#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 -3.15 1.61 3.41 -1.26 -5.01 113.62 109.22 1itp n SER 2 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.39 1itp n SER 2 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 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 0.00 1.95 -1.12 7.33 0.00 -0.63 -4.99 120.51 123.05 1itp n ALA 3 Ca 0.00 -3.11 0.13 0.00 0.00 0.00 0.00 53.44 50.47 1itp n ALA 3 Cb 0.00 -0.88 -0.03 0.00 0.00 0.00 0.00 19.45 18.54 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 1.57 -1.40 3.68 0.00 0.00 -1.26 -3.54 105.19 104.24 1itp n GLY 4 Ca 0.20 -0.90 -0.36 0.00 0.00 0.00 0.00 46.02 44.96 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 -1.66 4.10 0.31 1.61 -2.85 -1.25 -2.74 119.74 117.27 1itp s LYS 5 Ca 0.00 -0.26 0.07 0.00 -1.00 0.00 0.00 55.97 54.78 1itp s LYS 5 Cb 0.00 -3.45 -0.02 0.00 -2.06 0.00 0.00 37.83 32.30 1itp s LYS 5 CO 0.00 0.18 0.36 -0.06 0.10 0.00 0.00 175.35 175.94 1itp s PHE 6 N 0.69 3.08 -0.32 1.78 0.08 0.32 -3.59 117.98 120.01 1itp s PHE 6 Ca 0.07 -0.21 -0.02 0.00 0.12 0.00 0.00 56.93 56.89 1itp s PHE 6 Cb -0.12 -1.81 0.12 0.00 -0.57 0.00 0.00 43.02 40.64 1itp s PHE 6 CO 0.01 0.17 0.19 0.96 -0.10 0.00 0.00 175.22 176.45 1itp s ILE 7 N -2.19 -0.00 0.21 0.64 -4.36 0.43 -2.11 121.20 113.81 1itp s ILE 7 Ca 0.41 -1.21 0.03 0.00 -0.26 0.00 0.00 60.65 59.62 1itp s ILE 7 Cb -0.08 -1.03 -0.03 0.00 1.25 0.00 0.00 42.46 42.57 1itp s ILE 7 CO 0.29 -0.83 0.35 0.68 0.24 0.00 0.00 174.94 175.67 1itp s VAL 8 N 1.59 5.26 0.26 8.37 -7.23 -1.04 -2.43 120.40 125.18 1itp s VAL 8 Ca 0.14 -0.77 0.03 0.00 -1.81 0.00 0.00 61.98 59.57 1itp s VAL 8 Cb -0.19 -3.81 -0.06 0.00 0.56 0.00 0.00 36.38 32.89 1itp s VAL 8 CO -0.17 -0.25 0.03 -0.63 -0.31 0.00 0.00 175.10 173.77 1itp s ILE 9 N -1.92 1.01 -0.01 -0.62 -1.09 0.51 -1.12 121.20 117.97 1itp s ILE 9 Ca 0.35 -2.02 0.04 0.00 -2.23 0.00 0.00 60.65 56.79 1itp s ILE 9 Cb -0.10 -2.52 -0.01 0.00 -1.58 0.00 0.00 42.46 38.25 1itp s ILE 9 CO 0.29 -0.18 -0.14 -0.36 -1.23 0.00 0.00 174.94 173.33 1itp s PHE 10 N -3.43 1.21 1.01 3.97 0.08 0.53 -1.66 117.98 119.69 1itp s PHE 10 Ca 0.32 -0.24 -0.13 0.00 0.12 0.00 0.00 56.93 57.00 1itp s PHE 10 Cb 0.07 -0.78 0.20 0.00 -0.57 0.00 0.00 43.02 41.95 1itp s PHE 10 CO 0.12 -0.02 0.46 0.36 -0.10 0.00 0.00 175.22 176.04 1itp n LYS 11 N 2.68 -1.67 -1.06 0.44 2.85 -1.26 -4.43 118.16 115.70 1itp n LYS 11 Ca -0.14 -0.77 -0.24 0.00 -1.05 0.00 0.00 58.31 56.11 1itp n LYS 11 Cb 0.55 -1.46 0.09 0.00 -0.65 0.00 0.00 35.03 33.57 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 -1.72 5.66 0.00 -5.58 5.15 -1.26 -3.98 115.26 113.53 1itp n ASN 12 Ca 0.07 -3.38 0.00 0.00 -0.60 0.00 0.00 54.58 50.67 1itp n ASN 12 Cb 0.32 -0.91 0.00 0.00 -0.53 0.00 0.00 