#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1itp n SER 2 N 0.00 0.00 -2.13 1.61 7.64 -1.26 -4.70 113.62 114.78 1itp n SER 2 Ca 0.00 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.66 1itp n SER 2 Cb 0.00 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.22 1itp n SER 2 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1itp n ALA 3 N -3.00 5.66 0.00 -0.43 0.00 -0.96 -4.97 120.51 116.81 1itp n ALA 3 Ca 0.00 -2.29 0.00 0.00 0.00 0.00 0.00 53.44 51.15 1itp n ALA 3 Cb 0.00 -1.64 0.00 0.00 0.00 0.00 0.00 19.45 17.81 1itp n ALA 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1itp n GLY 4 N 0.34 -1.86 3.83 0.00 0.00 -1.26 -3.79 105.19 102.45 1itp n GLY 4 Ca 0.39 -1.88 -0.26 0.00 0.00 0.00 0.00 46.02 44.28 1itp n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1itp s LYS 5 N -0.03 3.01 0.17 1.61 1.02 -1.26 -2.50 119.74 121.75 1itp s LYS 5 Ca 0.00 -0.83 0.00 0.00 0.02 0.00 0.00 55.97 55.17 1itp s LYS 5 Cb 0.00 -2.70 -0.04 0.00 -0.52 0.00 0.00 37.83 34.56 1itp s LYS 5 CO 0.00 0.49 0.04 -0.06 -0.92 0.00 0.00 175.35 174.90 1itp s PHE 6 N -1.77 1.11 -0.31 3.18 0.40 0.45 -2.12 117.98 118.92 1itp s PHE 6 Ca 0.32 -1.15 -0.02 0.00 -0.60 0.00 0.00 56.93 55.48 1itp s PHE 6 Cb -0.10 -0.63 0.12 0.00 0.51 0.00 0.00 43.02 42.92 1itp s PHE 6 CO 0.24 -0.37 0.17 0.42 0.70 0.00 0.00 175.22 176.38 1itp s ILE 7 N -3.85 -0.03 0.30 0.64 1.01 -0.92 -2.50 121.20 115.86 1itp s ILE 7 Ca 0.27 -1.06 0.07 0.00 0.00 0.00 0.00 60.65 59.93 1itp s ILE 7 Cb 0.07 -1.02 -0.03 0.00 0.01 0.00 0.00 42.46 41.49 1itp s ILE 7 CO 0.05 -0.80 0.26 0.68 0.00 0.00 0.00 174.94 175.12 1itp s VAL 8 N 1.76 3.91 0.32 2.92 -7.23 -1.16 -0.14 120.40 120.77 1itp s VAL 8 Ca 0.12 -1.38 0.05 0.00 -1.81 0.00 0.00 61.98 58.96 1itp s VAL 8 Cb -0.18 -3.27 -0.03 0.00 0.56 0.00 0.00 36.38 33.45 1itp s VAL 8 CO -0.23 -0.25 0.21 -0.63 -0.31 0.00 0.00 175.10 173.89 1itp s ILE 9 N -2.23 0.16 0.01 -0.62 1.09 0.59 -2.12 121.20 118.08 1itp s ILE 9 Ca 0.38 -2.00 0.02 0.00 -1.10 0.00 0.00 60.65 57.94 1itp s ILE 9 Cb -0.07 -2.48 -0.01 0.00 -1.06 0.00 0.00 42.46 38.84 1itp s ILE 9 CO 0.26 0.00 -0.06 -0.36 -0.10 0.00 0.00 174.94 174.68 1itp s PHE 10 N -3.55 0.50 1.02 3.97 0.08 -0.15 -2.28 117.98 117.56 1itp s PHE 10 Ca 0.37 -0.22 -0.14 0.00 0.12 0.00 0.00 56.93 57.06 1itp s PHE 10 Cb 0.04 -0.31 0.18 0.00 -0.57 0.00 0.00 43.02 42.36 1itp s PHE 10 CO 0.21 -0.03 0.36 0.36 -0.10 0.00 0.00 175.22 176.02 1itp n LYS 11 N 2.48 -2.40 -1.01 0.44 2.85 -1.10 -4.52 118.16 114.89 1itp n LYS 11 Ca -0.16 -0.71 -0.22 0.00 -1.05 0.00 0.00 58.31 56.17 1itp n LYS 11 Cb 0.57 -1.49 0.10 0.00 -0.65 0.00 0.00 35.03 33.56 1itp n LYS 11 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1itp n ASN 12 N -1.46 5.19 0.00 -5.58 2.85 -1.26 -3.95 115.26 111.05 1itp n ASN 12 Ca 0.06 -3.31 0.00 0.00 -0.11 0.00 0.00 54.58 51.22 1itp n ASN 12 Cb 0.35 -0.88 0.00 0.00 1.24 0.00 0.00 39.78 40.50 1itp n ASN 12 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1itp n ASP 13 N -0.54 2.12 -3.84 1.20 2.03 -1.26 -5.07 116.55 111.18 1itp n ASP 13 Ca 0.46 0.00 -0.35 0.00 0.52 0.00 0.00 54.79 55.42 1itp n ASP 13 Cb 1.03 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 41.45 1itp n ASP 13 CO 0.00 0.00 0.00 0.55 -1.92 0.00 0.00 177.20 175.83 1itp n VAL 14 N -2.45 0.00 -2.51 5.18 3.14 -1.25 -4.94 118.33 115.49 1itp n VAL 14 Ca 0.00 -0.46 -0.24 0.00 -2.96 0.00 0.00 64.34 60.69 1itp n VAL 14 Cb 0.38 0.00 0.09 0.00 -1.06 0.00 0.00 33.84 33.25 1itp n VAL 14 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1itp s SER 15 N -0.92 4.53 -0.08 6.55 1.04 -1.26 -4.98 113.70 118.59 1itp s SER 15 Ca 0.49 -0.15 -0.22 0.00 0.48 0.00 0.00 55.95 56.55 1itp s SER 15 Cb -0.40 -0.35 -0.18 0.00 0.10 0.00 0.00 66.02 65.20 1itp s SER 15 CO 0.64 -1.72 0.81 -0.08 0.98 0.00 0.00 173.24 173.86 1itp h GLU 16 N -0.47 -0.10 -0.75 4.02 4.57 -2.00 -2.53 114.58 117.33 1itp h GLU 16 Ca -0.39 0.01 0.05 0.00 -1.18 0.00 0.00 59.36 57.84 1itp h GLU 16 Cb 1.28 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.85 1itp h GLU 16 CO 0.45 0.46 0.49 -0.44 -1.18 0.00 0.00 179.01 178.79 1itp h ASP 17 N -0.86 0.74 -0.36 1.04 3.32 -1.99 -1.03 116.42 117.28 1itp h ASP 17 Ca -0.01 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1itp h ASP 17 Cb 0.60 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1itp h ASP 17 CO 0.02 0.50 0.22 0.11 -1.72 0.00 0.00 179.24 178.36 1itp h LYS 18 N 0.86 0.49 0.36 3.56 6.56 -1.96 0.20 116.57 126.64 1itp h LYS 18 Ca 0.31 -0.04 -0.00 0.00 -1.06 0.00 0.00 60.65 59.85 1itp h LYS 18 Cb 0.15 -0.10 -0.03 0.00 -0.57 0.00 0.00 32.23 31.67 1itp h LYS 18 CO -0.10 0.37 -0.44 0.82 -2.06 0.00 0.00 179.45 178.04 1itp h ILE 19 N 0.47 0.12 -0.37 1.86 2.04 -0.76 0.37 117.51 121.25 1itp h ILE 19 Ca 0.13 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.08 1itp h ILE 19 Cb 0.00 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.19 1itp h ILE 19 CO -0.02 0.00 0.26 0.03 0.00 0.00 0.00 178.15 178.41 1itp h ARG 20 N -0.84 0.07 0.21 2.37 3.08 -1.18 -2.36 114.38 115.73 1itp h ARG 20 Ca -0.03 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1itp h ARG 20 Cb 0.77 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.80 1itp h ARG 20 CO -0.11 0.05 -0.10 0.93 -1.07 0.00 0.00 179.97 179.67 1itp h GLU 21 N 0.08 -0.27 -0.96 0.04 5.08 0.10 -1.80 114.58 116.84 1itp h GLU 21 Ca 0.17 0.02 0.37 0.00 -1.00 0.00 0.00 59.36 58.92 1itp h GLU 21 Cb 0.59 0.06 -0.17 0.00 0.50 0.00 0.00 28.75 29.73 1itp h GLU 21 CO -0.01 -0.18 0.41 2.41 -1.00 0.00 0.00 179.01 180.63 1itp n THR 22 N -3.13 -0.40 0.21 1.13 -1.04 0.11 0.12 114.28 111.28 1itp n THR 22 Ca -0.04 1.98 -0.15 0.00 -2.04 0.00 0.00 64.05 63.81 1itp n THR 22 Cb 0.11 -3.15 -0.08 0.00 -1.82 0.00 0.00 70.33 65.39 1itp n THR 22 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1itp h LYS 23 N 0.00 -0.48 -0.98 -2.82 6.56 -1.41 -2.16 116.57 115.27 1itp h LYS 23 Ca 0.76 0.03 0.06 0.00 -1.06 0.00 0.00 60.65 60.45 1itp h LYS 23 Cb 1.95 0.11 -0.06 0.00 -0.57 0.00 0.00 32.23 33.66 1itp h LYS 23 CO -0.77 -0.24 0.64 -0.44 -2.06 0.00 0.00 179.45 176.57 1itp h ASP 24 N -0.65 1.02 -0.92 0.86 5.19 0.18 0.17 116.42 122.27 1itp h ASP 24 Ca -0.05 0.01 0.14 0.00 -0.62 0.00 0.00 57.03 56.50 1itp h ASP 24 Cb 0.47 -0.21 -0.09 0.00 0.18 0.00 0.00 39.33 39.68 1itp h ASP 24 CO 0.08 0.65 0.54 -0.08 -3.12 0.00 0.00 179.24 177.31 1itp h GLU 25 N 1.15 0.77 0.02 3.56 4.57 0.79 0.26 114.58 125.70 1itp h GLU 25 Ca 0.42 -0.05 -0.19 0.00 -1.18 0.00 0.00 59.36 58.36 1itp h GLU 25 Cb 0.16 -0.17 0.02 0.00 -0.16 0.00 0.00 28.75 28.59 1itp h GLU 25 CO -0.16 0.51 -0.77 -0.24 -1.18 0.00 0.00 179.01 177.17 1itp h VAL 26 N 0.80 1.39 -0.92 0.32 3.04 -0.48 0.15 116.25 120.55 1itp h VAL 26 Ca 0.48 -2.17 0.16 0.00 -1.01 0.00 0.00 66.70 64.16 1itp h VAL 26 Cb 0.60 2.59 -0.10 0.00 -2.01 0.00 0.00 31.29 32.37 1itp h VAL 26 CO -0.32 0.64 0.51 0.40 -1.01 0.00 0.00 177.57 177.80 1itp h ILE 27 N 0.02 0.75 0.26 3.17 1.08 0.51 1.08 117.51 124.38 1itp h ILE 27 Ca -0.10 -0.24 -0.34 0.00 -0.39 0.00 0.00 64.86 63.79 1itp h ILE 27 Cb 1.47 -0.03 0.04 0.00 -3.07 0.00 0.00 36.82 35.23 1itp h ILE 27 CO 0.15 0.13 -1.48 0.00 -0.69 0.00 0.00 178.15 176.26 1itp h ALA 28 N 1.58 -0.16 0.34 1.87 0.00 -0.54 -3.37 119.26 118.97 1itp h ALA 28 Ca 0.50 -0.86 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 1itp h ALA 28 Cb 0.71 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1itp h ALA 28 CO -0.36 0.69 -0.17 1.49 0.00 0.00 0.00 179.25 180.91 1itp h GLU 29 N 0.14 -0.44 0.00 0.00 4.57 0.92 -3.48 114.58 116.28 1itp h GLU 29 Ca -0.26 