw2 n VAL 30 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2zw2 h VAL 31 N -0.12 1.04 -0.86 2.52 2.07 -1.08 -2.41 116.25 117.42 2zw2 h VAL 31 Ca -0.01 -0.54 0.16 0.00 0.82 0.00 0.00 66.70 67.14 2zw2 h VAL 31 Cb 0.19 1.38 -0.06 0.00 -1.52 0.00 0.00 31.29 31.28 2zw2 h VAL 31 CO -0.00 0.13 0.56 0.77 0.02 0.00 0.00 177.57 179.05 2zw2 h SER 32 N -0.38 0.50 0.18 0.57 4.64 -1.03 0.19 113.55 118.23 2zw2 h SER 32 Ca -0.01 0.04 -0.16 0.00 -0.47 0.00 0.00 61.79 61.18 2zw2 h SER 32 Cb 0.32 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 2zw2 h SER 32 CO 0.02 0.24 -0.62 0.03 -0.87 0.00 0.00 176.83 175.63 2zw2 h ARG 33 N 0.52 0.43 -0.02 4.77 2.47 -1.77 -3.33 114.38 117.45 2zw2 h ARG 33 Ca 0.44 -0.30 -0.17 0.00 -1.26 0.00 0.00 59.98 58.69 2zw2 h ARG 33 Cb 0.90 0.05 0.01 0.00 -1.65 0.00 0.00 29.97 29.28 2zw2 h ARG 33 CO -0.18 0.92 -0.64 0.35 0.56 0.00 0.00 179.97 180.98 2zw2 h PHE 34 N 0.31 0.69 -2.07 3.04 3.57 -0.50 -3.47 116.94 118.51 2zw2 h PHE 34 Ca -0.01 -0.36 0.00 0.00 3.53 0.00 0.00 57.97 61.14 2zw2 h PHE 34 Cb 1.17 -0.08 -0.22 0.00 2.79 0.00 0.00 35.95 39.61 2zw2 h PHE 34 CO 0.04 1.17 -0.01 0.45 -2.23 0.00 0.00 178.31 177.73 2zw2 s SER 35 N -6.81 -0.90 0.00 0.41 0.15 -0.41 -5.00 113.70 101.14 2zw2 s SER 35 Ca -0.13 1.45 0.19 0.00 0.70 0.00 0.00 55.95 58.17 2zw2 s SER 35 Cb 0.04 1.33 1.06 0.00 -1.71 0.00 0.00 66.02 66.74 2zw2 s SER 35 CO 0.84 -0.24 1.69 -0.90 1.20 0.00 0.00 173.24 175.83 2zw2 n ASP 36 N 4.26 0.22 0.02 5.45 5.68 -1.26 -2.83 116.55 128.09 2zw2 n ASP 36 Ca -0.20 -1.46 0.12 0.00 -0.50 0.00 0.00 54.79 52.75 2zw2 n ASP 36 Cb 0.58 -0.01 0.17 0.00 -1.14 0.00 0.00 41.12 40.72 2zw2 n ASP 36 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2zw2 n LYS 37 N -0.64 0.11 -3.40 0.11 5.02 -1.26 -4.60 118.16 113.49 2zw2 n LYS 37 Ca 0.14 0.02 -0.44 0.00 -2.02 0.00 0.00 58.31 56.00 2zw2 n LYS 37 Cb 0.10 -1.55 -0.08 0.00 -0.02 0.00 0.00 35.03 33.48 2zw2 n LYS 37 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2zw2 s ILE 38 N -3.07 5.16 -1.02 -0.18 1.01 -1.13 -4.94 121.20 117.03 2zw2 s ILE 38 Ca 0.09 -1.11 0.25 0.00 0.00 0.00 0.00 60.65 59.87 2zw2 s ILE 38 Cb 0.16 -4.10 -0.01 0.00 0.01 0.00 0.00 42.46 38.52 2zw2 s ILE 38 CO 0.74 -0.59 1.36 2.30 0.00 0.00 0.00 174.94 178.75 2zw2 n