39.78 38.66 1itp n ASN 12 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1itp n ASP 13 N -0.55 2.09 -4.18 1.20 9.92 -1.26 -5.07 116.55 118.70 1itp n ASP 13 Ca 0.48 0.00 -0.38 0.00 -0.53 0.00 0.00 54.79 54.36 1itp n ASP 13 Cb 0.96 0.00 0.02 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 -2.48 0.03 -2.50 2.53 3.14 -1.26 -4.95 118.33 112.84 1itp n VAL 14 Ca 0.00 -0.50 -0.23 0.00 -2.96 0.00 0.00 64.34 60.65 1itp n VAL 14 Cb 0.39 -0.01 0.08 0.00 -1.06 0.00 0.00 33.84 33.24 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 -1.01 4.67 0.01 6.55 1.04 -1.26 -4.99 113.70 118.71 1itp s SER 15 Ca 0.52 -0.08 -0.19 0.00 0.48 0.00 0.00 55.95 56.68 1itp s SER 15 Cb -0.41 -0.50 -0.23 0.00 0.10 0.00 0.00 66.02 64.98 1itp s SER 15 CO 0.71 -1.63 1.11 1.05 0.98 0.00 0.00 173.24 175.46 1itp h GLU 16 N -0.40 0.43 -0.88 4.02 4.11 -2.00 -2.58 114.58 117.28 1itp h GLU 16 Ca -0.40 -0.45 -0.02 0.00 0.07 0.00 0.00 59.36 58.57 1itp h GLU 16 Cb 1.28 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.62 1itp h GLU 16 CO 0.47 1.11 0.49 -0.44 0.07 0.00 0.00 179.01 180.71 1itp h ASP 17 N -0.07 1.10 -0.37 3.06 3.32 -1.99 -1.68 116.42 119.79 1itp h ASP 17 Ca -0.07 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1itp h ASP 17 Cb 1.31 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.56 1itp h ASP 17 CO 0.12 0.88 0.24 0.11 -1.72 0.00 0.00 179.24 178.87 1itp h LYS 18 N 1.23 0.50 0.34 3.56 1.57 -1.96 0.20 116.57 122.01 1itp h LYS 18 Ca 0.31 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1itp h LYS 18 Cb 0.02 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 1itp h LYS 18 CO -0.05 0.35 -0.48 0.82 -0.57 0.00 0.00 179.45 179.52 1itp h ILE 19 N 0.50 0.07 -0.45 1.86 2.04 -0.98 0.37 117.51 120.92 1itp h ILE 19 Ca 0.14 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.10 1itp h ILE 19 Cb -0.03 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.09 1itp h ILE 19 CO -0.03 0.00 0.31 0.03 0.00 0.00 0.00 178.15 178.46 1itp h ARG 20 N -0.86 0.15 0.19 2.37 3.08 -1.13 -2.31 114.38 115.87 1itp h ARG 20 Ca -0.03 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 1itp h ARG 20 Cb 0.79 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.81 1itp h ARG 20 CO -0.14 0.10 -0.09 0.93 -1.07 0.00 0.00 179.97 179.70 1itp h GLU 21 N 0.16 -0.24 -1.26 0.04 5.08 0.11 -1.10 114.58 117.37 1itp h GLU 21 Ca 0.21 0.02 0.46 0.00 -1.00 0.00 0.00 59.36 59.05 1itp h GLU 21 Cb 0.63 0.06 -0.15 0.00 0.50 0.00 0.00 28.75 29.78 1itp h GLU 21 CO -0.03 -0.16 0.77 2.41 -1.00 0.00 0.00 179.01 181.00 1itp n THR 22 N -2.94 -0.31 0.22 1.13 -1.04 0.11 0.21 114.28 111.66 1itp n THR 22 Ca -0.03 1.89 -0.13 0.00 -2.04 0.00 0.00 64.05 63.73 1itp n THR 22 Cb 0.10 -3.09 -0.07 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 -0.56 -0.92 -2.82 6.56 -1.36 -2.13 116.57 115.35 1itp h LYS 23 Ca 0.87 0.04 -0.00 0.00 -1.06 0.00 0.00 60.65 60.50 1itp h LYS 23 Cb 2.65 0.13 -0.04 0.00 -0.57 0.00 0.00 32.23 34.39 1itp h LYS 23 CO -0.57 -0.25 0.57 -0.44 -2.06 0.00 0.00 179.45 176.70 1itp h ASP 24 N -0.93 1.09 -0.98 0.86 3.32 0.18 0.19 116.42 120.16 1itp h ASP 24 Ca -0.06 -0.05 0.14 0.00 0.02 0.00 0.00 57.03 57.07 1itp h ASP 24 Cb 0.57 -0.28 -0.09 0.00 0.22 0.00 0.00 39.33 39.75 1itp h ASP 24 CO 0.10 0.83 0.60 -0.08 -1.72 0.00 0.00 179.24 178.96 1itp h GLU 25 N 1.27 0.86 0.03 3.56 4.81 0.25 0.22 114.58 125.58 1itp h GLU 25 Ca 0.33 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.44 1itp h GLU 25 Cb -0.08 -0.19 0.01 0.00 0.63 0.00 0.00 28.75 29.11 1itp h GLU 25 CO -0.07 0.57 -0.30 -0.24 -0.73 0.00 0.00 179.01 178.25 1itp h VAL 26 N 0.89 1.60 -0.99 0.32 3.04 -0.60 0.15 116.25 120.66 1itp h VAL 26 Ca 0.51 -2.16 0.25 0.00 -1.01 0.00 0.00 66.70 64.29 1itp h VAL 26 Cb 0.60 3.01 -0.13 0.00 -2.01 0.00 0.00 31.29 32.76 1itp h VAL 26 CO -0.30 0.59 0.57 0.40 -1.01 0.00 0.00 177.57 177.81 1itp h ILE 27 N -0.60 0.50 0.08 3.17 1.08 0.13 0.67 117.51 122.55 1itp h ILE 27 Ca -0.05 -0.18 -0.13 0.00 -0.39 0.00 0.00 64.86 64.11 1itp h ILE 27 Cb 1.13 -0.07 0.01 0.00 -3.07 0.00 0.00 36.82 34.82 1itp h ILE 27 CO 0.06 0.10 -0.61 0.00 -0.69 0.00 0.00 178.15 177.01 1itp h ALA 28 N 1.74 -0.02 -0.16 1.87 0.00 -0.63 -3.38 119.26 118.67 1itp h ALA 28 Ca 0.64 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1itp h ALA 28 Cb 1.25 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1itp h ALA 28 CO -0.50 0.30 0.00 -1.91 0.00 0.00 0.00 179.25 177.14 1itp n GLU 29 N -4.29 0.00 0.00 0.00 4.07 0.52 -4.95 120.64 115.99 1itp n GLU 29 Ca -0.14 0.66 0.00 0.00 -0.06 0.00 0.00 57.16 57.62 1itp n GLU 29 Cb 0.71 -1.47 0.00 0.00 -0.06 0.00 0.00 31.44 30.61 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 -0.98 -1.89 3.07 8.31 0.00 0.21 -5.05 105.19 108.86 1itp n GLY 30 Ca 0.00 0.51 -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 -1.45 -3.30 3.38 -0.02 0.00 -1.18 -4.72 105.19 97.90 1itp n GLY 31 Ca 0.00 -0.45 -0.25 0.00 0.00 0.00 0.00 46.02 45.32 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 -3.39 0.00 -4.52 2.61 -1.04 0.20 -3.02 114.28 105.12 1itp n THR 32 Ca -0.01 -2.42 -0.23 0.00 -2.04 0.00 0.00 64.05 59.36 1itp n THR 32 Cb 0.67 0.91 -0.16 0.00 -1.82 0.00 0.00 70.33 69.93 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 1.00 -0.04 12.58 -1.09 -1.26 -1.58 121.20 127.67 1itp s ILE 33 Ca 0.23 -0.44 0.05 0.00 -2.23 0.00 0.00 60.65 58.26 1itp s ILE 33 Cb 0.01 -0.90 -0.08 0.00 -1.58 0.00 0.00 42.46 39.91 1itp s ILE 33 CO 0.17 0.31 0.06 1.07 -1.23 0.00 0.00 174.94 175.32 1itp n THR 34 