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.95 1itp h GLU 29 Cb 2.17 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 30.86 1itp h GLU 29 CO 0.28 -0.29 0.00 0.41 -1.18 0.00 0.00 179.01 178.22 1itp n GLY 30 N -1.23 -1.83 3.07 1.92 0.00 0.36 -5.05 105.19 102.43 1itp n GLY 30 Ca -0.06 0.54 -0.37 0.00 0.00 0.00 0.00 46.02 46.14 1itp n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1itp n GLY 31 N -1.39 -3.32 3.22 -0.02 0.00 -1.08 -4.73 105.19 97.88 1itp n GLY 31 Ca 0.00 -0.46 -0.23 0.00 0.00 0.00 0.00 46.02 45.33 1itp n GLY 31 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1itp n THR 32 N -3.37 0.00 -4.05 2.61 -1.04 0.21 -3.16 114.28 105.47 1itp n THR 32 Ca -0.01 -2.34 -0.18 0.00 -2.04 0.00 0.00 64.05 59.48 1itp n THR 32 Cb 0.67 0.95 -0.16 0.00 -1.82 0.00 0.00 70.33 69.96 1itp n THR 32 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1itp s ILE 33 N -3.14 0.36 -0.09 12.58 -1.09 -1.26 -1.65 121.20 126.91 1itp s ILE 33 Ca 0.26 -0.02 0.07 0.00 -2.23 0.00 0.00 60.65 58.73 1itp s ILE 33 Cb 0.01 -0.42 -0.11 0.00 -1.58 0.00 0.00 42.46 40.36 1itp s ILE 33 CO 0.19 0.19 0.02 0.35 -1.23 0.00 0.00 174.94 174.45 1itp n THR 34 N 4.08 0.63 -3.77 2.92 -2.24 -1.01 -4.90 114.28 109.99 1itp n THR 34 Ca -0.26 -0.38 -0.10 0.00 -2.27 0.00 0.00 64.05 61.05 1itp n THR 34 Cb 0.51 -0.77 -0.06 0.00 -2.10 0.00 0.00 70.33 67.91 1itp n THR 34 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1itp s ASN 35 N -4.23 -0.09 0.22 3.42 -0.87 0.65 -5.01 114.94 109.03 1itp s ASN 35 Ca -0.06 -0.54 0.02 0.00 -1.57 0.00 0.00 52.86 50.71 1itp s ASN 35 Cb 0.03 0.45 -0.05 0.00 -0.02 0.00 0.00 41.25 41.66 1itp s ASN 35 CO 0.37 -0.86 0.05 -1.83 -2.57 0.00 0.00 177.10 172.26 1itp s GLU 36 N -3.86 1.29 -0.40 -0.60 1.03 -1.26 -0.29 118.70 114.61 1itp s GLU 36 Ca 0.07 -1.67 0.02 0.00 0.03 0.00 0.00 54.97 53.43 1itp s GLU 36 Cb 0.02 -0.30 0.12 0.00 -0.80 0.00 0.00 34.13 33.17 1itp s GLU 36 CO -0.08 -0.21 0.16 0.71 -1.33 0.00 0.00 175.26 174.51 1itp s TYR 37 N -3.68 2.61 -1.12 4.83 2.02 0.12 -4.82 117.35 117.32 1itp s TYR 37 Ca 0.32 -2.56 -0.07 0.00 -0.37 0.00 0.00 57.07 54.38 1itp s TYR 37 Cb 0.07 -2.30 0.28 0.00 -0.40 0.00 0.00 41.96 39.61 1itp s TYR 37 CO 0.09 -0.84 1.29 0.27 -1.57 0.00 0.00 175.55 174.80 1itp n ASN 38 N 3.95 5.83 -4.62 2.29 0.23 -1.26 -2.45 115.26 119.23 1itp n ASN 38 Ca 0.04 -3.18 -0.26 0.00 -0.53 0.00 0.00 54.58 50.65 1itp n ASN 38 Cb 0.38 -1.35 -0.08 0.00 -2.08 0.00 0.00 39.78 36.64 1itp n ASN 38 CO 0.00 0.00 0.00 -0.04 -0.93 0.00 0.00 177.26 176.29 1itp