#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 -1.99 -2.71 1.61 7.64 -1.26 -4.91 113.62 112.00 1itp n SER 2 Ca 0.00 -0.18 -0.30 0.00 1.01 0.00 0.00 58.87 59.40 1itp n SER 2 Cb 0.00 -0.26 -0.00 0.00 -1.01 0.00 0.00 64.21 62.94 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 -2.89 5.27 0.00 -0.43 0.00 -1.06 -4.96 120.51 116.44 1itp n ALA 3 Ca -0.04 -4.39 0.00 0.00 0.00 0.00 0.00 53.44 49.00 1itp n ALA 3 Cb 0.13 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 18.68 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 -0.42 -2.28 3.93 0.00 0.00 -1.26 -1.95 105.19 103.22 1itp n GLY 4 Ca 0.40 -1.53 -0.25 0.00 0.00 0.00 0.00 46.02 44.64 1itp n GLY 4 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1itp s LYS 5 N -0.64 3.36 0.23 1.61 -2.85 -1.26 -2.58 119.74 117.62 1itp s LYS 5 Ca 0.00 -0.67 0.01 0.00 -1.00 0.00 0.00 55.97 54.31 1itp s LYS 5 Cb 0.00 -2.91 -0.05 0.00 -2.06 0.00 0.00 37.83 32.82 1itp s LYS 5 CO 0.00 0.50 0.08 -0.06 0.10 0.00 0.00 175.35 175.97 1itp s PHE 6 N -1.80 1.39 -0.15 1.78 0.40 0.28 -2.46 117.98 117.42 1itp s PHE 6 Ca 0.34 -1.17 -0.04 0.00 -0.60 0.00 0.00 56.93 55.45 1itp s PHE 6 Cb -0.10 -0.79 0.06 0.00 0.51 0.00 0.00 43.02 42.69 1itp s PHE 6 CO 0.28 -0.35 0.09 0.42 0.70 0.00 0.00 175.22 176.36 1itp s ILE 7 N -3.80 -0.10 0.19 0.64 1.01 -0.93 -2.49 121.20 115.72 1itp s ILE 7 Ca 0.34 -0.06 0.11 0.00 0.00 0.00 0.00 60.65 61.04 1itp s ILE 7 Cb 0.07 -0.51 -0.04 0.00 0.01 0.00 0.00 42.46 41.99 1itp s ILE 7 CO 0.11 -0.20 -0.22 0.68 0.00 0.00 0.00 174.94 175.30 1itp s VAL 8 N 2.15 2.23 0.11 2.92 -7.23 -1.07 0.00 120.40 119.52 1itp s VAL 8 Ca 0.03 -2.03 0.03 0.00 -1.81 0.00 0.00 61.98 58.20 1itp s VAL 8 Cb -0.15 -2.06 -0.04 0.00 0.56 0.00 0.00 36.38 34.68 1itp s VAL 8 CO -0.08 -0.18 -0.08 -0.63 -0.31 0.00 0.00 175.10 173.82 1itp s ILE 9 N -1.81 0.85 0.03 -0.62 -1.09 -0.21 -1.44 121.20 116.91 1itp s ILE 9 Ca 0.20 -1.96 0.07 0.00 -2.23 0.00 0.00 60.65 56.74 1itp s ILE 9 Cb -0.07 -1.71 -0.03 0.00 -1.58 0.00 0.00 42.46 39.07 1itp s ILE 9 CO 0.09 -0.82 -0.19 -0.36 -1.23 0.00 0.00 174.94 172.44 1itp s PHE 10 N -3.46 2.53 0.99 3.97 0.08 -0.72 -0.93 117.98 120.45 1itp s PHE 10 Ca 0.13 -0.27 -0.17 0.00 0.12 0.00 0.00 56.93 56.74 1itp s PHE 10 Cb 0.04 -1.47 0.07 0.00 -0.57 0.00 0.00 43.02 41.08 1itp s PHE 10 CO -0.03 0.22 -0.17 0.36 -0.10 0.00 0.00 175.22 175.51 1itp n LYS 11 N 1.68 -1.44 -0.86 0.44 2.85 -1.26 -4.50 118.16 115.07 1itp n LYS 11 Ca -0.16 -0.42 -0.17 0.00 -1.05 0.00 0.00 58.31 56.50 1itp n LYS 11 Cb 0.52 -1.41 0.07 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 -0.10 5.37 0.00 -5.58 2.85 -1.26 -3.88 115.26 112.66 1itp n ASN 12 Ca 0.02 -3.08 0.00 0.00 -0.11 0.00 0.00 54.58 51.41 1itp n ASN 12 Cb 0.48 -0.90 0.00 0.00 1.24 0.00 0.00 39.78 40.60 