#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 -4.50 -0.33 1.61 3.41 -1.26 -4.90 113.62 107.65 1itp n SER 2 Ca 0.00 0.52 0.04 0.00 -0.26 0.00 0.00 58.87 59.18 1itp n SER 2 Cb 0.00 -1.41 0.10 0.00 -0.26 0.00 0.00 64.21 62.64 1itp n SER 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1itp n ALA 3 N -0.59 2.21 0.00 7.33 0.00 -1.02 -5.03 120.51 123.40 1itp n ALA 3 Ca 0.00 -1.41 0.00 0.00 0.00 0.00 0.00 53.44 52.03 1itp n ALA 3 Cb 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.17 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 -0.28 0.36 3.94 0.00 0.00 -1.25 0.17 105.19 108.13 1itp n GLY 4 Ca 0.08 -2.30 -0.26 0.00 0.00 0.00 0.00 46.02 43.55 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 -0.01 3.46 0.17 1.61 -2.85 -1.26 -1.91 119.74 118.95 1itp s LYS 5 Ca 0.00 -0.54 -0.00 0.00 -1.00 0.00 0.00 55.97 54.43 1itp s LYS 5 Cb 0.00 -2.91 -0.04 0.00 -2.06 0.00 0.00 37.83 32.82 1itp s LYS 5 CO 0.00 0.46 0.06 -0.06 0.10 0.00 0.00 175.35 175.91 1itp s PHE 6 N -1.83 1.07 -0.33 1.78 0.40 0.53 -2.31 117.98 117.29 1itp s PHE 6 Ca 0.36 -1.20 -0.01 0.00 -0.60 0.00 0.00 56.93 55.48 1itp s PHE 6 Cb -0.11 -0.59 0.13 0.00 0.51 0.00 0.00 43.02 42.96 1itp s PHE 6 CO 0.29 -0.44 0.19 0.42 0.70 0.00 0.00 175.22 176.38 1itp s ILE 7 N -3.93 0.04 0.26 0.64 1.01 -0.86 -2.51 121.20 115.84 1itp s ILE 7 Ca 0.28 -1.32 0.06 0.00 0.00 0.00 0.00 60.65 59.67 1itp s ILE 7 Cb 0.07 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.46 1itp s ILE 7 CO 0.05 -0.88 0.29 0.68 0.00 0.00 0.00 174.94 175.09 1itp s VAL 8 N 1.48 4.71 0.03 2.92 -7.23 -1.18 -0.25 120.40 120.88 1itp s VAL 8 Ca 0.15 -1.20 0.00 0.00 -1.81 0.00 0.00 61.98 59.12 1itp s VAL 8 Cb -0.20 -3.58 -0.02 0.00 0.56 0.00 0.00 36.38 33.13 1itp s VAL 8 CO -0.14 -0.32 -0.04 -0.63 -0.31 0.00 0.00 175.10 173.67 1itp s ILE 9 N -2.08 0.18 0.01 -0.62 1.09 0.88 -2.54 121.20 118.11 1itp s ILE 9 Ca 0.35 -0.99 0.02 0.00 -1.10 0.00 0.00 60.65 58.93 1itp s ILE 9 Cb -0.08 -0.38 -0.04 0.00 -1.06 0.00 0.00 42.46 40.90 1itp s ILE 9 CO 0.27 -0.51 -0.02 -0.36 -0.10 0.00 0.00 174.94 174.22 1itp s PHE 10 N -1.59 3.00 0.91 3.97 0.08 -0.63 0.19 117.98 123.90 1itp s PHE 10 Ca -0.14 0.03 -0.12 0.00 0.12 0.00 0.00 56.93 56.82 1itp s PHE 10 Cb -0.09 -1.64 0.19 0.00 -0.57 0.00 0.00 43.02 40.91 1itp s PHE 10 CO -0.01 0.43 0.42 0.36 -0.10 0.00 0.00 175.22 176.32 1itp n LYS 11 N 1.37 -1.70 -1.12 0.44 2.85 0.05 -4.52 118.16 115.53 