s MET 39 N -1.65 2.24 0.46 -3.83 -1.94 0.01 -5.02 119.30 109.56 1itp s MET 39 Ca 0.32 -1.23 0.26 0.00 -1.71 0.00 0.00 55.69 53.32 1itp s MET 39 Cb -0.04 -2.24 0.76 0.00 2.01 0.00 0.00 34.83 35.33 1itp s MET 39 CO -0.01 0.43 1.76 -1.00 -0.01 0.00 0.00 175.02 176.19 1itp h PRO 40 N 2.65 0.00 0.00 2.03 0.13 -2.04 -3.15 132.00 131.62 1itp h PRO 40 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1itp h PRO 40 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1itp h PRO 40 CO 0.57 0.11 -1.12 0.41 -0.23 0.00 0.00 178.00 177.74 1itp n GLY 41 N 0.56 -0.42 2.87 1.56 0.00 -1.26 -4.96 105.19 103.54 1itp n GLY 41 Ca 0.02 -0.34 -0.17 0.00 0.00 0.00 0.00 46.02 45.52 1itp n GLY 41 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1itp s MET 42 N -2.58 0.46 -0.43 1.61 -2.45 -1.19 -5.10 119.30 109.62 1itp s MET 42 Ca -0.00 -0.03 0.02 0.00 -1.25 0.00 0.00 55.69 54.43 1itp s MET 42 Cb 0.09 -0.55 0.14 0.00 1.25 0.00 0.00 34.83 35.76 1itp s MET 42 CO 0.54 -0.06 0.24 0.21 1.05 0.00 0.00 175.02 177.00 1itp s LYS 43 N 0.72 1.23 0.00 4.11 2.47 -1.26 -0.81 119.74 126.21 1itp s LYS 43 Ca -0.08 -1.96 0.00 0.00 -1.56 0.00 0.00 55.97 52.37 1itp s LYS 43 Cb -0.11 -2.26 0.00 0.00 -1.46 0.00 0.00 37.83 34.00 1itp s LYS 43 CO -0.01 -1.17 0.00 0.41 0.16 0.00 0.00 175.35 174.75 1itp n GLY 44 N 3.58 3.19 3.54 5.54 0.00 -1.03 -0.98 105.19 119.03 1itp n GLY 44 Ca 0.09 -1.25 -0.09 0.00 0.00 0.00 0.00 46.02 44.76 1itp n GLY 44 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1itp s PHE 45 N -4.90 0.15 -0.00 1.61 -0.12 -0.90 0.16 117.98 113.97 1itp s PHE 45 Ca 0.00 -0.51 0.01 0.00 -0.05 0.00 0.00 56.93 56.38 1itp s PHE 45 Cb 0.00 0.26 0.00 0.00 -0.63 0.00 0.00 43.02 42.65 1itp s PHE 45 CO 0.00 -0.93 -0.02 0.00 -0.05 0.00 0.00 175.22 174.21 1itp s ALA 46 N -3.95 0.21 0.00 1.99 0.00 0.61 -3.00 121.76 117.62 1itp s ALA 46 Ca 0.16 -0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.03 1itp s ALA 46 Cb -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.04 1itp s ALA 46 CO 0.03 0.04 0.00 0.41 0.00 0.00 0.00 175.76 176.24 1itp n GLY 47 N 3.11 -0.86 3.80 0.00 0.00 -1.04 -0.25 105.19 109.95 1itp n GLY 47 Ca -0.14 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.33 1itp n GLY 47 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1itp s GLU 48 N -0.31 3.65 0.00 1.61 2.02 -0.66 -0.41 118.70 124.60 1itp s GLU 48 Ca 0.00 -0.19 0.00 0.00 0.02 0.00 0.00 54.97 54.80 1itp s GLU 48 Cb 0.00 -3.22 0.00 0.00 0.10 0.00 0.00 34.13 31.01 1itp s GLU 48 CO 0.00 0.60 0.00 1.28 