ILE 39 N 5.18 0.00 -3.57 2.92 -5.35 -1.26 -4.74 119.36 112.54 2zw2 n ILE 39 Ca -0.12 -0.00 -0.15 0.00 -0.27 0.00 0.00 62.75 62.20 2zw2 n ILE 39 Cb 0.43 0.33 -0.06 0.00 -1.74 0.00 0.00 39.64 38.60 2zw2 n ILE 39 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2zw2 s GLU 40 N -2.99 0.89 -0.06 6.28 2.12 -1.26 -5.13 118.70 118.55 2zw2 s GLU 40 Ca 0.11 0.47 0.01 0.00 0.36 0.00 0.00 54.97 55.92 2zw2 s GLU 40 Cb 0.17 0.43 0.02 0.00 0.26 0.00 0.00 34.13 35.01 2zw2 s GLU 40 CO 0.71 -0.23 -0.08 0.99 -0.54 0.00 0.00 175.26 176.12 2zw2 s THR 41 N -0.65 0.83 -0.05 -1.70 2.01 -1.26 -5.08 115.64 109.74 2zw2 s THR 41 Ca -0.06 -0.28 0.06 0.00 0.31 0.00 0.00 61.69 61.73 2zw2 s THR 41 Cb -0.02 -0.81 -0.01 0.00 0.01 0.00 0.00 72.50 71.67 2zw2 s THR 41 CO 0.05 0.30 -0.24 -0.13 -0.69 0.00 0.00 174.62 173.91 2zw2 s ARG 42 N 0.94 2.32 0.13 4.92 1.81 -1.26 -4.29 118.95 123.52 2zw2 s ARG 42 Ca -0.10 -0.86 0.08 0.00 -1.72 0.00 0.00 55.73 53.13 2zw2 s ARG 42 Cb -0.15 -2.02 -0.04 0.00 -0.45 0.00 0.00 34.95 32.29 2zw2 s ARG 42 CO 0.01 0.39 -0.12 0.00 -0.68 0.00 0.00 175.30 174.90 2zw2 s ALA 43 N -0.23 2.89 0.16 2.13 0.00 -1.26 -4.90 121.76 120.56 2zw2 s ALA 43 Ca -0.01 -1.34 -0.06 0.00 0.00 0.00 0.00 51.96 50.55 2zw2 s ALA 43 Cb -0.12 -0.79 0.03 0.00 0.00 0.00 0.00 23.12 22.23 2zw2 s ALA 43 CO 0.02 0.58 0.33 0.41 0.00 0.00 0.00 175.76 177.11 2zw2 n GLY 44 N 0.51 1.55 3.67 0.00 0.00 -1.26 -4.43 105.19 105.24 2zw2 n GLY 44 Ca -0.13 -1.11 -0.33 0.00 0.00 0.00 0.00 46.02 44.45 2zw2 n GLY 44 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2zw2 s LYS 45 N -2.04 2.77 -0.12 1.61 2.20 -0.20 -4.96 119.74 118.99 2zw2 s LYS 45 Ca 0.07 -0.62 0.03 0.00 -0.36 0.00 0.00 55.97 55.08 2zw2 s LYS 45 Cb -0.02 -2.66 0.01 0.00 -1.51 0.00 0.00 37.83 33.65 2zw2 s LYS 45 CO 0.05 0.62 -0.21 -0.47 -0.36 0.00 0.00 175.35 174.98 2zw2 s TYR 46 N -1.08 2.49 -0.04 4.03 5.04 -1.26 -1.17 117.35 125.37 2zw2 s TYR 46 Ca 0.19 -1.20 0.03 0.00 -2.44 0.00 0.00 57.07 53.65 2zw2 s TYR 46 Cb -0.11 -1.70 0.01 0.00 0.35 0.00 0.00 41.96 40.50 2zw2 s TYR 46 CO 0.10 -0.54 -0.11 -0.51 -1.34 0.00 0.00 175.55 173.15 2zw2 s LEU 47 N 0.75 1.73 -0.07 6.97 1.43 -0.50 -5.01 118.68 123.99 2zw2 s LEU 47 Ca -0.09 -0.23 0.04 0.00 -1.03 0.00 0.00 54.13 52.81 2zw2 s