1itp n LYS 11 Ca -0.15 -0.71 -0.25 0.00 -1.05 0.00 0.00 58.31 56.15 1itp n LYS 11 Cb 0.53 -1.30 0.10 0.00 -0.65 0.00 0.00 35.03 33.71 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 -1.99 5.78 0.00 -5.58 5.15 -1.26 -4.05 115.26 113.30 1itp n ASN 12 Ca 0.07 -3.47 0.00 0.00 -0.60 0.00 0.00 54.58 50.58 1itp n ASN 12 Cb 0.29 -0.91 0.00 0.00 -0.53 0.00 0.00 39.78 38.63 1itp n ASN 12 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1itp n ASP 13 N -0.66 1.50 -3.94 1.20 2.03 -1.26 -5.07 116.55 110.34 1itp n ASP 13 Ca 0.51 0.00 -0.36 0.00 0.52 0.00 0.00 54.79 55.46 1itp n ASP 13 Cb 0.99 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 41.40 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 -2.58 0.00 -2.77 5.18 3.14 -1.26 -4.93 118.33 115.11 1itp n VAL 14 Ca 0.00 -0.47 -0.24 0.00 -2.96 0.00 0.00 64.34 60.68 1itp n VAL 14 Cb 0.38 0.00 0.02 0.00 -1.06 0.00 0.00 33.84 33.18 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 -0.93 5.70 0.09 6.55 1.04 -1.26 -4.94 113.70 119.95 1itp s SER 15 Ca 0.52 0.39 -0.20 0.00 0.48 0.00 0.00 55.95 57.14 1itp s SER 15 Cb -0.44 -1.53 -0.09 0.00 0.10 0.00 0.00 66.02 64.06 1itp s SER 15 CO 0.63 -0.85 1.58 -0.08 0.98 0.00 0.00 173.24 175.49 1itp h GLU 16 N 0.19 0.34 -0.72 4.02 4.57 -1.99 0.62 114.58 121.61 1itp h GLU 16 Ca -0.46 -0.08 -0.04 0.00 -1.18 0.00 0.00 59.36 57.60 1itp h GLU 16 Cb 1.26 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.77 1itp h GLU 16 CO 0.58 0.45 0.27 -0.44 -1.18 0.00 0.00 179.01 178.69 1itp h ASP 17 N 0.16 0.99 -0.35 1.04 3.32 -1.99 -1.63 116.42 117.97 1itp h ASP 17 Ca 0.07 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 1itp h ASP 17 Cb 0.26 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 1itp h ASP 17 CO 0.00 0.89 0.17 0.11 -1.72 0.00 0.00 179.24 178.70 1itp h LYS 18 N 1.05 0.50 0.35 3.56 1.79 -1.88 0.17 116.57 122.12 1itp h LYS 18 Ca 0.24 -0.07 -0.00 0.00 -2.18 0.00 0.00 60.65 58.64 1itp h LYS 18 Cb 0.22 -0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 30.75 1itp h LYS 18 CO -0.02 0.45 -0.44 0.82 -1.08 0.00 0.00 179.45 179.19 1itp h ILE 19 N 0.43 0.13 -0.31 1.86 2.04 -0.41 0.37 117.51 121.63 1itp h ILE 19 Ca 0.12 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.06 1itp h ILE 19 Cb 0.11 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.31 1itp h ILE 19 CO -0.02 0.00 0.22 0.03 0.00 0.00 0.00 178.15 178.38 1itp h ARG 20 N -0.83 0.06 0.19 