#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1itp s SER 2 N 0.00 3.45 -0.01 1.61 1.04 -1.26 -4.97 113.70 113.57 1itp s SER 2 Ca 0.00 1.60 0.18 0.00 0.48 0.00 0.00 55.95 58.21 1itp s SER 2 Cb 0.00 -2.26 -0.24 0.00 0.10 0.00 0.00 66.02 63.62 1itp s SER 2 CO 0.00 -2.67 0.63 0.00 0.98 0.00 0.00 173.24 172.18 1itp n ALA 3 N -3.91 3.70 0.00 5.32 0.00 -1.07 -5.05 120.51 119.49 1itp n ALA 3 Ca 0.07 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1itp n ALA 3 Cb 0.55 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.34 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 1.43 0.37 3.88 0.00 0.00 -1.23 -4.10 105.19 105.54 1itp n GLY 4 Ca 0.01 -1.68 -0.36 0.00 0.00 0.00 0.00 46.02 43.99 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 -2.00 3.50 0.26 1.61 1.02 -1.26 -1.60 119.74 121.27 1itp s LYS 5 Ca 0.00 -0.11 0.04 0.00 0.02 0.00 0.00 55.97 55.93 1itp s LYS 5 Cb 0.00 -3.16 -0.05 0.00 -0.52 0.00 0.00 37.83 34.10 1itp s LYS 5 CO 0.00 0.73 -0.01 -0.06 -0.92 0.00 0.00 175.35 175.09 1itp s PHE 6 N -1.13 1.72 -0.25 3.18 0.40 0.65 -2.70 117.98 119.84 1itp s PHE 6 Ca 0.20 -0.87 -0.04 0.00 -0.60 0.00 0.00 56.93 55.62 1itp s PHE 6 Cb -0.13 -1.01 0.09 0.00 0.51 0.00 0.00 43.02 42.48 1itp s PHE 6 CO 0.09 0.05 0.11 0.42 0.70 0.00 0.00 175.22 176.60 1itp s ILE 7 N -3.30 -0.01 0.27 0.64 1.01 -0.95 -2.56 121.20 116.30 1itp s ILE 7 Ca 0.30 -0.62 0.08 0.00 0.00 0.00 0.00 60.65 60.41 1itp s ILE 7 Cb 0.06 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.58 1itp s ILE 7 CO 0.10 -0.59 0.10 0.68 0.00 0.00 0.00 174.94 175.24 1itp s VAL 8 N 2.08 3.78 0.04 2.92 -7.23 -1.15 -0.09 120.40 120.74 1itp s VAL 8 Ca 0.07 -1.67 -0.01 0.00 -1.81 0.00 0.00 61.98 58.55 1itp s VAL 8 Cb -0.16 -3.09 -0.03 0.00 0.56 0.00 0.00 36.38 33.67 1itp s VAL 8 CO -0.28 -0.33 -0.01 -0.63 -0.31 0.00 0.00 175.10 173.54 1itp s ILE 9 N -2.26 0.16 0.11 -0.62 1.09 0.39 -2.40 121.20 117.67 1itp s ILE 9 Ca 0.33 -1.34 0.08 0.00 -1.10 0.00 0.00 60.65 58.62 1itp s ILE 9 Cb -0.06 -0.91 -0.04 0.00 -1.06 0.00 0.00 42.46 40.38 1itp s ILE 9 CO 0.22 -0.74 -0.14 -0.36 -0.10 0.00 0.00 174.94 173.83 1itp s PHE 10 N -2.72 2.64 0.81 3.97 0.08 -0.72 0.17 117.98 122.21 1itp s PHE 10 Ca -0.04 -0.21 -0.11 0.00 0.12 0.00 0.00 56.93 56.69 1itp s PHE 10 Cb -0.01 -1.39 0.17 0.00 -0.57 0.00 0.00 43.02 41.22 1itp s PHE 10 CO -0.06 0.40 0.38 0.36 -0.10 0.00 0.00 175.22 176.21 1itp n LYS 11 N 0.79 -1.62 -1.22 0.44 2.85 -1.04 -4.46 118.16 113.91 1itp n LYS 11 Ca -0.15 -0.65 -0.29 0.00 -1.05 0.00 0.00 58.31 56.18 1itp n LYS 11 Cb 0.52 -1.16 0.11 0.00 -0.65 0.00 0.00 35.03 33.85 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 -2.05 6.21 0.00 -5.58 2.85 -1.26 -4.12 115.26 111.31 1itp n ASN 12 Ca 0.06 -3.62 0.00 0.00 -0.11 0.00 0.00 54.58 50.91 1itp n ASN 12 Cb 0.27 -0.93 0.00 0.00 1.24 0.00 0.00 39.78 40.36 1itp n ASN 12 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 1itp n ASP 13 N -0.84 1.13 -4.11 1.20 9.92 -1.26 -5.08 116.55 117.52 1itp n ASP 13 Ca 0.57 0.00 -0.38 0.00 -0.53 0.00 0.00 54.79 54.45 1itp n ASP 13 Cb 0.97 0.00 0.01 0.00 -0.64 0.00 0.00 41.12 41.46 1itp n ASP 13 CO 0.00 0.00 0.00 0.55 0.13 0.00 0.00 177.20 177.88 1itp n VAL 14 N -2.50 0.22 -2.57 2.53 3.14 -1.26 -4.95 118.33 112.94 1itp n VAL 14 Ca 0.00 -0.48 -0.24 0.00 -2.96 0.00 0.00 64.34 60.66 1itp n VAL 14 Cb 0.31 0.00 0.12 0.00 -1.06 0.00 0.00 33.84 33.21 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 -0.96 4.16 -0.08 6.55 1.04 -1.26 -4.99 113.70 118.17 1itp s SER 15 Ca 0.56 -0.41 -0.16 0.00 0.48 0.00 0.00 55.95 56.42 1itp s SER 15 Cb -0.53 0.12 -0.12 0.00 0.10 0.00 0.00 66.02 65.59 1itp s SER 15 CO 0.62 -2.00 0.59 -0.08 0.98 0.00 0.00 173.24 173.35 1itp h GLU 16 N -0.65 -0.17 -0.28 4.02 4.81 -1.98 -2.67 114.58 117.66 1itp h GLU 16 Ca -0.36 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 58.92 1itp h GLU 16 Cb 1.26 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.63 1itp h GLU 16 CO 0.38 0.19 -0.33 0.22 -0.73 0.00 0.00 179.01 178.75 1itp h ASP 17 N -0.96 -1.11 -0.81 1.04 3.58 -1.99 0.31 116.42 116.48 1itp h ASP 17 Ca -0.02 0.15 0.20 0.00 0.42 0.00 0.00 57.03 57.78 1itp h ASP 17 Cb 0.45 0.46 -0.13 0.00 1.72 0.00 0.00 39.33 41.82 1itp h ASP 17 CO 0.03 -0.22 0.17 0.11 -2.88 0.00 0.00 179.24 176.45 1itp h LYS 18 N -0.20 0.20 0.13 0.28 1.79 -1.99 0.38 116.57 117.17 1itp h LYS 18 Ca 0.05 -0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.52 1itp h LYS 18 Cb 0.33 -0.05 -0.05 0.00 -1.58 0.00 0.00 32.23 30.89 1itp h LYS 18 CO -0.37 0.13 -0.48 0.82 -1.08 0.00 0.00 179.45 178.47 1itp h ILE 19 N 0.21 0.07 -0.51 1.86 2.04 -0.21 0.43 117.51 121.40 1itp h ILE 19 Ca 0.48 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.43 1itp h ILE 19 Cb 0.90 0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 1itp h ILE 19 CO -0.62 0.00 0.35 0.03 0.00 0.00 0.00 178.15 177.91 1itp h ARG 20 N -0.72 