0.02 0.00 0.00 175.26 177.16 1itp n LEU 49 N 2.54 0.00 0.00 1.80 4.77 -1.04 0.63 117.00 125.70 1itp n LEU 49 Ca -0.19 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.67 1itp n LEU 49 Cb 0.54 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.63 1itp n LEU 49 CO 0.33 0.00 0.35 0.41 -1.33 0.00 0.00 177.39 177.15 1itp n THR 50 N 0.00 0.00 0.12 -5.08 -1.04 -1.26 -2.26 114.28 104.75 1itp n THR 50 Ca 0.00 -1.41 -0.02 0.00 -2.04 0.00 0.00 64.05 60.57 1itp n THR 50 Cb 0.00 1.06 0.09 0.00 -1.82 0.00 0.00 70.33 69.65 1itp n THR 50 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1itp h PRO 51 N 0.00 0.00 0.22 -2.82 0.13 -2.00 -2.72 132.00 124.81 1itp h PRO 51 Ca -0.31 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.81 1itp h PRO 51 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1itp h PRO 51 CO 0.40 0.71 -0.10 0.37 -0.23 0.00 0.00 178.00 179.15 1itp h GLN 52 N 0.00 -0.28 -0.82 0.86 -0.00 -2.00 -2.86 115.11 110.01 1itp h GLN 52 Ca -0.01 0.02 0.14 0.00 -0.00 0.00 0.00 58.65 58.80 1itp h GLN 52 Cb 1.30 0.06 -0.09 0.00 0.00 0.00 0.00 27.48 28.75 1itp h GLN 52 CO 0.09 0.10 0.40 0.77 0.00 0.00 0.00 178.83 180.20 1itp h SER 53 N -0.87 0.48 0.00 -0.69 0.02 -1.97 -2.46 113.55 108.06 1itp h SER 53 Ca -0.03 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1itp h SER 53 Cb 0.51 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.07 1itp h SER 53 CO 0.05 0.21 0.00 0.18 -1.14 0.00 0.00 176.83 176.13 1itp n LEU 54 N -4.89 0.00 -0.63 5.07 4.32 -1.03 -0.89 117.00 118.95 1itp n LEU 54 Ca 0.16 0.96 0.48 0.00 -0.02 0.00 0.00 56.01 57.58 1itp n LEU 54 Cb 0.41 -0.46 0.73 0.00 -1.62 0.00 0.00 43.42 42.48 1itp n LEU 54 CO 0.21 -0.46 1.32 0.41 -1.22 0.00 0.00 177.39 177.66 1itp n THR 55 N -2.25 -0.01 0.04 -5.08 -1.04 -1.03 0.23 114.28 105.14 1itp n THR 55 Ca 0.00 1.34 -0.02 0.00 -2.04 0.00 0.00 64.05 63.33 1itp n THR 55 Cb 0.00 -2.23 -0.01 0.00 -1.82 0.00 0.00 70.33 66.27 1itp n THR 55 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 1itp h LYS 56 N 0.00 -0.09 -0.41 -2.82 3.11 -0.56 -1.88 116.57 113.91 1itp h LYS 56 Ca 0.84 0.01 0.00 0.00 -2.81 0.00 0.00 60.65 58.69 1itp h LYS 56 Cb 3.36 0.02 0.00 0.00 -1.00 0.00 0.00 32.23 34.62 1itp h LYS 56 CO -0.02 -0.06 0.00 1.97 -2.81 0.00 0.00 179.45 178.53 1itp n PHE 57 N -2.35 0.55 -0.10 1.91 1.16 0.95 -3.98 117.46 115.60 1itp n PHE 57 Ca -0.01 -0.27 -0.18 0.00 -1.87 0.00 0.00 57.45 55.11 1itp n PHE 57 Cb 0.04 -0.01 -0.09 0.00 -1.61 0.00 0.00 39.48 37.82 1itp n PHE 57 CO 0.00 0.00 0.00 1.04 -1.87 