LEU 47 Cb -0.16 -0.66 0.00 0.00 0.03 0.00 0.00 46.19 45.40 2zw2 s LEU 47 CO 0.00 0.06 -0.18 0.54 0.23 0.00 0.00 176.35 177.00 2zw2 s VAL 48 N 0.34 1.56 0.17 -1.59 0.11 -1.26 -0.04 120.40 119.69 2zw2 s VAL 48 Ca -0.06 -0.75 0.11 0.00 -2.93 0.00 0.00 61.98 58.35 2zw2 s VAL 48 Cb -0.11 -1.37 -0.04 0.00 -1.53 0.00 0.00 36.38 33.33 2zw2 s VAL 48 CO 0.01 0.45 -0.23 -0.36 -3.33 0.00 0.00 175.10 171.64 2zw2 s PHE 49 N 0.36 2.34 -0.22 1.54 0.08 0.65 -4.96 117.98 117.77 2zw2 s PHE 49 Ca -0.13 -0.35 -0.06 0.00 0.12 0.00 0.00 56.93 56.52 2zw2 s PHE 49 Cb -0.15 -1.19 -0.02 0.00 -0.57 0.00 0.00 43.02 41.08 2zw2 s PHE 49 CO 0.05 0.46 0.02 1.03 -0.10 0.00 0.00 175.22 176.67 2zw2 s ARG 50 N -2.50 3.59 -0.07 0.44 0.52 -1.26 -0.44 118.95 119.24 2zw2 s ARG 50 Ca 0.19 -0.52 0.03 0.00 -0.52 0.00 0.00 55.73 54.91 2zw2 s ARG 50 Cb -0.09 -3.14 0.01 0.00 0.52 0.00 0.00 34.95 32.25 2zw2 s ARG 50 CO 0.09 -0.08 -0.16 0.08 0.02 0.00 0.00 175.30 175.26 2zw2 s VAL 51 N 1.25 1.38 -0.04 3.52 1.01 0.11 -4.96 120.40 122.68 2zw2 s VAL 51 Ca 0.04 -0.64 -0.24 0.00 0.00 0.00 0.00 61.98 61.14 2zw2 s VAL 51 Cb -0.15 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 2zw2 s VAL 51 CO 0.01 0.41 0.74 0.20 0.00 0.00 0.00 175.10 176.46 2zw2 s ASN 52 N 0.44 7.06 0.27 3.32 0.01 -1.26 -0.27 114.94 124.51 2zw2 s ASN 52 Ca -0.13 1.27 -0.21 0.00 -0.71 0.00 0.00 52.86 53.09 2zw2 s ASN 52 Cb -0.15 -2.43 0.02 0.00 0.41 0.00 0.00 41.25 39.10 2zw2 s ASN 52 CO 0.04 -0.11 0.72 -0.55 -1.51 0.00 0.00 177.10 175.70 2zw2 s SER 53 N 0.67 -0.27 0.00 -1.22 0.15 -0.76 -4.93 113.70 107.35 2zw2 s SER 53 Ca 0.39 -0.59 0.22 0.00 0.70 0.00 0.00 55.95 56.67 2zw2 s SER 53 Cb -0.18 0.72 -0.06 0.00 -1.71 0.00 0.00 66.02 64.79 2zw2 s SER 53 CO 0.20 -1.33 1.02 -1.54 1.20 0.00 0.00 173.24 172.79 2zw2 n SER 54 N -0.46 1.02 -3.70 5.45 3.41 -1.26 -4.42 113.62 113.66 2zw2 n SER 54 Ca -0.04 -0.92 -0.08 0.00 -0.26 0.00 0.00 58.87 57.56 2zw2 n SER 54 Cb 0.59 0.80 -0.02 0.00 -0.26 0.00 0.00 64.21 65.32 2zw2 n SER 54 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2zw2 s SER 55 N -2.93 -0.33 0.23 4.04 1.04 -1.26 -5.02 113.70 109.46 2zw2 s SER 55 Ca 0.10 -0.38 -0.01 0.00 0.48 0.00 0.00 55.95 56.15 2zw2 s SER 55 Cb 0.17 0.63 0.25 0.00 0.10 0.00 0.00 66.02 67.17 2zw2 