0.32 0.33 2.37 -0.00 0.17 -2.57 114.38 114.28 1itp h ARG 20 Ca 0.01 -0.02 -0.02 0.00 -0.50 0.00 0.00 59.98 59.45 1itp h ARG 20 Cb 0.73 -0.07 0.00 0.00 0.00 0.00 0.00 29.97 30.63 1itp h ARG 20 CO -0.26 0.21 -0.16 0.93 0.00 0.00 0.00 179.97 180.69 1itp h GLU 21 N 0.33 -0.43 -0.96 0.04 5.08 0.18 -1.38 114.58 117.44 1itp h GLU 21 Ca 0.23 0.03 0.40 0.00 -1.00 0.00 0.00 59.36 59.02 1itp h GLU 21 Cb 0.49 0.10 -0.17 0.00 0.50 0.00 0.00 28.75 29.67 1itp h GLU 21 CO -0.05 -0.28 0.52 2.41 -1.00 0.00 0.00 179.01 180.60 1itp n THR 22 N -3.49 -0.39 0.23 1.13 -1.04 0.13 0.19 114.28 111.04 1itp n THR 22 Ca -0.06 1.90 -0.14 0.00 -2.04 0.00 0.00 64.05 63.72 1itp n THR 22 Cb 0.17 -3.10 -0.08 0.00 -1.82 0.00 0.00 70.33 65.51 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 -0.58 -1.00 -2.82 1.57 -1.36 -2.40 116.57 109.98 1itp h LYS 23 Ca 0.80 0.04 0.02 0.00 -1.87 0.00 0.00 60.65 59.64 1itp h LYS 23 Cb 2.15 0.13 -0.05 0.00 0.08 0.00 0.00 32.23 34.54 1itp h LYS 23 CO -0.71 -0.28 0.66 -0.44 -0.57 0.00 0.00 179.45 178.10 1itp h ASP 24 N -0.87 1.12 -0.92 0.86 5.19 0.19 -0.99 116.42 121.00 1itp h ASP 24 Ca -0.06 -0.02 0.18 0.00 -0.62 0.00 0.00 57.03 56.50 1itp h ASP 24 Cb 0.57 -0.27 -0.10 0.00 0.18 0.00 0.00 39.33 39.70 1itp h ASP 24 CO 0.10 0.80 0.50 -0.33 -3.12 0.00 0.00 179.24 177.19 1itp h GLU 25 N 1.32 0.62 -0.11 3.56 4.39 0.22 0.27 114.58 124.84 1itp h GLU 25 Ca 0.38 -0.04 -0.22 0.00 0.34 0.00 0.00 59.36 59.82 1itp h GLU 25 Cb -0.09 -0.14 0.01 0.00 -0.10 0.00 0.00 28.75 28.42 1itp h GLU 25 CO -0.10 0.41 -0.81 -0.24 -1.16 0.00 0.00 179.01 177.12 1itp h VAL 26 N 0.64 1.31 0.39 3.13 3.04 -0.75 0.77 116.25 124.78 1itp h VAL 26 Ca 0.53 -2.06 -0.00 0.00 -1.01 0.00 0.00 66.70 64.15 1itp h VAL 26 Cb 0.83 2.07 -0.03 0.00 -2.01 0.00 0.00 31.29 32.16 1itp h VAL 26 CO -0.40 0.64 -0.42 0.40 -1.01 0.00 0.00 177.57 176.78 1itp h ILE 27 N 0.45 0.15 -0.48 3.17 1.08 0.54 1.22 117.51 123.65 1itp h ILE 27 Ca -0.06 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.37 1itp h ILE 27 Cb 1.43 0.15 -0.02 0.00 -3.07 0.00 0.00 36.82 35.31 1itp h ILE 27 CO 0.16 0.00 0.14 0.00 -0.69 0.00 0.00 178.15 177.76 1itp h ALA 28 N -0.50 0.63 -0.13 1.87 0.00 -0.68 -3.27 119.26 117.18 1itp h ALA 28 Ca -0.03 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1itp h ALA 28 Cb 0.75 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1itp h ALA 28 CO -0.08 0.29 0.00 -1.91 0.00 0.00 0.00 179.25 177.55 1itp n