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 -0.10 0.56 -4.17 1.20 2.03 -1.26 -5.07 116.55 109.74 1itp n ASP 13 Ca 0.35 0.00 -0.39 0.00 0.52 0.00 0.00 54.79 55.27 1itp n ASP 13 Cb 0.83 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.23 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 -2.79 0.26 -2.56 5.18 3.14 -1.25 -4.95 118.33 115.35 1itp n VAL 14 Ca 0.00 -0.49 -0.24 0.00 -2.96 0.00 0.00 64.34 60.65 1itp n VAL 14 Cb 0.40 0.00 0.13 0.00 -1.06 0.00 0.00 33.84 33.30 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 -0.98 4.10 -0.02 6.55 1.04 -1.26 -4.98 113.70 118.16 1itp s SER 15 Ca 0.57 -0.43 -0.09 0.00 0.48 0.00 0.00 55.95 56.48 1itp s SER 15 Cb -0.54 0.17 -0.05 0.00 0.10 0.00 0.00 66.02 65.70 1itp s SER 15 CO 0.63 -2.04 0.55 -0.08 0.98 0.00 0.00 173.24 173.28 1itp h GLU 16 N -0.68 -0.30 -0.53 4.02 4.81 -1.99 -2.61 114.58 117.30 1itp h GLU 16 Ca -0.35 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 58.94 1itp h GLU 16 Cb 1.26 0.07 -0.06 0.00 0.63 0.00 0.00 28.75 30.64 1itp h GLU 16 CO 0.37 -0.20 -0.31 -3.47 -0.73 0.00 0.00 179.01 174.67 1itp n ASP 17 N -3.68 -0.56 -0.30 1.04 2.03 -1.26 0.14 116.55 113.96 1itp n ASP 17 Ca -0.04 1.37 0.13 0.00 0.52 0.00 0.00 54.79 56.77 1itp n ASP 17 Cb 0.12 -0.33 0.28 0.00 -0.72 0.00 0.00 41.12 40.46 1itp n ASP 17 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1itp h LYS 18 N 0.00 0.11 0.18 -0.67 1.57 -1.98 0.45 116.57 116.23 1itp h LYS 18 Ca 0.09 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.87 1itp h LYS 18 Cb 0.22 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.46 1itp h LYS 18 CO -0.50 0.07 -0.44 0.82 -0.57 0.00 0.00 179.45 178.83 1itp h ILE 19 N 0.12 0.12 -0.42 1.86 2.04 0.17 0.41 117.51 121.80 1itp h ILE 19 Ca 0.55 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.49 1itp h ILE 19 Cb 1.12 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 1itp h ILE 19 CO -0.75 0.00 0.29 0.03 0.00 0.00 0.00 178.15 177.72 1itp h ARG 20 N -0.72 0.22 0.29 2.37 3.08 0.17 -2.63 114.38 117.17 1itp h ARG 20 Ca 0.01 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1itp h ARG 20 Cb 0.72 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.72 1itp h ARG 20 CO -0.22 0.14 -0.14 0.93 -1.07 0.00 0.00 179.97 179.61 1itp h GLU 21 N 0.22 -0.37 -1.00 0.04 5.08 0.17 -1.56 114.58 117.16 1itp h GLU 21 Ca 0.19 0.03 0.39 0.00 -1.00 0.00 0.00 59.36 58.97 1itp h GLU 21 Cb 0.48 0.09 -0.15 0.00 0.50 0.00 0.00 28.75 29.66 1itp h GLU 21 CO -0.04 -0.25 0.57 2.41 -1.00 0.00 0.00 179.01 180.71 1itp n THR 22 N -3.41 -0.34 0.20 1.13 -1.04 0.12 0.19 114.28 111.14 1itp n THR 22 Ca -0.05 1.79 -0.13 0.00 -2.04 0.00 0.00 64.05 63.62 1itp n THR 22 Cb 0.15 -2.91 -0.08 0.00 -1.82 0.00 0.00 70.33 65.67 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 -0.52 -0.96 -2.82 1.57 -1.39 -2.40 116.57 110.04 1itp h LYS 23 Ca 0.78 0.04 0.02 0.00 -1.87 0.00 0.00 60.65 59.61 1itp h LYS 23 Cb 2.18 0.12 -0.05 0.00 0.08 0.00 0.00 32.23 34.56 1itp h LYS 23 CO -0.63 -0.21 0.64 -0.44 -0.57 0.00 0.00 179.45 178.24 1itp h ASP 24 N -0.88 1.08 -0.71 0.86 5.19 0.21 0.51 116.42 122.68 1itp h ASP 24 Ca -0.06 -0.02 0.13 0.00 -0.62 0.00 0.00 57.03 56.47 1itp h ASP 24 Cb 0.55 -0.26 -0.09 0.00 0.18 0.00 0.00 39.33 39.71 1itp h ASP 24 CO 0.09 0.77 0.25 -0.33 -3.12 0.00 0.00 179.24 176.90 1itp h GLU 25 N 1.27 0.38 -0.10 3.56 5.08 0.21 0.21 114.58 125.19 1itp h GLU 25 Ca 0.37 -0.02 -0.12 0.00 -1.00 0.00 0.00 59.36 58.58 1itp h GLU 25 Cb -0.09 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1itp h GLU 25 CO -0.09 0.25 -0.41 -0.24 -1.00 0.00 0.00 179.01 177.52 1itp h VAL 26 N 0.39 1.38 -0.80 3.13 3.04 -0.80 0.14 116.25 122.74 1itp h VAL 26 Ca 0.39 -1.74 0.18 0.00 -1.01 0.00 0.00 66.70 64.51 1itp h VAL 26 Cb 0.58 2.19 -0.12 0.00 -2.01 0.00 0.00 31.29 31.93 1itp h VAL 26 CO -0.40 0.52 0.25 0.40 -1.01 0.00 0.00 177.57 177.33 1itp h ILE 27 N 0.04 0.50 0.08 3.17 1.08 0.38 1.06 117.51 123.82 1itp h ILE 27 Ca -0.02 -0.11 -0.26 0.00 -0.39 0.00 0.00 64.86 64.08 1itp h ILE 27 Cb 1.04 0.15 0.01 0.00 -3.07 0.00 0.00 36.82 34.95 1itp h ILE 27 CO 0.09 0.06 -1.13 0.00 -0.69 0.00 0.00 178.15 176.47 1itp h ALA 28 N 1.65 0.18 -0.83 1.87 0.00 -0.61 -3.37 119.26 118.15 1itp h ALA 28 Ca 0.47 -0.79 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1itp h ALA 28 Cb 0.83 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1itp h ALA 28 CO -0.52 0.84 0.00 -1.91 0.00 0.00 0.00 179.25 177.67 1itp n GLU 29 N -3.68 0.00 0.00 0.00 2.13 0.73 -4.99 120.64 114.83 1itp n GLU 29 Ca -0.09 0.36 0.00 0.00 0.66 0.00 0.00 57.16 58.09 1itp n GLU 29 Cb 0.94 -1.30 0.00 0.00 0.27 0.00 0.00 31.44 31.35 1itp n GLU 29 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1itp n GLY 30 N -0.51 -1.81 3.09 8.31 0.00 0.33 -5.05 105.19 109.55 1itp n GLY 30 Ca 0.00 0.46 -0.37 0.00 0.00 0.00 0.00 46.02 46.11 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 -1.38 -3.26 3.51 -0.02 0.00 -1.19 -4.73 105.19 98.12 1itp n GLY 31 Ca 0.00 -0.47 -0.26 0.00 0.00 0.00 0.00 46.02 45.29 1itp n GLY 31 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1itp s THR 32 N -2.08 0.46 -0.05 2.61 2.01 0.21 -3.12 115.64 115.68 1itp s THR 32 Ca 0.42 -2.00 0.02 0.00 0.31 0.00 0.00 61.69 60.44 1itp s THR 32 Cb -0.03 -2.29 0.01 0.00 0.01 0.00 0.00 72.50 70.20 1itp s THR 32 CO 0.71 0.00 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.91 1itp s ILE 33 N -3.18 0.92 -0.04 1.82 -1.09 -1.26 -1.79 121.20 116.57 1itp s ILE 33 Ca 0.23 -0.36 0.04 0.00 -2.23 0.00 0.00 60.65 58.32 1itp s ILE 33 Cb 0.01 -0.85 -0.05 0.00 -1.58 0.00 0.00 42.46 39.99 