0.00 0.00 176.76 175.93 1itp n GLN 58 N 0.68 0.54 -0.36 3.97 6.02 0.64 -2.99 117.38 125.89 1itp n GLN 58 Ca 0.14 0.53 -0.02 0.00 -0.01 0.00 0.00 57.00 57.63 1itp n GLN 58 Cb 0.35 -1.70 0.10 0.00 1.02 0.00 0.00 30.24 30.01 1itp n GLN 58 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1itp h GLY 59 N -1.00 1.37 1.85 1.08 0.00 -1.48 0.62 103.07 105.50 1itp h GLY 59 Ca -0.30 -0.52 0.00 0.00 0.00 0.00 0.00 47.33 46.51 1itp h GLY 59 CO -0.18 0.51 -0.00 -0.10 0.00 0.00 0.00 176.54 176.77 1itp n LEU 60 N -4.40 0.00 -4.25 3.11 7.94 -1.26 -4.90 117.00 113.24 1itp n LEU 60 Ca 0.11 0.42 -0.40 0.00 -1.11 0.00 0.00 56.01 55.03 1itp n LEU 60 Cb 0.02 -0.42 0.00 0.00 0.53 0.00 0.00 43.42 43.55 1itp n LEU 60 CO 0.37 0.00 -0.52 1.67 -1.11 0.00 0.00 177.39 177.80 1itp n GLN 61 N -1.42 0.00 0.00 1.96 7.27 0.21 -2.48 117.38 122.91 1itp n GLN 61 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.17 1itp n GLN 61 Cb 0.31 -0.99 0.00 0.00 2.41 0.00 0.00 30.24 31.96 1itp n GLN 61 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1itp n GLY 62 N 2.39 2.76 0.00 1.69 0.00 -0.78 -4.76 105.19 106.48 1itp n GLY 62 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1itp n GLY 62 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1itp n ASP 63 N 0.00 0.93 0.00 1.61 -0.08 -1.04 -4.86 116.55 113.12 1itp n ASP 63 Ca 0.00 -1.28 0.00 0.00 -1.51 0.00 0.00 54.79 52.00 1itp n ASP 63 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1itp n ASP 63 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1itp n LEU 64 N -0.14 0.00 -4.64 -2.67 7.94 -1.26 -4.93 117.00 111.30 1itp n LEU 64 Ca 0.00 0.00 -0.37 0.00 -1.11 0.00 0.00 56.01 54.53 1itp n LEU 64 Cb 0.19 0.25 -0.10 0.00 0.53 0.00 0.00 43.42 44.30 1itp n LEU 64 CO 0.00 -0.42 -0.12 -0.63 -1.11 0.00 0.00 177.39 175.11 1itp s ILE 65 N -1.83 5.32 -0.02 1.96 -1.09 -1.26 -2.73 121.20 121.55 1itp s ILE 65 Ca 0.00 0.27 -0.02 0.00 -2.23 0.00 0.00 60.65 58.67 1itp s ILE 65 Cb 0.00 -3.55 -0.27 0.00 -1.58 0.00 0.00 42.46 37.06 1itp s ILE 65 CO 0.00 0.30 0.77 -0.78 -1.23 0.00 0.00 174.94 174.01 1itp h ASP 66 N 7.72 0.37 -3.64 3.58 3.58 -1.69 -2.08 116.42 124.25 1itp h ASP 66 Ca -0.37 -0.55 -0.10 0.00 0.42 0.00 0.00 57.03 56.43 1itp h ASP 66 Cb 1.17 -0.12 -0.24 0.00 1.72 0.00 0.00 39.33 41.86 1itp h ASP 66 CO 0.64 1.47 -0.19 -0.44 -2.88 0.00 0.00 179.24 177.84 1itp s SER 67 N -6.92 -0.53 -0.23 2.28 0.01 -1.26 -4.94 113.70 102.11 1itp s SER 67 Ca -0.10 0.98 0.02 0.00 1.31 0.00 0.00 55.95 58.15 1itp s SER 67 Cb 0.07 0.94 0.04 0.00 