GLU 29 N -4.51 0.00 0.08 0.00 2.13 0.26 -4.96 120.64 113.64 1itp n GLU 29 Ca 0.01 0.56 0.00 0.00 0.66 0.00 0.00 57.16 58.40 1itp n GLU 29 Cb 0.20 -1.48 0.00 0.00 0.27 0.00 0.00 31.44 30.43 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 -0.98 -1.84 3.10 8.31 0.00 0.41 -5.05 105.19 109.13 1itp n GLY 30 Ca 0.00 0.48 -0.36 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.45 -3.09 3.39 -0.02 0.00 -0.51 -4.69 105.19 98.82 1itp n GLY 31 Ca 0.00 -0.43 -0.22 0.00 0.00 0.00 0.00 46.02 45.37 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 0.30 -0.05 2.61 2.01 0.19 -2.75 115.64 115.87 1itp s THR 32 Ca 0.43 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 60.43 1itp s THR 32 Cb -0.01 -2.43 0.02 0.00 0.01 0.00 0.00 72.50 70.09 1itp s THR 32 CO 0.69 0.00 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.96 1itp s ILE 33 N -3.39 0.49 -0.08 1.82 -1.09 -1.26 -1.74 121.20 115.96 1itp s ILE 33 Ca 0.32 -0.06 0.08 0.00 -2.23 0.00 0.00 60.65 58.76 1itp s ILE 33 Cb 0.03 -0.55 -0.11 0.00 -1.58 0.00 0.00 42.46 40.26 1itp s ILE 33 CO 0.20 0.23 0.05 0.35 -1.23 0.00 0.00 174.94 174.53 1itp n THR 34 N 4.29 0.52 -3.71 2.92 -2.24 -1.03 -4.95 114.28 110.08 1itp n THR 34 Ca -0.21 -0.34 -0.12 0.00 -2.27 0.00 0.00 64.05 61.11 1itp n THR 34 Cb 0.51 -0.67 -0.07 0.00 -2.10 0.00 0.00 70.33 68.00 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 -3.93 -0.19 0.24 3.42 0.01 -0.43 -5.04 114.94 109.01 1itp s ASN 35 Ca -0.04 -0.14 0.02 0.00 -0.71 0.00 0.00 52.86 52.00 1itp s ASN 35 Cb 0.03 0.39 -0.05 0.00 0.41 0.00 0.00 41.25 42.03 1itp s ASN 35 CO 0.35 -0.66 0.04 -1.83 -1.51 0.00 0.00 177.10 173.48 1itp s GLU 36 N -2.67 1.35 -0.55 -0.60 1.03 -1.26 -0.21 118.70 115.80 1itp s GLU 36 Ca -0.04 -1.70 0.04 0.00 0.03 0.00 0.00 54.97 53.29 1itp s GLU 36 Cb -0.00 -0.46 0.15 0.00 -0.80 0.00 0.00 34.13 33.02 1itp s GLU 36 CO -0.04 -0.18 0.35 0.71 -1.33 0.00 0.00 175.26 174.78 1itp s TYR 37 N -3.56 2.64 -1.23 4.83 2.02 0.10 -4.85 117.35 117.29 1itp s TYR 37 Ca 0.32 -2.88 -0.14 0.00 -0.37 0.00 0.00 57.07 53.99 1itp s TYR 37 Cb 0.07 -2.20 0.15 0.00 -0.40 0.00 0.00 41.96 39.58 1itp s TYR 37 CO 0.10 -0.69 1.52 0.27 -1.57 0.00 0.00 175.55 175.18 1itp n ASN 38 N 2.77 5.15 -4.67 2.29 0.23 -1.26 -2.50 115.26 117.27 1itp n ASN 38 Ca 0.16 -2.97 -0.29 0.00 -0.53 0.00 0.00 54.58 50.95 1itp n ASN 38 Cb 0.36 -1.60 -0.10 0.00 -2.08 0.00 0.00 39.78 36.36 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 