N 3.51 0.24 -3.60 2.92 5.66 -1.06 -4.89 114.28 117.07 1itp n THR 34 Ca -0.21 -0.20 -0.10 0.00 -3.05 0.00 0.00 64.05 60.49 1itp n THR 34 Cb 0.53 -0.41 -0.02 0.00 -1.55 0.00 0.00 70.33 68.88 1itp n THR 34 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 1itp s ASN 35 N -3.33 -0.43 0.21 1.09 0.01 -0.94 -5.00 114.94 106.55 1itp s ASN 35 Ca -0.03 -0.25 0.01 0.00 -0.71 0.00 0.00 52.86 51.88 1itp s ASN 35 Cb 0.02 0.64 -0.05 0.00 0.41 0.00 0.00 41.25 42.28 1itp s ASN 35 CO 0.24 -1.11 0.05 -1.83 -1.51 0.00 0.00 177.10 172.95 1itp s GLU 36 N -3.82 1.22 -0.46 -0.60 1.03 -1.26 -0.40 118.70 114.42 1itp s GLU 36 Ca 0.05 -1.63 0.03 0.00 0.03 0.00 0.00 54.97 53.45 1itp s GLU 36 Cb -0.03 -0.18 0.13 0.00 -0.80 0.00 0.00 34.13 33.25 1itp s GLU 36 CO -0.05 -0.23 0.24 0.71 -1.33 0.00 0.00 175.26 174.60 1itp s TYR 37 N -3.77 2.40 -0.92 4.83 2.02 0.14 -4.82 117.35 117.23 1itp s TYR 37 Ca 0.31 -2.66 -0.02 0.00 -0.37 0.00 0.00 57.07 54.33 1itp s TYR 37 Cb 0.07 -2.21 0.26 0.00 -0.40 0.00 0.00 41.96 39.69 1itp s TYR 37 CO 0.08 -0.78 2.13 0.09 -1.57 0.00 0.00 175.55 175.50 1itp n ASN 38 N 3.47 7.39 -4.93 2.29 4.13 -1.25 -2.12 115.26 124.23 1itp n ASN 38 Ca 0.07 -3.59 -0.25 0.00 1.68 0.00 0.00 54.58 52.48 1itp n ASN 38 Cb 0.34 -1.17 0.03 0.00 -1.54 0.00 0.00 39.78 37.44 1itp n ASN 38 CO 0.00 0.00 0.00 -0.04 0.28 0.00 0.00 177.26 177.50 1itp s MET 39 N -3.40 2.90 0.28 3.52 -1.94 -0.40 -4.98 119.30 115.28 1itp s MET 39 Ca 0.49 -0.19 0.26 0.00 -1.71 0.00 0.00 55.69 54.53 1itp s MET 39 Cb 0.31 -2.35 0.89 0.00 2.01 0.00 0.00 34.83 35.69 1itp s MET 39 CO -0.24 -0.62 1.76 -1.00 -0.01 0.00 0.00 175.02 174.91 1itp h PRO 40 N -0.03 0.00 0.00 2.03 0.13 -2.05 -3.19 132.00 128.89 1itp h PRO 40 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1itp h PRO 40 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1itp h PRO 40 CO 0.59 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.77 1itp n GLY 41 N 0.64 -0.18 2.58 1.56 0.00 -1.26 -4.95 105.19 103.59 1itp n GLY 41 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.16 0.78 -1.07 1.61 1.75 -1.20 -5.03 119.30 115.98 1itp s MET 42 Ca 0.00 -1.45 -0.04 0.00 -1.25 0.00 0.00 55.69 52.95 1itp s MET 42 Cb 0.00 -1.71 0.31 0.00 2.84 0.00 0.00 34.83 36.26 1itp s MET 42 CO 0.00 -1.15 1.46 1.63 -0.65 0.00 0.00 175.02 176.31 1itp n LYS 43 N 4.09 4.42 -1.81 4.11 5.02 -1.25 -1.28 118.16 131.45 1itp n LYS 43 Ca 0.07 -4.56 0.00 0.00 -2.02 0.00 0.00 58.31 51.80 1itp n LYS 43 Cb 0.37 -2.50 0.00 0.00 -0.02 0.00 0.00 35.03 32.88 1itp n LYS 43 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1itp n GLY 44 N 1.31 4.18 3.50 0.72 0.00 -0.90 -0.34 105.19 113.65 1itp n GLY 44 Ca 0.26 -1.70 -0.09 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.79 0.02 0.14 