s SER 55 CO 0.80 -1.13 1.61 -0.61 0.98 0.00 0.00 173.24 174.89 2zw2 h GLN 56 N 2.00 0.54 -0.03 4.02 4.15 -2.00 -2.45 115.11 121.34 2zw2 h GLN 56 Ca -0.24 -0.26 -0.00 0.00 0.77 0.00 0.00 58.65 58.91 2zw2 h GLN 56 Cb 1.26 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.95 2zw2 h GLN 56 CO 0.28 0.84 0.01 0.37 -1.93 0.00 0.00 178.83 178.40 2zw2 h GLN 57 N 0.45 0.05 -0.90 1.69 4.15 -1.99 -1.95 115.11 116.60 2zw2 h GLN 57 Ca 0.04 -0.01 0.05 0.00 0.77 0.00 0.00 58.65 59.50 2zw2 h GLN 57 Cb 0.87 -0.01 -0.06 0.00 0.21 0.00 0.00 27.48 28.50 2zw2 h GLN 57 CO 0.07 0.20 0.57 1.49 -1.93 0.00 0.00 178.83 179.24 2zw2 h GLU 58 N -0.12 1.05 -0.19 1.69 4.81 -1.93 -1.00 114.58 118.89 2zw2 h GLU 58 Ca 0.01 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.16 2zw2 h GLU 58 Cb 0.17 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 2zw2 h GLU 58 CO -0.00 0.69 0.04 0.00 -0.73 0.00 0.00 179.01 179.02 2zw2 h ALA 59 N 1.39 0.25 -0.36 2.92 0.00 -1.28 -1.93 119.26 120.26 2zw2 h ALA 59 Ca 0.37 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 55.02 2zw2 h ALA 59 Cb 0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2zw2 h ALA 59 CO -0.14 -0.10 -0.20 1.79 0.00 0.00 0.00 179.25 180.60 2zw2 h THR 60 N 0.12 1.29 -0.08 0.00 1.35 -1.11 -2.45 112.91 112.02 2zw2 h THR 60 Ca 0.06 -1.33 -0.07 0.00 -0.55 0.00 0.00 66.41 64.52 2zw2 h THR 60 Cb 0.28 1.37 -0.01 0.00 -1.73 0.00 0.00 68.15 68.06 2zw2 h THR 60 CO 0.00 0.44 -0.26 -0.33 -0.25 0.00 0.00 175.52 175.12 2zw2 h GLU 61 N 0.55 0.14 -0.59 4.72 5.08 -1.21 -0.48 114.58 122.80 2zw2 h GLU 61 Ca 0.08 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.31 2zw2 h GLU 61 Cb 0.75 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 2zw2 h GLU 61 CO 0.06 0.40 0.03 1.25 -1.00 0.00 0.00 179.01 179.75 2zw2 h LEU 62 N 0.13 0.99 -0.53 1.33 5.85 -1.16 0.52 115.31 122.45 2zw2 h LEU 62 Ca 0.02 -0.29 -0.16 0.00 0.84 0.00 0.00 57.88 58.28 2zw2 h LEU 62 Cb 0.54 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 2zw2 h LEU 62 CO 0.04 1.04 -0.65 0.58 -0.34 0.00 0.00 178.44 179.11 2zw2 h VAL 63 N 0.92 1.38 -0.28 1.05 2.07 -0.99 -1.12 116.25 119.26 2zw2 h VAL 63 Ca 0.17 -2.02 -0.01 0.00 0.82 0.00 0.00 66.70 65.66 2zw2 h VAL 63 Cb 0.51 2.01 -0.01 0.00 -1.52 0.00 0.00 31.29 