2.07 2.04 -0.02 -3.83 -1.94 0.09 -5.06 119.30 112.65 1itp s MET 39 Ca 0.45 -2.13 -0.03 0.00 -1.71 0.00 0.00 55.69 52.27 1itp s MET 39 Cb -0.01 -1.67 -0.02 0.00 2.01 0.00 0.00 34.83 35.14 1itp s MET 39 CO 0.02 -0.13 0.29 -1.00 -0.01 0.00 0.00 175.02 174.19 1itp h PRO 40 N 1.63 -0.10 -0.01 2.03 0.13 -2.03 -3.34 132.00 130.31 1itp h PRO 40 Ca -0.44 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1itp h PRO 40 Cb 1.26 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1itp h PRO 40 CO 0.78 -0.06 0.00 0.41 -0.23 0.00 0.00 178.00 178.89 1itp n GLY 41 N 1.15 -0.75 2.72 1.56 0.00 -1.26 -4.60 105.19 104.01 1itp n GLY 41 Ca -0.01 -0.26 -0.27 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.00 0.59 -0.48 1.61 -2.45 -1.25 -5.07 119.30 110.25 1itp s MET 42 Ca 0.45 -0.38 0.03 0.00 -1.25 0.00 0.00 55.69 54.54 1itp s MET 42 Cb 0.21 -2.06 0.13 0.00 1.25 0.00 0.00 34.83 34.37 1itp s MET 42 CO 0.36 -0.64 0.25 0.15 1.05 0.00 0.00 175.02 176.19 1itp s LYS 43 N 1.89 1.63 0.03 4.11 3.01 -1.26 -0.73 119.74 128.41 1itp s LYS 43 Ca -0.01 -2.32 0.00 0.00 -1.01 0.00 0.00 55.97 52.63 1itp s LYS 43 Cb -0.17 -2.80 -0.00 0.00 -1.01 0.00 0.00 37.83 33.85 1itp s LYS 43 CO -0.08 -1.14 0.04 0.41 0.51 0.00 0.00 175.35 175.09 1itp n GLY 44 N 3.30 3.27 3.48 -3.33 0.00 -1.04 -1.76 105.19 109.11 1itp n GLY 44 Ca 0.07 -1.47 -0.10 0.00 0.00 0.00 0.00 46.02 44.53 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 -4.19 -0.19 -0.02 1.61 -0.12 -1.01 0.02 117.98 114.08 1itp s PHE 45 Ca 0.03 -0.13 0.02 0.00 -0.05 0.00 0.00 56.93 56.80 1itp s PHE 45 Cb -0.00 0.40 0.00 0.00 -0.63 0.00 0.00 43.02 42.79 1itp s PHE 45 CO 0.02 -0.88 -0.08 0.00 -0.05 0.00 0.00 175.22 174.24 1itp s ALA 46 N -3.85 0.73 0.00 1.99 0.00 0.71 -2.94 121.76 118.41 1itp s ALA 46 Ca 0.07 -0.27 0.00 0.00 0.00 0.00 0.00 51.96 51.76 1itp s ALA 46 Cb -0.01 -0.28 0.00 0.00 0.00 0.00 0.00 23.12 22.84 1itp s ALA 46 CO -0.06 0.12 0.00 0.41 0.00 0.00 0.00 175.76 176.23 1itp n GLY 47 N 3.28 1.80 3.43 0.00 0.00 -1.06 -1.32 105.19 111.33 1itp n GLY 47 Ca -0.18 -0.68 -0.44 0.00 0.00 0.00 0.00 46.02 44.72 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 2.99 0.00 1.61 2.02 -0.71 -0.26 118.70 125.23 1itp s GLU 48 Ca 0.00 -1.14 0.00 0.00 0.02 0.00 0.00 54.97 53.85 1itp s GLU 48 Cb 0.00 -4.05 0.00 0.00 0.10 0.00 0.00 34.13 30.18 1itp s GLU 48 CO 0.00 -0.90 0.00 1.28 0.02 0.00 0.00 175.26 175.66 1itp n LEU 49 N 5.25 0.00 0.00 