1.61 -0.12 -0.27 0.23 117.98 117.80 1itp s PHE 45 Ca 0.00 -0.37 0.04 0.00 -0.05 0.00 0.00 56.93 56.55 1itp s PHE 45 Cb 0.00 0.30 -0.04 0.00 -0.63 0.00 0.00 43.02 42.64 1itp s PHE 45 CO 0.00 -0.89 -0.08 0.00 -0.05 0.00 0.00 175.22 174.19 1itp s ALA 46 N -3.90 1.38 0.00 1.99 0.00 0.47 -2.50 121.76 119.20 1itp s ALA 46 Ca 0.12 -1.49 0.00 0.00 0.00 0.00 0.00 51.96 50.59 1itp s ALA 46 Cb -0.00 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.24 1itp s ALA 46 CO -0.01 -0.14 0.00 0.41 0.00 0.00 0.00 175.76 176.02 1itp n GLY 47 N -0.19 -0.37 3.83 0.00 0.00 -0.90 -2.22 105.19 105.35 1itp n GLY 47 Ca -0.10 -1.01 -0.37 0.00 0.00 0.00 0.00 46.02 44.54 1itp n GLY 47 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1itp s GLU 48 N -2.00 3.70 0.00 1.61 2.56 -0.62 -0.52 118.70 123.43 1itp s GLU 48 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.97 54.86 1itp s GLU 48 Cb 0.00 -3.26 0.00 0.00 2.00 0.00 0.00 34.13 32.87 1itp s GLU 48 CO 0.00 0.63 0.00 1.28 -0.56 0.00 0.00 175.26 176.61 1itp n LEU 49 N 2.44 0.00 0.00 2.70 4.77 -1.11 0.58 117.00 126.38 1itp n LEU 49 Ca -0.18 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.75 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 0.33 0.00 0.25 0.41 -1.33 0.00 0.00 177.39 177.06 1itp n THR 50 N 0.00 0.00 0.18 -5.08 -1.04 -1.26 -1.60 114.28 105.48 1itp n THR 50 Ca 0.00 -0.58 0.06 0.00 -2.04 0.00 0.00 64.05 61.49 1itp n THR 50 Cb 0.00 0.53 0.27 0.00 -1.82 0.00 0.00 70.33 69.31 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 0.37 -2.82 0.13 -1.95 -2.62 132.00 125.10 1itp h PRO 51 Ca -0.17 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.94 1itp h PRO 51 Cb 0.65 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.78 1itp h PRO 51 CO 0.22 0.35 -0.18 0.37 -0.23 0.00 0.00 178.00 178.53 1itp h GLN 52 N 0.00 -0.47 -0.87 0.86 4.15 -2.00 -2.87 115.11 113.90 1itp h GLN 52 Ca -0.00 0.03 0.16 0.00 0.77 0.00 0.00 58.65 59.61 1itp h GLN 52 Cb 1.02 0.11 -0.07 0.00 0.21 0.00 0.00 27.48 28.75 1itp h GLN 52 CO 0.05 -0.32 0.57 0.77 -1.93 0.00 0.00 178.83 177.97 1itp h SER 53 N -0.99 0.56 0.00 -0.69 0.02 -1.97 -2.72 113.55 107.76 1itp h SER 53 Ca -0.05 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1itp h SER 53 Cb 0.38 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.85 1itp h SER 53 CO 0.08 0.27 0.00 0.18 -1.14 0.00 0.00 176.83 176.22 1itp n LEU 54 N -4.54 0.00 -0.60 5.07 4.77 -0.99 -1.30 117.00 119.40 1itp n LEU 54 Ca 0.17 0.85 0.46 0.00 -0.03 0.00 0.00 56.01 57.46 1itp n LEU 54 Cb 0.53 -0.35 0.71 0.00 -2.33 0.00 0.00 43.42 41.98 1itp n LEU 54 CO 0.30 -0.35 1.27 0.41 -1.33 0.00 0.00 177.39 177.70 1itp n THR 55 N -1.81 -0.02 0.00 -5.08 -1.04 -1.05 0.18 114.28 105.47 1itp n THR 55 Ca 0.00 1.32 0.00 0.00 -2.04 