1itp s ILE 33 CO 0.16 0.30 0.01 0.35 -1.23 0.00 0.00 174.94 174.54 1itp n THR 34 N 3.78 0.29 -3.66 2.92 -2.24 -1.04 -4.92 114.28 109.42 1itp n THR 34 Ca -0.23 -0.18 -0.10 0.00 -2.27 0.00 0.00 64.05 61.27 1itp n THR 34 Cb 0.52 -0.88 -0.05 0.00 -2.10 0.00 0.00 70.33 67.82 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 -3.55 -0.19 0.30 3.42 0.01 -0.50 -5.02 114.94 109.41 1itp s ASN 35 Ca -0.02 -0.36 0.02 0.00 -0.71 0.00 0.00 52.86 51.80 1itp s ASN 35 Cb 0.01 0.46 -0.05 0.00 0.41 0.00 0.00 41.25 42.08 1itp s ASN 35 CO 0.17 -0.84 0.10 -1.83 -1.51 0.00 0.00 177.10 173.19 1itp s GLU 36 N -3.81 1.55 -0.38 -0.60 1.03 -1.26 -0.32 118.70 114.91 1itp s GLU 36 Ca 0.03 -1.86 0.01 0.00 0.03 0.00 0.00 54.97 53.17 1itp s GLU 36 Cb 0.02 -0.44 0.12 0.00 -0.80 0.00 0.00 34.13 33.03 1itp s GLU 36 CO -0.12 -0.30 0.19 0.71 -1.33 0.00 0.00 175.26 174.40 1itp s TYR 37 N -3.56 1.69 -1.16 4.83 2.02 0.14 -4.81 117.35 116.50 1itp s TYR 37 Ca 0.36 -2.06 -0.10 0.00 -0.37 0.00 0.00 57.07 54.89 1itp s TYR 37 Cb 0.07 -1.68 0.24 0.00 -0.40 0.00 0.00 41.96 40.20 1itp s TYR 37 CO 0.15 -0.82 1.29 0.27 -1.57 0.00 0.00 175.55 174.87 1itp n ASN 38 N 4.07 5.47 -4.63 2.29 0.23 -1.26 -2.10 115.26 119.33 1itp n ASN 38 Ca 0.05 -3.05 -0.25 0.00 -0.53 0.00 0.00 54.58 50.81 1itp n ASN 38 Cb 0.37 -1.44 -0.08 0.00 -2.08 0.00 0.00 39.78 36.55 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 -0.35 2.25 0.06 -3.83 -1.94 -0.56 -5.01 119.30 109.92 1itp s MET 39 Ca 0.35 -1.32 0.23 0.00 -1.71 0.00 0.00 55.69 53.24 1itp s MET 39 Cb -0.05 -2.19 0.93 0.00 2.01 0.00 0.00 34.83 35.52 1itp s MET 39 CO -0.03 0.40 1.71 -0.35 -0.01 0.00 0.00 175.02 176.74 1itp n PRO 40 N -0.51 0.06 0.00 2.03 -0.04 -1.26 -3.08 135.00 132.19 1itp n PRO 40 Ca -0.08 0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1itp n PRO 40 Cb 0.57 -1.58 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 1itp n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1itp n GLY 41 N 0.74 -0.73 2.89 0.55 0.00 -1.26 -4.96 105.19 102.42 1itp n GLY 41 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.23 0.65 -1.08 1.61 0.00 -1.18 -5.06 119.30 114.01 1itp s MET 42 Ca 0.00 -0.59 -0.07 0.00 0.00 0.00 0.00 55.69 55.04 1itp s MET 42 Cb 0.00 -0.48 0.28 0.00 0.00 0.00 0.00 34.83 34.64 1itp s MET 42 CO 0.00 -1.17 1.18 1.63 0.00 0.00 0.00 175.02 176.66 1itp n LYS 43 N 4.44 3.71 -2.31 4.11 4.01 -1.26 -1.49 118.16 129.36 1itp n LYS 43 Ca 0.10 -4.49 -0.03 0.00 -0.51 0.00 0.00 58.31 53.37 1itp n LYS 43 Cb 0.48 -2.52 -0.01 0.00 -0.51 0.00 0.00 35.03 32.47 1itp n LYS 43 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1itp n GLY 44 N 2.22 3.97 3.37 0.72 0.00 -0.89 -1.76 105.19 112.81 1itp n GLY 44 Ca 0.24 -1.88 -0.10 0.00 0.00 0.00 0.00 46.02 44.28 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 -1.85 -0.19 0.07 1.61 -0.12 -0.52 0.24 117.98 117.22 1itp s PHE 45 Ca 0.03 -0.13 0.05 0.00 -0.05 0.00 0.00 56.93 56.84 1itp s PHE 45 Cb 0.00 0.30 -0.03 0.00 -0.63 0.00 0.00 43.02 42.67 1itp s PHE 45 CO 0.02 -0.76 -0.13 0.00 -0.05 0.00 0.00 175.22 174.29 1itp s ALA 46 N -3.82 1.13 0.00 1.99 0.00 0.56 -2.58 121.76 119.04 1itp s ALA 46 Ca 0.05 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 51.01 1itp s ALA 46 Cb 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.05 1itp s ALA 46 CO -0.10 0.14 0.00 0.41 0.00 0.00 0.00 175.76 176.21 1itp n GLY 47 N 1.23 -0.66 3.79 0.00 0.00 -1.04 -1.41 105.19 107.10 1itp n GLY 47 Ca -0.21 -0.51 -0.36 0.00 0.00 0.00 0.00 46.02 44.94 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 -0.88 3.90 0.00 1.61 2.02 -0.74 -0.56 118.70 124.05 1itp s GLU 48 Ca 0.00 -0.14 0.00 0.00 0.02 0.00 0.00 54.97 54.85 1itp s GLU 48 Cb 0.00 -3.33 0.00 0.00 0.10 0.00 0.00 34.13 30.90 1itp s GLU 48 CO 0.00 0.49 0.00 1.28 0.02 0.00 0.00 175.26 177.05 1itp n LEU 49 N 2.89 0.00 0.00 1.80 4.77 -1.06 0.67 117.00 126.06 1itp n LEU 49 Ca -0.17 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.71 1itp n LEU 49 Cb 0.53 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.62 1itp n LEU 49 CO 0.35 0.00 0.26 0.41 -1.33 0.00 0.00 177.39 177.08 1itp n THR 50 N 0.00 0.00 0.21 -5.08 -1.04 -1.26 -2.57 114.28 104.54 1itp n THR 50 Ca 0.00 -1.22 0.09 0.00 -2.04 0.00 0.00 64.05 60.88 1itp n THR 50 Cb 0.00 0.87 0.32 0.00 -1.82 0.00 0.00 70.33 69.70 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 0.12 -2.82 0.13 -2.00 -2.65 132.00 124.79 1itp h PRO 51 Ca -0.25 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.88 1itp h PRO 51 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1itp h PRO 51 CO 0.32 0.24 -0.06 0.37 -0.23 0.00 0.00 178.00 178.64 1itp h GLN 52 N 0.00 -0.16 -0.83 0.86 4.15 -2.00 -2.93 115.11 114.20 1itp h GLN 52 Ca -0.00 0.01 0.11 0.00 0.77 0.00 0.00 58.65 59.54 1itp h GLN 52 Cb 0.93 0.04 -0.06 0.00 0.21 0.00 0.00 27.48 28.60 1itp h GLN 52 CO 0.03 0.26 0.54 0.77 -1.93 0.00 0.00 178.83 178.50 1itp h SER 53 N -0.94 0.67 0.00 -0.69 0.02 -1.97 -2.69 113.55 107.95 1itp h SER 53 Ca -0.02 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1itp h SER 53 Cb 0.49 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.91 1itp h SER 53 CO 0.03 0.39 0.00 0.18 -1.14 0.00 0.00 176.83 176.28 1itp n LEU 54 N -4.52 0.00 -0.63 5.07 4.32 -1.00 -1.68 117.00 118.57 1itp n LEU 54 Ca 0.14 0.99 0.47 0.00 -0.02 0.00 0.00 56.01 57.60 1itp n LEU 54 Cb 0.36 -0.49 0.73 0.00 -1.62 0.00 0.00 43.42 42.39 1itp n LEU 54 CO 0.31 -0.49 1.32 0.41 -1.22 0.00 0.00 177.39 177.72 1itp n THR 55 N -2.13 -0.01 0.00 -5.08 -1.04 -1.08 0.25 114.28 105.20 1itp n THR 55 Ca 0.00 1.35 -0.00 0.00 -2.04 