1.80 4.32 -0.63 0.54 117.00 128.28 1itp n LEU 49 Ca -0.11 0.00 -0.03 0.00 -0.02 0.00 0.00 56.01 55.85 1itp n LEU 49 Cb 0.45 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.25 1itp n LEU 49 CO 0.45 -0.29 0.09 0.41 -1.22 0.00 0.00 177.39 176.83 1itp n THR 50 N -0.58 0.00 0.04 -5.08 -1.04 -1.26 -2.61 114.28 103.75 1itp n THR 50 Ca 0.00 -0.35 -0.15 0.00 -2.04 0.00 0.00 64.05 61.51 1itp n THR 50 Cb 0.00 0.27 -0.05 0.00 -1.82 0.00 0.00 70.33 68.73 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 0.53 0.69 -2.82 0.13 -1.98 -2.19 132.00 126.36 1itp h PRO 51 Ca -0.08 -0.52 -0.03 0.00 -0.87 0.00 0.00 66.00 64.49 1itp h PRO 51 Cb 0.32 0.14 0.01 0.00 0.13 0.00 0.00 31.00 31.59 1itp h PRO 51 CO 0.10 1.15 -0.33 0.37 -0.23 0.00 0.00 178.00 179.06 1itp h GLN 52 N 0.32 -0.89 -0.75 0.86 4.15 -2.01 -2.86 115.11 113.93 1itp h GLN 52 Ca -0.08 0.06 0.14 0.00 0.77 0.00 0.00 58.65 59.55 1itp h GLN 52 Cb 1.53 0.20 -0.05 0.00 0.21 0.00 0.00 27.48 29.37 1itp h GLN 52 CO 0.16 -0.60 0.50 0.77 -1.93 0.00 0.00 178.83 177.74 1itp h SER 53 N -1.10 0.40 0.00 -0.69 0.02 -1.97 -2.82 113.55 107.38 1itp h SER 53 Ca -0.09 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1itp h SER 53 Cb 0.71 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1itp h SER 53 CO 0.16 0.21 0.00 0.18 -1.14 0.00 0.00 176.83 176.23 1itp n LEU 54 N -4.48 0.00 -0.60 5.07 4.77 -0.82 -1.08 117.00 119.86 1itp n LEU 54 Ca 0.14 0.62 0.47 0.00 -0.03 0.00 0.00 56.01 57.21 1itp n LEU 54 Cb 0.52 -0.12 0.74 0.00 -2.33 0.00 0.00 43.42 42.22 1itp n LEU 54 CO 0.33 -0.12 1.33 0.41 -1.33 0.00 0.00 177.39 178.01 1itp n THR 55 N -1.18 -0.09 -0.07 -5.08 -1.04 -1.09 0.13 114.28 105.85 1itp n THR 55 Ca 0.00 1.54 -0.07 0.00 -2.04 0.00 0.00 64.05 63.47 1itp n THR 55 Cb 0.00 -2.54 -0.05 0.00 -1.82 0.00 0.00 70.33 65.91 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 -0.21 0.00 -2.82 3.11 -0.86 -1.01 116.57 114.78 1itp h LYS 56 Ca 0.88 0.01 -0.16 0.00 -2.81 0.00 0.00 60.65 58.58 1itp h LYS 56 Cb 3.30 0.05 -0.03 0.00 -1.00 0.00 0.00 32.23 34.55 1itp h LYS 56 CO -0.17 -0.14 -1.51 1.97 -2.81 0.00 0.00 179.45 176.79 1itp n PHE 57 N -4.13 0.82 -0.32 1.91 1.16 0.70 -3.65 117.46 113.95 1itp n PHE 57 Ca -0.02 0.27 0.10 0.00 -1.87 0.00 0.00 57.45 55.93 1itp n PHE 57 Cb 0.18 -1.03 0.27 0.00 -1.61 0.00 0.00 39.48 37.30 1itp n PHE 57 CO 0.00 0.00 0.00 1.96 -1.87 0.00 0.00 176.76 176.85 1itp h GLN 58 N 0.00 0.67 0.05 3.97 4.20 0.12 