0.00 0.00 64.05 63.33 1itp n THR 55 Cb 0.00 -2.20 0.00 0.00 -1.82 0.00 0.00 70.33 66.31 1itp n THR 55 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1itp n LYS 56 N -3.74 0.00 -0.39 -2.82 0.00 -0.42 -2.28 118.16 108.51 1itp n LYS 56 Ca 0.39 0.53 0.06 0.00 0.00 0.00 0.00 58.31 59.29 1itp n LYS 56 Cb 1.73 -1.43 0.23 0.00 0.00 0.00 0.00 35.03 35.56 1itp n LYS 56 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.40 179.37 1itp n PHE 57 N -1.97 0.94 -0.07 5.64 1.16 0.62 -3.95 117.46 119.84 1itp n PHE 57 Ca 0.00 -0.38 -0.22 0.00 -1.87 0.00 0.00 57.45 54.98 1itp n PHE 57 Cb 0.00 -0.16 -0.12 0.00 -1.61 0.00 0.00 39.48 37.59 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 0.69 0.63 0.12 3.97 1.13 0.48 -1.79 117.38 122.61 1itp n GLN 58 Ca 0.17 0.46 -0.02 0.00 -1.94 0.00 0.00 57.00 55.67 1itp n GLN 58 Cb 0.60 -1.73 0.11 0.00 0.11 0.00 0.00 30.24 29.34 1itp n GLN 58 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1itp h GLY 59 N -0.30 0.00 0.98 1.08 0.00 -1.60 -3.02 103.07 100.21 1itp h GLY 59 Ca -0.39 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 1itp h GLY 59 CO -0.12 0.00 -1.10 -0.10 0.00 0.00 0.00 176.54 175.22 1itp n LEU 60 N -3.71 0.84 -3.78 3.11 7.94 -1.25 -4.95 117.00 115.19 1itp n LEU 60 Ca -0.01 0.33 -0.34 0.00 -1.11 0.00 0.00 56.01 54.88 1itp n LEU 60 Cb 0.68 -0.03 0.03 0.00 0.53 0.00 0.00 43.42 44.63 1itp n LEU 60 CO 0.43 -0.12 -1.12 1.67 -1.11 0.00 0.00 177.39 177.14 1itp n GLN 61 N -2.71 0.00 0.00 1.96 7.27 -0.74 -3.07 117.38 120.09 1itp n GLN 61 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.05 1itp n GLN 61 Cb 0.61 -0.93 0.00 0.00 2.41 0.00 0.00 30.24 32.32 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 3.08 3.33 0.05 1.69 0.00 -0.38 -4.75 105.19 108.20 1itp n GLY 62 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 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 0.01 2.23 0.00 1.61 -0.08 -1.17 -4.66 116.55 114.49 1itp n ASP 63 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1itp n ASP 63 Cb 0.00 0.92 0.00 0.00 2.34 0.00 0.00 41.12 44.38 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 -2.33 0.33 -3.81 -2.67 -0.00 -1.26 -4.82 117.00 102.44 1itp n LEU 64 Ca -0.15 -0.33 -0.28 0.00 -0.00 0.00 0.00 56.01 55.25 1itp n LEU 64 Cb 0.77 0.00 -0.16 0.00 -0.00 0.00 0.00 43.42 44.02 1itp n LEU 64 CO 0.24 0.08 -0.39 -0.63 -0.00 0.00 0.00 177.39 176.69 1itp s ILE 65 N -0.03 0.84 -0.04 1.47 -1.09 -1.26 -4.33 121.20 116.77 1itp s ILE 65 Ca 0.00 -0.65 -0.20 0.00 -2.23 0.00 0.00 60.65 57.57 1itp s ILE 65 Cb 0.00 -1.20 -0.32 0.00 -1.58 0.00 0.00 42.46 39.36 1itp s ILE 65 CO 0.00 -0.07 0.88 0.44 -1.23 0.00 0.00 174.94 174.96 1itp h ASP 66 N 8.17 0.54 -4.83 3.58 5.19 -1.58 -1.00 116.42 126.48 1itp h ASP 66 Ca -0.19 -0.94 -0.23 0.00 -0.62 0.00 0.00 57.03 55.06 1itp h ASP 66 Cb 1.11 -0.18 -0.21 0.00 0.18 0.00 0.00 39.33 40.23 1itp h ASP 66 CO 0.36 1.49 -0.72 -0.44 -3.12 0.00 0.00 179.24 176.81 1itp s SER 67 N -7.11 0.58 -0.18 6.45 0.01 -1.24 -4.93 113.70 107.28 1itp s SER 67 Ca -0.13 -0.51 -0.05 0.00 1.31 0.00 0.00 55.95 56.57 1itp s SER 67 Cb 0.02 0.06 0.07 0.00 0.21 0.00 0.00 66.02 66.38 1itp s SER 67 CO 0.85 -0.24 0.12 -0.51 0.41 0.00 0.00 173.24 173.87 1itp s ILE 68 N -1.38 -0.13 -0.34 1.44 2.07 -1.26 -0.37 121.20 121.23 1itp s ILE 68 Ca -0.12 -0.19 0.03 0.00 -1.41 0.00 0.00 60.65 58.96 1itp s ILE 68 Cb -0.10 -0.62 0.10 0.00 0.13 0.00 0.00 42.46 41.98 1itp s ILE 68 CO -0.00 -0.29 0.07 -0.70 -1.91 0.00 0.00 174.94 172.11 1itp s GLU 69 N 2.17 1.30 -0.25 3.50 2.12 -1.02 -5.01 118.70 121.52 1itp s GLU 69 Ca 0.03 -1.71 -0.08 0.00 0.36 0.00 0.00 54.97 53.57 1itp s GLU 69 Cb -0.16 -2.90 -0.03 0.00 0.26 0.00 0.00 34.13 31.30 1itp s GLU 69 CO -0.11 -0.96 0.09 -1.21 -0.54 0.00 0.00 175.26 172.53 1itp s GLU 70 N 1.02 3.72 -0.78 4.30 8.01 -1.26 -0.43 118.70 133.29 1itp s GLU 70 Ca 0.11 -0.44 0.03 0.00 0.01 0.00 0.00 54.97 54.67 1itp s GLU 70 Cb -0.19 -3.39 0.30 0.00 -4.31 0.00 0.00 34.13 26.54 1itp s GLU 70 CO -0.12 -0.17 1.11 -3.47 0.01 0.00 0.00 175.26 172.62 1itp n ASP 71 N 4.91 5.05 0.03 -0.19 -0.08 -1.24 -4.72 116.55 120.31 1itp n ASP 71 Ca -0.16 -3.54 -0.01 0.00 -1.51 0.00 0.00 54.79 49.57 1itp n ASP 71 Cb 0.52 -0.84 -0.00 0.00 2.34 0.00 0.00 41.12 43.13 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 0.54 -0.10 3.50 0.27 0.00 -1.23 -3.83 105.19 104.33 1itp n GLY 72 Ca 0.32 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.08 4.58 -0.08 -0.61 1.01 -1.26 -4.54 121.20 118.22 1itp s ILE 73 Ca -0.04 -1.86 -0.09 0.00 0.00 0.00 0.00 60.65 58.67 1itp s ILE 73 Cb 0.01 -4.95 -0.03 0.00 0.01 0.00 0.00 42.46 37.50 1itp s ILE 73 CO 0.06 -1.72 -0.17 0.52 0.00 0.00 0.00 174.94 173.63 1itp n VAL 74 N 5.61 0.81 -1.23 2.92 0.31 -1.26 -4.92 118.33 120.57 1itp n VAL 74 Ca 0.34 0.29 -0.49 0.00 -0.01 0.00 0.00 64.34 64.47 1itp n VAL 74 Cb 0.47 -1.89 -0.12 0.00 -0.91 0.00 0.00 33.84 31.39 1itp n VAL 74 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1itp n THR 75 N -3.52 0.00 -3.23 2.52 5.66 -1.26 -4.80 114.28 109.65 1itp n THR 75 Ca -0.07 0.00 -0.45 0.00 -3.05 0.00 0.00 64.05 60.48 1itp n THR 75 Cb 0.25 -0.46 -0.00 0.00 -1.55 0.00 0.00 70.33 68.57 1itp n THR 75 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1itp s THR 76 N 6.45 5.68 0.00 1.09 2.01 -1.26 -5.23 115.64 124.37 1itp s THR 76 Ca 1.15 -3.07 0.00 0.00 0.31 0.00 0.00 61.69 60.09 1itp s THR 76 Cb -1.31 -4.68 0.00 0.00 0.01 0.00 0.00 72.50 66.53 1itp s THR 76 CO 0.55 -1.29 0.00 0.00 -0.69 0.00 0.00 174.62 173.19