2.37 3.08 -1.17 -2.45 114.38 115.63 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 0.76 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.80 1itp h ARG 20 CO -0.12 0.04 -0.09 0.93 -1.07 0.00 0.00 179.97 179.66 1itp h GLU 21 N 0.07 -0.25 -0.94 0.04 5.08 0.96 -1.67 114.58 117.87 1itp h GLU 21 Ca 0.14 0.02 0.38 0.00 -1.00 0.00 0.00 59.36 58.90 1itp h GLU 21 Cb 0.49 0.06 -0.17 0.00 0.50 0.00 0.00 28.75 29.62 1itp h GLU 21 CO -0.01 -0.16 0.44 2.41 -1.00 0.00 0.00 179.01 180.69 1itp n THR 22 N -3.01 -0.39 0.25 1.13 -1.04 0.11 0.11 114.28 111.44 1itp n THR 22 Ca -0.03 1.92 -0.15 0.00 -2.04 0.00 0.00 64.05 63.75 1itp n THR 22 Cb 0.10 -3.08 -0.08 0.00 -1.82 0.00 0.00 70.33 65.45 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 -0.60 -0.83 -2.82 1.57 -1.42 -2.34 116.57 110.13 1itp h LYS 23 Ca 0.77 0.04 0.10 0.00 -1.87 0.00 0.00 60.65 59.69 1itp h LYS 23 Cb 1.99 0.14 -0.07 0.00 0.08 0.00 0.00 32.23 34.36 1itp h LYS 23 CO -0.74 -0.32 0.47 -0.44 -0.57 0.00 0.00 179.45 177.85 1itp h ASP 24 N -0.81 0.67 -0.97 0.86 5.19 0.18 0.19 116.42 121.73 1itp h ASP 24 Ca -0.06 0.05 0.18 0.00 -0.62 0.00 0.00 57.03 56.57 1itp h ASP 24 Cb 0.56 -0.08 -0.09 0.00 0.18 0.00 0.00 39.33 39.90 1itp h ASP 24 CO 0.10 0.38 0.61 -0.08 -3.12 0.00 0.00 179.24 177.13 1itp h GLU 25 N 0.79 0.69 0.08 3.56 4.57 0.41 0.11 114.58 124.79 1itp h GLU 25 Ca 0.40 -0.04 -0.23 0.00 -1.18 0.00 0.00 59.36 58.31 1itp h GLU 25 Cb 0.38 -0.16 0.02 0.00 -0.16 0.00 0.00 28.75 28.84 1itp h GLU 25 CO -0.25 0.46 -0.96 -0.24 -1.18 0.00 0.00 179.01 176.84 1itp h VAL 26 N 0.71 1.37 -0.37 0.32 3.04 -0.32 0.17 116.25 121.17 1itp h VAL 26 Ca 0.53 -2.34 0.08 0.00 -1.01 0.00 0.00 66.70 63.96 1itp h VAL 26 Cb 0.88 2.73 -0.08 0.00 -2.01 0.00 0.00 31.29 32.81 1itp h VAL 26 CO -0.30 0.69 -0.21 0.40 -1.01 0.00 0.00 177.57 177.14 1itp h ILE 27 N 0.05 0.40 0.24 3.17 1.08 0.12 0.42 117.51 123.00 1itp h ILE 27 Ca -0.14 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.32 1itp h ILE 27 Cb 1.67 0.40 0.00 0.00 -3.07 0.00 0.00 36.82 35.82 1itp h ILE 27 CO 0.18 0.00 -0.12 0.00 -0.69 0.00 0.00 178.15 177.53 1itp h ALA 28 N 1.06 -0.33 -0.10 1.87 0.00 -0.95 -3.36 119.26 117.46 1itp h ALA 28 Ca 0.18 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1itp h ALA 28 Cb 0.44 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1itp h ALA 28 CO -0.47 -0.33 -0.06 -1.91 0.00 0.00 0.00 179.25 176.49 1itp n GLU 29 N -4.99 -0.04 0.05 0.00 4.07 0.58 -4.86 120.64 115.45 1itp n GLU 29 Ca -0.06 0.98 0.00 0.00 -0.06 0.00 0.00 57.16 58.02 1itp n GLU 29 Cb 0.19 -1.47 0.00 0.00 -0.06 0.00 0.00 31.44 30.11 1itp n GLU 29 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1itp n GLY 30 N -1.02 -1.87 3.04 8.31 0.00 0.14 -5.05 105.19 108.74 1itp n GLY 30 Ca 0.00 0.50 -0.37 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.46 -3.73 3.53 -0.02 0.00 -0.63 -4.71 105.19 98.16 1itp n GLY 31 Ca 0.00 -0.52 -0.26 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.03 0.51 -0.04 2.61 2.01 0.17 -2.75 115.64 116.11 1itp s THR 32 Ca 0.40 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 60.41 1itp s THR 32 Cb -0.06 -2.28 0.02 0.00 0.01 0.00 0.00 72.50 70.19 1itp s THR 32 CO 0.74 0.00 -0.02 -0.63 -0.69 0.00 0.00 174.62 174.03 1itp s ILE 33 N -3.17 0.35 -0.06 1.82 -1.09 -1.26 -1.77 121.20 116.01 1itp s ILE 33 Ca 0.22 0.01 0.06 0.00 -2.23 0.00 0.00 60.65 58.71 1itp s ILE 33 Cb 0.01 -0.43 -0.08 0.00 -1.58 0.00 0.00 42.46 40.38 1itp s ILE 33 CO 0.15 0.19 0.03 1.07 -1.23 0.00 0.00 174.94 175.15 1itp n THR 34 N 4.24 0.45 -3.76 2.92 5.66 -1.01 -4.90 114.28 117.88 1itp n THR 34 Ca -0.23 -0.28 -0.10 0.00 -3.05 0.00 0.00 64.05 60.39 1itp n THR 34 Cb 0.50 -0.78 -0.05 0.00 -1.55 0.00 0.00 70.33 68.45 1itp n THR 34 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 1itp s ASN 35 N -3.80 -0.15 0.19 1.09 3.84 0.70 -5.01 114.94 111.81 1itp s ASN 35 Ca -0.03 -0.52 0.00 0.00 0.21 0.00 0.00 52.86 52.52 1itp s ASN 35 Cb 0.02 0.49 -0.04 0.00 -0.55 0.00 0.00 41.25 41.16 1itp s ASN 35 CO 0.28 -0.91 0.07 -1.83 -2.79 0.00 0.00 177.10 171.92 1itp s GLU 36 N -3.87 1.18 -0.44 0.43 1.03 -1.26 -0.51 118.70 115.26 1itp s GLU 36 Ca 0.08 -1.60 0.02 0.00 0.03 0.00 0.00 54.97 53.50 1itp s GLU 36 Cb 0.02 -0.01 0.13 0.00 -0.80 0.00 0.00 34.13 33.47 1itp s GLU 36 CO -0.07 -0.27 0.22 0.71 -1.33 0.00 0.00 175.26 174.52 1itp s TYR 37 N -3.91 2.18 -1.20 4.83 2.02 0.91 -4.82 117.35 117.37 1itp s TYR 37 Ca 0.32 -2.49 -0.12 0.00 -0.37 0.00 0.00 57.07 54.41 1itp s TYR 37 Cb 0.07 -2.04 0.20 0.00 -0.40 0.00 0.00 41.96 39.79 1itp s TYR 37 CO 0.08 -0.79 1.44 0.27 -1.57 0.00 0.00 175.55 174.98 1itp n ASN 38 N 3.61 5.31 -4.89 2.29 0.23 -1.26 -2.51 115.26 118.04 1itp n ASN 38 Ca 0.07 -3.02 -0.22 0.00 -0.53 0.00 0.00 54.58 50.88 1itp n ASN 38 Cb 0.35 -1.51 -0.02 0.00 -2.08 0.00 0.00 39.78 36.51 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 