0.00 0.00 64.05 63.35 1itp n THR 55 Cb 0.00 -2.24 -0.00 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 -0.01 -0.43 -2.82 3.11 -1.00 -2.29 116.57 113.13 1itp h LYS 56 Ca 0.84 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 58.68 1itp h LYS 56 Cb 3.34 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 34.57 1itp h LYS 56 CO -0.03 -0.01 0.00 1.97 -2.81 0.00 0.00 179.45 178.57 1itp n PHE 57 N -2.04 0.57 -0.08 1.91 1.16 0.89 -3.88 117.46 115.98 1itp n PHE 57 Ca -0.00 -0.26 -0.08 0.00 -1.87 0.00 0.00 57.45 55.23 1itp n PHE 57 Cb 0.01 -0.04 -0.03 0.00 -1.61 0.00 0.00 39.48 37.80 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 0.54 0.48 0.07 3.97 6.02 0.71 -2.72 117.38 126.45 1itp n GLN 58 Ca 0.13 0.50 0.05 0.00 -0.01 0.00 0.00 57.00 57.67 1itp n GLN 58 Cb 0.37 -1.67 0.49 0.00 1.02 0.00 0.00 30.24 30.44 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 0.42 1.38 1.08 0.00 -1.56 0.16 103.07 103.54 1itp h GLY 59 Ca -0.07 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1itp h GLY 59 CO -0.04 0.15 -0.35 -0.10 0.00 0.00 0.00 176.54 176.20 1itp n LEU 60 N -4.49 0.42 -3.97 3.11 7.94 -1.25 -4.94 117.00 113.82 1itp n LEU 60 Ca 0.01 0.22 -0.39 0.00 -1.11 0.00 0.00 56.01 54.75 1itp n LEU 60 Cb 0.07 -0.31 -0.01 0.00 0.53 0.00 0.00 43.42 43.70 1itp n LEU 60 CO 0.35 0.03 -0.36 1.67 -1.11 0.00 0.00 177.39 177.97 1itp n GLN 61 N -1.67 0.00 -0.03 1.96 7.27 0.55 -2.27 117.38 123.20 1itp n GLN 61 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.13 1itp n GLN 61 Cb 0.36 -0.92 0.00 0.00 2.41 0.00 0.00 30.24 32.09 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 2.12 0.44 0.04 1.69 0.00 -0.88 -4.83 105.19 103.77 1itp n GLY 62 Ca 0.11 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.08 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 3.17 -0.07 1.61 -0.08 -0.96 -4.75 116.55 115.46 1itp n ASP 63 Ca 0.00 -0.02 0.00 0.00 -1.51 0.00 0.00 54.79 53.26 1itp n ASP 63 Cb 0.00 0.37 0.00 0.00 2.34 0.00 0.00 41.12 43.83 1itp n ASP 63 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1itp n LEU 64 N -2.47 0.00 -3.80 -2.67 -0.00 -1.26 -4.92 117.00 101.88 1itp n LEU 64 Ca -0.14 -0.20 -0.25 0.00 -0.00 0.00 0.00 56.01 55.42 1itp n LEU 64 Cb 0.72 0.00 -0.17 0.00 -0.00 0.00 0.00 43.42 43.97 1itp n LEU 64 CO 0.14 0.10 -0.39 -0.63 -0.00 0.00 0.00 177.39 176.61 1itp s ILE 65 N 0.00 0.57 -0.04 1.47 1.01 -1.26 -4.24 121.20 118.70 1itp s ILE 65 Ca 0.00 -0.10 -0.21 0.00 0.00 0.00 0.00 60.65 60.33 1itp s ILE 65 Cb 0.00 -0.75 -0.31 0.00 0.01 0.00 0.00 42.46 41.41 1itp s ILE 65 CO 0.00 0.20 0.91 -0.78 0.00 0.00 0.00 174.94 175.28 1itp h ASP 66 N 8.27 0.49 -4.55 3.58 3.58 -1.26 -2.33 116.42 124.21 1itp h ASP 66 Ca -0.21 -0.94 -0.09 0.00 0.42 0.00 0.00 57.03 56.20 1itp h ASP 66 Cb 1.12 -0.16 -0.21 0.00 