32.28 2zw2 h VAL 63 CO 0.02 0.61 0.15 0.50 0.02 0.00 0.00 177.57 178.87 2zw2 h LYS 64 N 0.25 0.40 -0.58 1.57 1.63 -0.74 -0.23 116.57 118.87 2zw2 h LYS 64 Ca -0.01 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.73 2zw2 h LYS 64 Cb 1.19 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 32.71 2zw2 h LYS 64 CO 0.11 0.35 0.34 -0.22 -3.45 0.00 0.00 179.45 176.58 2zw2 h LYS 65 N 0.34 0.80 -0.01 1.90 3.64 -0.73 -1.18 116.57 121.33 2zw2 h LYS 65 Ca 0.10 -0.08 0.03 0.00 -1.27 0.00 0.00 60.65 59.43 2zw2 h LYS 65 Cb 0.07 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 31.69 2zw2 h LYS 65 CO -0.02 0.58 -0.17 1.25 -2.27 0.00 0.00 179.45 178.83 2zw2 h LEU 66 N 0.79 -0.50 -0.88 5.20 5.85 -0.81 0.24 115.31 125.20 2zw2 h LEU 66 Ca 0.21 0.07 0.08 0.00 0.84 0.00 0.00 57.88 59.08 2zw2 h LEU 66 Cb -0.00 0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.17 2zw2 h LEU 66 CO -0.04 -0.23 0.54 0.00 -0.34 0.00 0.00 178.44 178.37 2zw2 h ALA 67 N 0.66 1.25 0.34 1.25 0.00 -0.68 -0.46 119.26 121.62 2zw2 h ALA 67 Ca 0.06 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2zw2 h ALA 67 Cb 0.35 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2zw2 h ALA 67 CO -0.17 0.22 -0.16 -0.44 0.00 0.00 0.00 179.25 178.70 2zw2 h ASP 68 N 0.93 -0.39 -0.66 0.00 3.32 -0.65 -1.77 116.42 117.20 2zw2 h ASP 68 Ca 0.41 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.47 2zw2 h ASP 68 Cb 0.29 0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 2zw2 h ASP 68 CO -0.21 -0.04 0.41 -0.33 -1.72 0.00 0.00 179.24 177.34 2zw2 h GLU 69 N -0.94 0.90 -0.62 3.56 5.08 -0.53 -2.75 114.58 119.28 2zw2 h GLU 69 Ca -0.05 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 2zw2 h GLU 69 Cb 0.35 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.41 2zw2 h GLU 69 CO 0.08 0.63 0.00 -1.33 -1.00 0.00 0.00 179.01 177.39 2zw2 n MET 70 N -4.40 2.77 -3.76 2.33 2.81 -0.19 -4.97 117.12 111.71 2zw2 n MET 70 Ca 0.07 -2.28 -0.23 0.00 -1.81 0.00 0.00 57.70 53.44 2zw2 n MET 70 Cb 0.07 -1.60 0.02 0.00 -0.71 0.00 0.00 33.22 30.99 2zw2 n MET 70 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2zw2 n ARG 71 N 1.15 -4.11 0.01 0.03 5.12 -1.04 -4.87 116.66 112.95 2zw2 n ARG 71 Ca 0.21 0.55 0.12 0.00 -1.93 0.00 0.00 57.85 56.80 2zw2 n ARG 71 