0.74 2.45 -0.01 -3.83 -1.94 -0.29 -5.06 119.30 111.35 1itp s MET 39 Ca 0.40 -1.65 -0.02 0.00 -1.71 0.00 0.00 55.69 52.70 1itp s MET 39 Cb -0.02 -2.33 -0.01 0.00 2.01 0.00 0.00 34.83 34.48 1itp s MET 39 CO -0.01 -0.33 0.29 -1.00 -0.01 0.00 0.00 175.02 173.96 1itp h PRO 40 N 0.91 -0.07 -0.00 2.03 0.13 -2.04 -3.36 132.00 129.60 1itp h PRO 40 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1itp h PRO 40 Cb 1.28 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1itp h PRO 40 CO 0.56 -0.05 -0.12 0.41 -0.23 0.00 0.00 178.00 178.58 1itp n GLY 41 N 1.16 -0.84 3.06 1.56 0.00 -1.26 -4.75 105.19 104.13 1itp n GLY 41 Ca -0.01 -0.29 -0.28 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.43 2.20 -0.35 1.61 -2.45 -1.26 -4.97 119.30 111.65 1itp s MET 42 Ca 0.30 -0.56 -0.00 0.00 -1.25 0.00 0.00 55.69 54.17 1itp s MET 42 Cb 0.20 -1.84 0.12 0.00 1.25 0.00 0.00 34.83 34.56 1itp s MET 42 CO 0.47 -0.03 0.17 0.15 1.05 0.00 0.00 175.02 176.83 1itp s LYS 43 N 0.89 0.73 0.04 4.11 1.02 -1.26 -1.14 119.74 124.12 1itp s LYS 43 Ca -0.09 -1.29 0.00 0.00 0.02 0.00 0.00 55.97 54.61 1itp s LYS 43 Cb -0.15 -1.75 -0.00 0.00 -0.52 0.00 0.00 37.83 35.41 1itp s LYS 43 CO 0.00 -1.10 0.04 0.41 -0.92 0.00 0.00 175.35 173.79 1itp n GLY 44 N 4.35 3.37 3.41 -3.33 0.00 -1.04 -1.60 105.19 110.34 1itp n GLY 44 Ca 0.04 -1.51 -0.12 0.00 0.00 0.00 0.00 46.02 44.43 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 -3.79 -0.46 -0.01 1.61 -0.71 -1.05 -0.06 117.98 113.51 1itp s PHE 45 Ca 0.04 0.22 0.04 0.00 -1.04 0.00 0.00 56.93 56.19 1itp s PHE 45 Cb 0.00 0.50 -0.01 0.00 -1.21 0.00 0.00 43.02 42.30 1itp s PHE 45 CO 0.03 -0.83 -0.13 0.00 -1.34 0.00 0.00 175.22 172.95 1itp s ALA 46 N -3.77 1.05 0.00 1.99 0.00 0.33 -3.11 121.76 118.25 1itp s ALA 46 Ca 0.02 -0.56 0.00 0.00 0.00 0.00 0.00 51.96 51.42 1itp s ALA 46 Cb -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 23.12 22.85 1itp s ALA 46 CO -0.12 0.25 0.00 0.41 0.00 0.00 0.00 175.76 176.30 1itp n GLY 47 N 2.73 1.01 3.81 0.00 0.00 -1.05 -0.21 105.19 111.48 1itp n GLY 47 Ca -0.14 -0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.28 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 2.20 3.78 0.00 1.61 2.02 -0.73 -0.34 118.70 127.23 1itp s GLU 48 Ca 0.00 -0.17 0.00 0.00 0.02 0.00 0.00 54.97 54.82 1itp s GLU 48 Cb 0.00 -3.29 0.00 0.00 0.10 0.00 0.00 34.13 30.94 1itp s GLU 48 CO 0.00 0.56 0.00 