1.72 0.00 0.00 39.33 41.80 1itp h ASP 66 CO 0.31 1.40 -0.09 -0.44 -2.88 0.00 0.00 179.24 177.53 1itp s SER 67 N -6.99 -0.45 -0.11 2.28 0.01 -1.24 -4.93 113.70 102.28 1itp s SER 67 Ca -0.13 0.63 0.01 0.00 1.31 0.00 0.00 55.95 57.77 1itp s SER 67 Cb 0.01 0.67 0.02 0.00 0.21 0.00 0.00 66.02 66.93 1itp s SER 67 CO 0.84 -0.38 -0.14 -0.51 0.41 0.00 0.00 173.24 173.46 1itp s ILE 68 N -0.63 1.39 -0.62 1.44 1.10 -1.26 -1.05 121.20 121.57 1itp s ILE 68 Ca -0.07 -0.57 0.05 0.00 -0.51 0.00 0.00 60.65 59.55 1itp s ILE 68 Cb -0.03 -1.29 0.19 0.00 0.15 0.00 0.00 42.46 41.48 1itp s ILE 68 CO 0.04 0.42 0.53 1.21 -2.11 0.00 0.00 174.94 175.03 1itp n GLU 69 N 4.31 1.62 -2.12 3.50 2.13 0.10 -5.02 120.64 125.16 1itp n GLU 69 Ca -0.18 -4.20 -0.42 0.00 0.66 0.00 0.00 57.16 53.01 1itp n GLU 69 Cb 0.51 -2.09 -0.03 0.00 0.27 0.00 0.00 31.44 30.10 1itp n GLU 69 CO 0.00 0.00 0.00 -1.83 -0.41 0.00 0.00 177.13 174.89 1itp s GLU 70 N -1.41 4.28 -0.08 5.31 4.04 -1.26 -2.18 118.70 127.40 1itp s GLU 70 Ca 0.30 2.12 0.11 0.00 0.04 0.00 0.00 54.97 57.55 1itp s GLU 70 Cb 0.03 -3.34 0.17 0.00 0.02 0.00 0.00 34.13 31.01 1itp s GLU 70 CO -0.14 -0.52 1.06 -3.47 -1.84 0.00 0.00 175.26 170.36 1itp n ASP 71 N 4.42 1.82 -4.77 0.83 2.03 -1.08 -4.96 116.55 114.85 1itp n ASP 71 Ca 0.13 -2.60 -0.40 0.00 0.52 0.00 0.00 54.79 52.44 1itp n ASP 71 Cb 0.42 -0.28 0.02 0.00 -0.72 0.00 0.00 41.12 40.55 1itp n ASP 71 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1itp n GLY 72 N -0.96 1.08 3.19 0.27 0.00 -1.03 -4.29 105.19 103.44 1itp n GLY 72 Ca 0.10 0.21 -0.10 0.00 0.00 0.00 0.00 46.02 46.22 1itp n GLY 72 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1itp s ILE 73 N -1.18 -0.38 0.00 -0.61 -1.09 -0.82 -4.88 121.20 112.24 1itp s ILE 73 Ca 0.60 0.17 0.00 0.00 -2.23 0.00 0.00 60.65 59.19 1itp s ILE 73 Cb -0.45 -0.58 0.00 0.00 -1.58 0.00 0.00 42.46 39.85 1itp s ILE 73 CO 0.59 0.07 0.00 0.52 -1.23 0.00 0.00 174.94 174.89 1itp n VAL 74 N 4.98 0.00 -4.08 2.92 0.31 -1.26 -3.99 118.33 117.22 1itp n VAL 74 Ca -0.13 0.00 -0.45 0.00 -0.01 0.00 0.00 64.34 63.74 1itp n VAL 74 Cb 0.51 -0.47 0.01 0.00 -0.91 0.00 0.00 33.84 32.99 1itp n VAL 74 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1itp n THR 75 N -0.45 -2.77 0.04 2.52 -1.04 -1.26 -4.69 114.28 106.63 1itp n THR 75 Ca 0.00 -0.62 0.00 0.00 -2.04 0.00 0.00 64.05 61.39 1itp n THR 75 Cb 0.00 -2.31 0.00 0.00 -1.82 0.00 0.00 70.33 66.20 1itp n THR 75 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1itp n THR 76 N -5.00 0.00 -0.64 12.58 -1.04 -1.26 -5.29 114.28 113.63 1itp n THR 76 Ca -0.13 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 1itp n THR 76 Cb 0.57 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.08 1itp n THR 76 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43