0.21 0.00 0.00 66.02 67.28 1itp s SER 67 CO 0.84 -0.18 -0.15 -0.51 0.41 0.00 0.00 173.24 173.66 1itp s ILE 68 N 0.68 2.15 -0.80 1.44 2.07 -1.26 -0.30 121.20 125.18 1itp s ILE 68 Ca -0.03 -1.32 0.02 0.00 -1.41 0.00 0.00 60.65 57.91 1itp s ILE 68 Cb -0.05 -2.11 0.29 0.00 0.13 0.00 0.00 42.46 40.72 1itp s ILE 68 CO -0.05 0.22 1.10 1.21 -1.91 0.00 0.00 174.94 175.52 1itp n GLU 69 N 4.52 3.51 -1.78 3.50 2.13 0.80 -5.00 120.64 128.32 1itp n GLU 69 Ca -0.17 -4.67 -0.42 0.00 0.66 0.00 0.00 57.16 52.56 1itp n GLU 69 Cb 0.46 -2.35 -0.03 0.00 0.27 0.00 0.00 31.44 29.79 1itp n GLU 69 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 1itp s GLU 70 N -2.92 4.15 -0.06 5.31 2.12 -1.26 -2.15 118.70 123.89 1itp s GLU 70 Ca 0.39 2.52 0.09 0.00 0.36 0.00 0.00 54.97 58.33 1itp s GLU 70 Cb 0.14 -3.42 0.14 0.00 0.26 0.00 0.00 34.13 31.25 1itp s GLU 70 CO -0.01 -0.77 1.05 -3.47 -0.54 0.00 0.00 175.26 171.52 1itp n ASP 71 N 5.08 1.25 0.24 -1.70 2.03 -1.04 -4.86 116.55 117.54 1itp n ASP 71 Ca 0.16 -2.49 -0.09 0.00 0.52 0.00 0.00 54.79 52.90 1itp n ASP 71 Cb 0.38 -0.29 -0.04 0.00 -0.72 0.00 0.00 41.12 40.44 1itp n ASP 71 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1itp h GLY 72 N 0.00 -0.63 -7.56 0.27 0.00 -1.53 -3.34 103.07 90.28 1itp h GLY 72 Ca 0.00 0.23 -0.65 0.00 0.00 0.00 0.00 47.33 46.91 1itp h GLY 72 CO 0.00 -0.23 1.90 -1.50 0.00 0.00 0.00 176.54 176.71 1itp s ILE 73 N -4.32 4.07 -0.75 2.60 2.07 -1.25 -4.22 121.20 119.40 1itp s ILE 73 Ca -0.09 -1.48 0.04 0.00 -1.41 0.00 0.00 60.65 57.71 1itp s ILE 73 Cb 0.01 -5.14 0.19 0.00 0.13 0.00 0.00 42.46 37.65 1itp s ILE 73 CO 0.27 -1.98 0.60 0.55 -1.91 0.00 0.00 174.94 172.46 1itp n VAL 74 N 6.55 2.08 -1.41 4.00 3.14 -1.25 -5.02 118.33 126.42 1itp n VAL 74 Ca 0.42 -4.98 0.00 0.00 -2.96 0.00 0.00 64.34 56.82 1itp n VAL 74 Cb 0.48 -2.22 0.00 0.00 -1.06 0.00 0.00 33.84 31.04 1itp n VAL 74 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 1itp n THR 75 N 1.91 -3.98 0.19 1.55 -1.04 -1.26 -4.83 114.28 106.82 1itp n THR 75 Ca 0.21 1.82 -0.08 0.00 -2.04 0.00 0.00 64.05 63.97 1itp n THR 75 Cb 0.36 -2.65 -0.04 0.00 -1.82 0.00 0.00 70.33 66.18 1itp n THR 75 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1itp h THR 76 N 0.96 0.00 0.00 12.58 2.02 -1.99 -3.54 112.91 122.95 1itp h THR 76 Ca 0.00 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.06 1itp h THR 76 Cb 0.33 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.74 1itp h THR 76 CO 0.00 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.89