Cb 0.62 -4.93 0.51 0.00 -1.16 0.00 0.00 32.46 27.50 2zw2 n ARG 71 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2zw2 n LEU 72 N -4.28 0.08 -3.70 0.55 4.77 -0.68 -4.82 117.00 108.92 2zw2 n LEU 72 Ca -0.28 0.51 -0.10 0.00 -0.03 0.00 0.00 56.01 56.11 2zw2 n LEU 72 Cb 0.67 -0.49 -0.03 0.00 -2.33 0.00 0.00 43.42 41.24 2zw2 n LEU 72 CO 0.70 -0.11 0.32 -0.72 -1.33 0.00 0.00 177.39 176.25 2zw2 s TYR 73 N -3.02 -0.19 -0.34 -1.77 -0.85 -1.25 -5.07 117.35 104.85 2zw2 s TYR 73 Ca 0.11 -0.14 -0.04 0.00 -0.52 0.00 0.00 57.07 56.48 2zw2 s TYR 73 Cb 0.15 0.46 0.06 0.00 0.38 0.00 0.00 41.96 43.02 2zw2 s TYR 73 CO 0.45 -0.95 0.09 1.21 -1.52 0.00 0.00 175.55 174.83 2zw2 s ASN 74 N -2.86 5.16 0.66 -0.18 3.84 -1.26 -4.93 114.94 115.37 2zw2 s ASN 74 Ca 0.08 -1.40 0.33 0.00 0.21 0.00 0.00 52.86 52.08 2zw2 s ASN 74 Cb -0.02 -1.81 1.78 0.00 -0.55 0.00 0.00 41.25 40.65 2zw2 s ASN 74 CO -0.03 -0.36 2.00 1.55 -2.79 0.00 0.00 177.10 177.47 2zw2 h PRO 75 N 8.11 0.00 0.00 0.43 0.13 -1.99 0.56 132.00 139.24 2zw2 h PRO 75 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 2zw2 h PRO 75 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2zw2 h PRO 75 CO 0.60 0.00 -0.25 0.82 -0.23 0.00 0.00 178.00 178.94 2zw2 h ILE 76 N 0.00 0.00 0.00 -3.56 2.04 -2.03 -3.38 117.51 110.58 2zw2 h ILE 76 Ca 0.00 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 65.02 2zw2 h ILE 76 Cb 0.53 1.70 0.00 0.00 -0.74 0.00 0.00 36.82 38.31 2zw2 h ILE 76 CO 0.00 0.00 -0.46 1.33 0.00 0.00 0.00 178.15 179.02 2zw2 n VAL 77 N -2.75 0.00 -4.31 1.67 0.24 -0.44 -5.00 118.33 107.74 2zw2 n VAL 77 Ca 0.03 -0.07 -0.27 0.00 -2.04 0.00 0.00 64.34 61.99 2zw2 n VAL 77 Cb 0.50 0.47 -0.10 0.00 -1.47 0.00 0.00 33.84 33.24 2zw2 n VAL 77 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 2zw2 s HIS 78 N -1.08 2.56 0.14 6.34 3.76 0.18 -1.01 115.29 126.19 2zw2 s HIS 78 Ca 0.00 -0.25 0.09 0.00 -0.15 0.00 0.00 55.06 54.75 2zw2 s HIS 78 Cb 0.00 -1.28 -0.04 0.00 1.11 0.00 0.00 32.58 32.37 2zw2 s HIS 78 CO 0.00 0.48 -0.13 0.15 -0.85 0.00 0.00 174.74 174.39 2zw2 s LYS 79 N -2.63 1.96 0.04 1.40 1.02 0.11 -4.44 119.74 117.20 2zw2 s LYS 79 Ca 0.23 -1.19 0.03 0.00 0.02 0.00 0.00 55.97 55.05 2zw2 s LYS 79 Cb -0.09 -2.16 -0.02 0.00 -0.52 0.00 0.00 37.83 35.03 2zw2 