1.28 0.02 0.00 0.00 175.26 177.12 1itp n LEU 49 N 2.68 0.00 0.00 1.80 4.77 -0.80 0.43 117.00 125.87 1itp n LEU 49 Ca -0.18 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.74 1itp n LEU 49 Cb 0.54 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.64 1itp n LEU 49 CO 0.34 0.00 0.26 0.41 -1.33 0.00 0.00 177.39 177.06 1itp n THR 50 N 0.00 0.00 0.13 -5.08 -1.04 -1.26 -2.44 114.28 104.59 1itp n THR 50 Ca 0.00 -0.67 -0.01 0.00 -2.04 0.00 0.00 64.05 61.34 1itp n THR 50 Cb 0.00 0.58 0.13 0.00 -1.82 0.00 0.00 70.33 69.21 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 0.33 -2.82 0.13 -1.99 -2.52 132.00 125.13 1itp h PRO 51 Ca -0.18 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.93 1itp h PRO 51 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 1itp h PRO 51 CO 0.23 0.64 -0.16 0.37 -0.23 0.00 0.00 178.00 178.85 1itp h GLN 52 N 0.00 -0.43 -0.86 0.86 4.15 -2.00 -2.86 115.11 113.97 1itp h GLN 52 Ca -0.01 0.03 0.12 0.00 0.77 0.00 0.00 58.65 59.56 1itp h GLN 52 Cb 1.24 0.10 -0.06 0.00 0.21 0.00 0.00 27.48 28.96 1itp h GLN 52 CO 0.08 -0.14 0.55 0.77 -1.93 0.00 0.00 178.83 178.17 1itp h SER 53 N -0.99 0.67 0.00 -0.69 0.02 -1.97 -2.64 113.55 107.95 1itp h SER 53 Ca -0.05 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1itp h SER 53 Cb 0.50 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.93 1itp h SER 53 CO 0.08 0.37 0.00 0.18 -1.14 0.00 0.00 176.83 176.31 1itp n LEU 54 N -4.54 0.00 -0.63 5.07 4.32 -0.95 -1.46 117.00 118.82 1itp n LEU 54 Ca 0.16 0.78 0.47 0.00 -0.02 0.00 0.00 56.01 57.40 1itp n LEU 54 Cb 0.40 -0.28 0.73 0.00 -1.62 0.00 0.00 43.42 42.65 1itp n LEU 54 CO 0.31 -0.28 1.32 0.41 -1.22 0.00 0.00 177.39 177.93 1itp n THR 55 N -1.56 -0.02 0.02 -5.08 -1.04 -1.08 0.21 114.28 105.74 1itp n THR 55 Ca 0.00 1.35 -0.01 0.00 -2.04 0.00 0.00 64.05 63.35 1itp n THR 55 Cb 0.00 -2.25 -0.01 0.00 -1.82 0.00 0.00 70.33 66.25 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 -0.08 -0.24 -2.82 3.11 -0.89 0.35 116.57 116.01 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 3.34 0.02 0.00 0.00 -1.00 0.00 0.00 32.23 34.59 1itp h LYS 56 CO -0.04 -0.05 0.00 1.97 -2.81 0.00 0.00 179.45 178.52 1itp n PHE 57 N -2.48 0.31 -0.01 1.91 1.16 0.84 -3.86 117.46 115.33 1itp n PHE 57 Ca -0.01 -0.15 -0.18 0.00 -1.87 0.00 0.00 57.45 55.24 1itp n PHE 57 Cb 0.04 0.00 -0.14 0.00 -1.61 0.00 0.00 39.48 37.77 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 