1.36 115.11 125.47 1itp h GLN 58 Ca -0.17 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.42 1itp h GLN 58 Cb 1.55 -0.15 0.01 0.00 0.30 0.00 0.00 27.48 29.19 1itp h GLN 58 CO 0.04 0.44 -0.34 0.78 -0.67 0.00 0.00 178.83 179.08 1itp h GLY 59 N 0.69 0.17 2.00 3.46 0.00 -1.34 -3.18 103.07 104.87 1itp h GLY 59 Ca 0.52 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1itp h GLY 59 CO -0.37 0.34 0.00 -0.10 0.00 0.00 0.00 176.54 176.40 1itp n LEU 60 N -4.42 0.31 -4.10 3.11 7.94 -0.82 -4.78 117.00 114.24 1itp n LEU 60 Ca -0.11 0.60 -0.36 0.00 -1.11 0.00 0.00 56.01 55.03 1itp n LEU 60 Cb 0.60 -0.60 0.07 0.00 0.53 0.00 0.00 43.42 44.02 1itp n LEU 60 CO 0.40 -0.56 -1.30 1.67 -1.11 0.00 0.00 177.39 176.49 1itp n GLN 61 N -1.87 -0.26 0.00 1.96 7.27 0.46 -2.64 117.38 122.30 1itp n GLN 61 Ca 0.01 -0.07 0.00 0.00 0.07 0.00 0.00 57.00 57.01 1itp n GLN 61 Cb 0.11 -1.22 0.00 0.00 2.41 0.00 0.00 30.24 31.54 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 3.00 2.15 0.31 1.69 0.00 -0.96 -4.55 105.19 106.83 1itp n GLY 62 Ca -0.00 -0.28 0.08 0.00 0.00 0.00 0.00 46.02 45.81 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 1.29 1.98 0.21 1.61 -0.08 -1.08 -4.83 116.55 115.65 1itp n ASP 63 Ca 0.00 -3.28 0.00 0.00 -1.51 0.00 0.00 54.79 50.00 1itp n ASP 63 Cb 0.00 -0.45 0.00 0.00 2.34 0.00 0.00 41.12 43.01 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 -1.20 -3.75 -4.73 -2.67 7.94 -1.24 -5.01 117.00 106.34 1itp n LEU 64 Ca 0.16 0.81 -0.37 0.00 -1.11 0.00 0.00 56.01 55.50 1itp n LEU 64 Cb 0.67 3.54 -0.06 0.00 0.53 0.00 0.00 43.42 48.10 1itp n LEU 64 CO -0.01 0.22 0.08 -0.63 -1.11 0.00 0.00 177.39 175.94 1itp s ILE 65 N -1.85 5.24 -0.10 1.96 1.01 -1.26 -2.49 121.20 123.71 1itp s ILE 65 Ca 0.00 0.75 -0.18 0.00 0.00 0.00 0.00 60.65 61.22 1itp s ILE 65 Cb 0.00 -3.72 -0.28 0.00 0.01 0.00 0.00 42.46 38.47 1itp s ILE 65 CO 0.00 0.37 0.62 -0.78 0.00 0.00 0.00 174.94 175.14 1itp h ASP 66 N 6.62 0.36 -3.60 3.58 3.58 0.15 -2.55 116.42 124.57 1itp h ASP 66 Ca -0.41 -0.86 -0.14 0.00 0.42 0.00 0.00 57.03 56.03 1itp h ASP 66 Cb 1.17 -0.12 -0.26 0.00 1.72 0.00 0.00 39.33 41.85 1itp h ASP 66 CO 0.75 1.54 -0.33 -0.44 -2.88 0.00 0.00 179.24 177.88 1itp s SER 67 N -6.98 -0.39 -0.13 2.28 0.01 -1.18 -4.92 113.70 102.40 1itp s SER 67 Ca -0.19 0.73 0.00 0.00 1.31 0.00 0.00 55.95 57.80 1itp s SER 67 Cb 0.03 0.68 -0.01 0.00 0.21 0.00 0.00 66.02 66.93 1itp s SER 67 CO 0.77 -0.15 -0.14 -0.51 0.41 0.00 0.00 173.24 173.62 1itp s ILE 68 N 0.71 2.98 -0.58 1.44 1.10 -1.26 -0.46 121.20 125.13 1itp s ILE 68 Ca -0.04 -0.69 0.06 0.00 -0.51 0.00 0.00 60.65 59.47 1itp s ILE 68 Cb -0.05 -2.24 0.23 0.00 0.15 0.00 0.00 42.46 40.54 1itp s ILE 68 CO -0.05 0.53 0.63 1.21 -2.11 0.00 0.00 174.94 175.15 1itp n GLU 69 N 3.50 1.87 -1.91 3.50 2.13 0.87 -5.00 120.64 125.59 1itp n GLU 69 Ca -0.18 -4.22 -0.42 0.00 0.66 0.00 0.00 57.16 53.00 1itp n GLU 69 Cb 0.53 -1.99 -0.03 0.00 0.27 0.00 0.00 31.44 30.22 1itp n GLU 69 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 1itp s GLU 70 N -1.88 4.21 -0.08 5.31 2.02 -1.26 -2.25 118.70 124.76 1itp s GLU 70 Ca 0.36 2.39 0.20 0.00 0.02 0.00 0.00 54.97 57.94 1itp s GLU 70 Cb 0.12 -3.15 0.42 0.00 0.10 0.00 0.00 34.13 31.62 1itp s GLU 70 CO -0.07 -0.62 1.19 -3.47 0.02 0.00 0.00 175.26 172.31 1itp n ASP 71 N 3.96 1.27 0.00 -0.19 -0.08 -1.10 -4.89 116.55 115.53 1itp n ASP 71 Ca 0.14 -2.74 0.00 0.00 -1.51 0.00 0.00 54.79 50.68 1itp n ASP 71 Cb 0.38 -0.39 0.00 0.00 2.34 0.00 0.00 41.12 43.45 1itp n ASP 71 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1itp n GLY 72 N -0.14 -0.31 3.63 0.27 0.00 -1.21 -4.09 105.19 103.34 1itp n GLY 72 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 1itp n GLY 72 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1itp s ILE 73 N -0.67 4.46 -0.13 -0.61 -1.16 -1.26 -4.67 121.20 117.16 1itp s ILE 73 Ca 0.00 1.66 -0.27 0.00 -0.51 0.00 0.00 60.65 61.53 1itp s ILE 73 Cb 0.00 -4.44 -0.02 0.00 0.61 0.00 0.00 42.46 38.61 1itp s ILE 73 CO 0.00 -0.56 0.89 0.54 -2.81 0.00 0.00 174.94 173.00 1itp s VAL 74 N 3.78 4.86 0.11 4.00 0.11 -1.26 -4.96 120.40 127.04 1itp s VAL 74 Ca 0.46 1.78 -0.33 0.00 -2.93 0.00 0.00 61.98 60.96 1itp s VAL 74 Cb -0.11 -4.20 -0.13 0.00 -1.53 0.00 0.00 36.38 30.41 1itp s VAL 74 CO 0.18 0.04 1.57 0.74 -3.33 0.00 0.00 175.10 174.30 1itp h THR 75 N 5.11 0.06 -3.27 5.04 2.02 -2.00 -3.41 112.91 116.46 1itp h THR 75 Ca -0.31 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 66.56 1itp h THR 75 Cb 1.14 0.06 -0.35 0.00 -1.74 0.00 0.00 68.15 67.26 1itp h THR 75 CO 0.83 0.00 -0.67 0.28 0.37 0.00 0.00 175.52 176.33 1itp s THR 76 N -5.83 -0.14 0.00 3.16 -1.32 -1.26 -5.31 115.64 104.95 1itp s THR 76 Ca -0.16 0.31 0.00 0.00 -1.21 0.00 0.00 61.69 60.63 1itp s THR 76 Cb 0.07 -0.20 0.00 0.00 -1.51 0.00 0.00 72.50 70.85 1itp s THR 76 CO 0.62 0.13 0.37 0.00 -2.21 0.00 0.00 174.62 173.53