s LYS 79 CO 0.13 0.47 -0.10 0.96 -0.92 0.00 0.00 175.35 175.89 2zw2 s ILE 80 N -1.40 0.77 -0.06 2.17 -4.36 -1.26 -1.44 121.20 115.61 2zw2 s ILE 80 Ca 0.22 -0.97 0.02 0.00 -0.26 0.00 0.00 60.65 59.66 2zw2 s ILE 80 Cb -0.10 -0.75 0.02 0.00 1.25 0.00 0.00 42.46 42.87 2zw2 s ILE 80 CO 0.13 -0.18 -0.11 -0.70 0.24 0.00 0.00 174.94 174.33 2zw2 s GLU 81 N -1.27 1.54 -0.10 0.37 2.12 -0.13 -4.98 118.70 116.25 2zw2 s GLU 81 Ca -0.04 -0.35 0.03 0.00 0.36 0.00 0.00 54.97 54.97 2zw2 s GLU 81 Cb -0.08 -1.31 -0.01 0.00 0.26 0.00 0.00 34.13 33.00 2zw2 s GLU 81 CO 0.01 -0.00 -0.21 0.42 -0.54 0.00 0.00 175.26 174.94 2zw2 s ILE 82 N 0.74 2.34 -0.01 -3.70 1.01 -1.26 -0.79 121.20 119.54 2zw2 s ILE 82 Ca -0.13 -0.93 0.05 0.00 0.00 0.00 0.00 60.65 59.64 2zw2 s ILE 82 Cb -0.15 -1.91 -0.01 0.00 0.01 0.00 0.00 42.46 40.39 2zw2 s ILE 82 CO 0.03 0.55 -0.17 -0.13 0.00 0.00 0.00 174.94 175.22 2zw2 s ARG 83 N 0.24 1.35 0.02 2.79 0.52 -0.67 -4.98 118.95 118.21 2zw2 s ARG 83 Ca -0.14 -0.64 -0.00 0.00 -0.52 0.00 0.00 55.73 54.43 2zw2 s ARG 83 Cb -0.17 -1.32 -0.02 0.00 0.52 0.00 0.00 34.95 33.96 2zw2 s ARG 83 CO 0.07 0.36 -0.02 0.00 0.02 0.00 0.00 175.30 175.73 2zw2 s ALA 84 N -0.45 0.08 -0.12 2.13 0.00 -1.26 0.16 121.76 122.30 2zw2 s ALA 84 Ca 0.06 -0.47 -0.09 0.00 0.00 0.00 0.00 51.96 51.46 2zw2 s ALA 84 Cb -0.07 0.12 0.04 0.00 0.00 0.00 0.00 23.12 23.21 2zw2 s ALA 84 CO -0.00 -0.13 0.31 0.54 0.00 0.00 0.00 175.76 176.47 2zw2 s ASN 85 N -1.20 -0.34 0.38 0.00 4.22 -0.61 -4.98 114.94 112.41 2zw2 s ASN 85 Ca -0.13 0.64 -0.26 0.00 -2.14 0.00 0.00 52.86 50.97 2zw2 s ASN 85 Cb -0.08 0.60 -0.09 0.00 1.28 0.00 0.00 41.25 42.96 2zw2 s ASN 85 CO -0.01 -0.13 1.14 -0.60 -2.04 0.00 0.00 177.10 175.47 2zw2 s ARG 86 N 0.58 4.15 0.22 3.55 3.52 -1.26 -0.73 118.95 128.99 2zw2 s ARG 86 Ca -0.03 1.79 0.03 0.00 -0.13 0.00 0.00 55.73 57.38 2zw2 s ARG 86 Cb -0.05 -2.73 -0.01 0.00 -1.56 0.00 0.00 34.95 30.60 2zw2 s ARG 86 CO -0.03 -0.22 0.10 0.44 -0.81 0.00 0.00 175.30 174.77 2zw2 n ILE 87 N 0.21 0.00 -0.28 4.11 -5.35 -0.39 -4.87 119.36 112.79 2zw2 n ILE 87 Ca 0.04 -1.35 0.00 0.00 -0.27 0.00 0.00 62.75 61.17 2zw2 n ILE 87 Cb 0.47 0.52 0.00 0.00 -1.74 0.00 0.00 39.64 38.88 2zw2 n ILE 87 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17