0.55 0.72 0.13 3.97 6.02 0.57 -2.68 117.38 126.67 1itp n GLN 58 Ca 0.16 0.25 -0.01 0.00 -0.01 0.00 0.00 57.00 57.39 1itp n GLN 58 Cb 0.37 -1.71 0.15 0.00 1.02 0.00 0.00 30.24 30.07 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 1.82 0.00 -1.20 1.08 0.00 -1.03 -2.71 103.07 101.03 1itp h GLY 59 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.92 1itp h GLY 59 CO 0.07 0.00 -0.03 1.47 0.00 0.00 0.00 176.54 178.05 1itp n LEU 60 N -3.73 2.26 -3.98 3.11 -0.00 -1.25 -4.98 117.00 108.43 1itp n LEU 60 Ca -0.01 -0.76 -0.36 0.00 -0.00 0.00 0.00 56.01 54.88 1itp n LEU 60 Cb 0.64 -0.00 0.04 0.00 -0.00 0.00 0.00 43.42 44.09 1itp n LEU 60 CO 0.42 0.38 -1.42 1.67 -0.00 0.00 0.00 177.39 178.45 1itp n GLN 61 N 0.73 0.00 0.00 1.47 7.27 -1.03 -2.37 117.38 123.45 1itp n GLN 61 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.23 1itp n GLN 61 Cb 0.48 -1.00 0.00 0.00 2.41 0.00 0.00 30.24 32.14 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 3.48 2.03 1.38 1.69 0.00 -0.69 -4.56 105.19 108.53 1itp n GLY 62 Ca -0.02 -0.38 0.09 0.00 0.00 0.00 0.00 46.02 45.70 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 1.88 4.42 0.00 1.61 2.03 -1.00 -4.76 116.55 120.74 1itp n ASP 63 Ca 0.00 -2.45 0.00 0.00 0.52 0.00 0.00 54.79 52.86 1itp n ASP 63 Cb 0.00 -0.53 0.00 0.00 -0.72 0.00 0.00 41.12 39.87 1itp n ASP 63 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1itp n LEU 64 N 0.87 0.00 -4.69 -2.67 7.94 -1.25 -4.96 117.00 112.23 1itp n LEU 64 Ca 0.23 0.00 -0.42 0.00 -1.11 0.00 0.00 56.01 54.71 1itp n LEU 64 Cb 0.83 0.42 -0.03 0.00 0.53 0.00 0.00 43.42 45.17 1itp n LEU 64 CO 0.21 -0.47 0.74 -0.63 -1.11 0.00 0.00 177.39 176.12 1itp s ILE 65 N -0.95 4.82 -0.08 1.96 -1.09 -1.26 -0.77 121.20 123.83 1itp s ILE 65 Ca 0.00 2.00 -0.11 0.00 -2.23 0.00 0.00 60.65 60.31 1itp s ILE 65 Cb 0.00 -4.30 -0.29 0.00 -1.58 0.00 0.00 42.46 36.30 1itp s ILE 65 CO 0.00 0.06 0.56 -0.78 -1.23 0.00 0.00 174.94 173.54 1itp h ASP 66 N 7.02 0.51 -3.60 3.58 3.58 0.18 -1.84 116.42 125.85 1itp h ASP 66 Ca -0.34 -0.92 -0.11 0.00 0.42 0.00 0.00 57.03 56.08 1itp h ASP 66 Cb 1.17 -0.17 -0.25 0.00 1.72 0.00 0.00 39.33 41.80 1itp h ASP 66 CO 0.82 1.77 -0.23 -0.44 -2.88 0.00 0.00 179.24 178.29 1itp s SER 67 N -7.18 -0.50 -0.10 2.28 0.01 -1.17 -4.92 113.70 102.13 1itp s SER 67 Ca -0.19 0.91 0.02 0.00 1.31 0.00 0.00 55.95 58.00 1itp s SER 67 Cb 0.05 0.87 -0.02 0.00 0.21 0.00 0.00 66.02 67.14 1itp s SER 67 CO 0.81 -0.17 -0.15 -0.51 0.41 0.00 0.00 173.24 173.63 1itp s ILE 68 N 0.73 2.88 -0.57 1.44 2.07 -1.26 -0.09 121.20 126.41 1itp s ILE 68 Ca -0.04 -0.74 0.06 0.00 -1.41 0.00 0.00 60.65 58.52 1itp s ILE 68 Cb -0.05 -2.17 0.24 0.00 0.13 0.00 0.00 42.46 40.61 1itp s ILE 68 CO -0.05 0.55 0.65 1.21 -1.91 0.00 0.00 174.94 175.39 1itp n GLU 69 N 3.16 1.90 -1.89 3.50 2.13 0.66 -4.98 120.64 125.12 1itp n GLU 69 Ca -0.18 -4.21 -0.42 0.00 0.66 0.00 0.00 57.16 53.01 1itp n GLU 69 Cb 0.53 -1.95 -0.03 0.00 0.27 0.00 0.00 31.44 30.25 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 -1.96 4.18 0.00 5.31 2.12 -1.26 -2.02 118.70 125.07 1itp s GLU 70 Ca 0.37 2.37 0.00 0.00 0.36 0.00 0.00 54.97 58.07 1itp s GLU 70 Cb 0.14 -3.72 0.00 0.00 0.26 0.00 0.00 34.13 30.81 1itp s GLU 70 CO -0.06 -0.79 0.93 -3.47 -0.54 0.00 0.00 175.26 171.34 1itp n ASP 71 N 6.04 1.85 -4.81 -1.70 2.03 -0.98 -4.98 116.55 114.00 1itp n ASP 71 Ca 0.17 -1.87 -0.33 0.00 0.52 0.00 0.00 54.79 53.27 1itp n ASP 71 Cb 0.41 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.78 1itp n ASP 71 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1itp s GLY 72 N -0.87 2.33 -0.03 0.27 0.00 -1.06 -4.47 107.32 103.48 1itp s GLY 72 Ca 0.00 0.48 0.04 0.00 0.00 0.00 0.00 44.72 45.24 1itp s GLY 72 CO 0.00 0.79 -0.15 -0.42 0.00 0.00 0.00 173.10 173.31 1itp s ILE 73 N -2.21 1.27 -1.12 0.90 1.09 0.44 -4.92 121.20 116.64 1itp s ILE 73 Ca 0.65 -0.64 -0.06 0.00 -1.10 0.00 0.00 60.65 59.49 1itp s ILE 73 Cb -0.15 -1.09 0.28 0.00 -1.06 0.00 0.00 42.46 40.44 1itp s ILE 73 CO 0.26 0.37 1.46 0.52 -0.10 0.00 0.00 174.94 177.44 1itp n VAL 74 N 3.07 4.98 -3.15 2.92 0.31 -1.26 -4.66 118.33 120.53 1itp n VAL 74 Ca -0.17 -5.53 -0.08 0.00 -0.01 0.00 0.00 64.34 58.54 1itp n VAL 74 Cb 0.54 -2.25 0.01 0.00 -0.91 0.00 0.00 33.84 31.22 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 2.08 -4.54 -4.11 2.52 -1.04 -1.26 -4.99 114.28 102.94 1itp n THR 75 Ca 0.28 0.67 -0.21 0.00 -2.04 0.00 0.00 64.05 62.75 1itp n THR 75 Cb 0.35 -3.99 -0.17 0.00 -1.82 0.00 0.00 70.33 64.70 1itp n THR 75 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1itp s THR 76 N -1.28 0.59 0.00 12.58 2.01 -1.26 -5.33 115.64 122.96 1itp s THR 76 Ca 0.09 -0.12 0.00 0.00 0.31 0.00 0.00 61.69 61.97 1itp s THR 76 Cb -0.01 -0.63 0.00 0.00 0.01 0.00 0.00 72.50 71.86 1itp s THR 76 CO 0.34 0.25 0.10 0.00 -0.69 0.00 0.00 174.62 174.63