#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 5.47 0.00 1.61 0.01 -1.26 -5.00 113.70 114.53 1itp s SER 2 Ca 0.00 -0.38 0.27 0.00 1.31 0.00 0.00 55.95 57.15 1itp s SER 2 Cb 0.00 -0.58 0.79 0.00 0.21 0.00 0.00 66.02 66.44 1itp s SER 2 CO 0.00 -0.94 1.60 0.00 0.41 0.00 0.00 173.24 174.30 1itp n ALA 3 N -2.03 3.13 0.00 1.44 0.00 -0.86 -5.01 120.51 117.18 1itp n ALA 3 Ca 0.09 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1itp n ALA 3 Cb 0.59 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.85 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 1.41 0.30 3.88 0.00 0.00 -1.24 0.79 105.19 110.32 1itp n GLY 4 Ca 0.09 -1.63 -0.37 0.00 0.00 0.00 0.00 46.02 44.12 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 3.52 0.09 1.61 1.02 -1.26 -2.20 119.74 120.52 1itp s LYS 5 Ca 0.00 -0.07 0.04 0.00 0.02 0.00 0.00 55.97 55.96 1itp s LYS 5 Cb 0.00 -3.18 -0.03 0.00 -0.52 0.00 0.00 37.83 34.10 1itp s LYS 5 CO 0.00 0.75 -0.11 -0.06 -0.92 0.00 0.00 175.35 175.01 1itp s PHE 6 N -1.08 1.08 -0.25 3.18 0.40 0.59 -2.58 117.98 119.33 1itp s PHE 6 Ca 0.18 -0.60 -0.04 0.00 -0.60 0.00 0.00 56.93 55.87 1itp s PHE 6 Cb -0.13 -0.60 0.09 0.00 0.51 0.00 0.00 43.02 42.89 1itp s PHE 6 CO 0.08 0.02 0.12 0.96 0.70 0.00 0.00 175.22 177.09 1itp s ILE 7 N -2.12 -0.09 0.33 0.64 -4.36 -1.08 -1.33 121.20 113.18 1itp s ILE 7 Ca 0.03 -0.53 0.10 0.00 -0.26 0.00 0.00 60.65 59.99 1itp s ILE 7 Cb -0.05 -0.83 -0.06 0.00 1.25 0.00 0.00 42.46 42.77 1itp s ILE 7 CO 0.01 -0.55 -0.11 0.54 0.24 0.00 0.00 174.94 175.06 1itp s VAL 8 N 2.13 2.24 0.32 8.37 0.11 -1.08 -1.39 120.40 131.10 1itp s VAL 8 Ca 0.07 -2.24 0.03 0.00 -2.93 0.00 0.00 61.98 56.91 1itp s VAL 8 Cb -0.16 -2.57 -0.04 0.00 -1.53 0.00 0.00 36.38 32.08 1itp s VAL 8 CO -0.27 -0.25 0.12 -0.63 -3.33 0.00 0.00 175.10 170.75 1itp s ILE 9 N -2.62 0.60 0.21 7.04 -1.09 0.82 -1.81 121.20 124.35 1itp s ILE 9 Ca 0.32 -2.00 0.10 0.00 -2.23 0.00 0.00 60.65 56.84 1itp s ILE 9 Cb 0.01 -2.56 -0.05 0.00 -1.58 0.00 0.00 42.46 38.29 1itp s ILE 9 CO 0.16 0.00 -0.20 -0.36 -1.23 0.00 0.00 174.94 173.30 1itp s PHE 10 N -3.50 2.11 1.04 3.97 0.40 -0.99 -1.79 117.98 119.21 1itp s PHE 10 Ca 0.34 -0.40 -0.14 0.00 -0.60 0.00 0.00 56.93 56.13 1itp s PHE 10 Cb 0.06 -1.00 0.21 0.00 0.51 0.00 0.00 43.02 42.79 1itp s PHE 10 CO 0.16 0.51 0.46 0.36 0.70 0.00 0.00 175.22 177.40 1itp n LYS 11 N -0.06 -2.64 -1.23 0.44 2.85 0.23 -4.40 118.16 113.35 1itp n LYS 11 Ca -0.10 -0.78 -0.30 0.00 -1.05 0.00 0.00 58.31 56.08 1itp n LYS 11 Cb 0.58 -1.50 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 -1.75 6.47 0.00 -5.58 5.15 -1.26 -4.12 115.26 114.18 1itp n ASN 12 Ca 0.07 -3.64 0.00 0.00 -0.60 0.00 0.00 54.58 50.42 1itp n ASN 12 Cb 0.33 -0.94 0.00 0.00 -0.53 0.00 0.00 39.78 38.64 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 -0.83 0.94 -3.99 1.20 -0.08 -1.26 -5.09 116.55 107.45 1itp n ASP 13 Ca 0.58 0.00 -0.37 0.00 -1.51 0.00 0.00 54.79 53.49 1itp n ASP 13 Cb 0.91 0.00 0.01 0.00 2.34 0.00 0.00 41.12 44.38 1itp n ASP 13 CO 0.00 0.00 0.00 0.55 0.12 0.00 0.00 177.20 177.87 1itp n VAL 14 N -2.27 0.00 -2.58 5.18 3.14 -1.26 -4.95 118.33 115.59 1itp n VAL 14 Ca 0.00 -0.47 -0.24 0.00 -2.96 0.00 0.00 64.34 60.67 1itp n VAL 14 Cb 0.21 0.00 0.11 0.00 -1.06 0.00 0.00 33.84 33.10 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 -0.94 4.35 0.03 6.55 1.04 -1.26 -5.00 113.70 118.47 1itp s SER 15 Ca 0.53 -0.35 -0.16 0.00 0.48 0.00 0.00 55.95 56.45 1itp s SER 15 Cb -0.47 -0.03 -0.35 0.00 0.10 0.00 0.00 66.02 65.27 1itp s SER 15 CO 0.62 -1.86 1.00 -0.08 0.98 0.00 0.00 173.24 173.90 1itp h GLU 16 N -0.53 0.54 0.63 4.02 4.57 -1.98 -2.78 114.58 119.05 1itp h GLU 16 Ca -0.36 -0.90 -0.03 0.00 -1.18 0.00 0.00 59.36 56.89 1itp h GLU 16 Cb 1.27 0.33 -0.01 0.00 -0.16 0.00 0.00 28.75 30.18 1itp h GLU 16 CO 0.40 1.43 -0.45 0.22 -1.18 0.00 0.00 179.01 179.44 1itp h ASP 17 N 0.13 -1.16 -0.70 1.04 3.58 -1.98 0.19 116.42 117.51 1itp h ASP 17 Ca -0.25 0.07 0.13 0.00 0.42 0.00 0.00 57.03 57.41 1itp h ASP 17 Cb 2.12 0.35 -0.09 0.00 1.72 0.00 0.00 39.33 43.43 1itp h ASP 17 CO 0.27 -0.65 0.22 0.11 -2.88 0.00 0.00 179.24 176.31 1itp h LYS 18 N -1.03 0.34 0.19 0.28 1.57 -1.98 0.27 116.57 116.22 1itp h LYS 18 Ca -0.08 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1itp h LYS 18 Cb 0.84 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.03 1itp h LYS 18 CO 0.05 0.23 -0.48 0.82 -0.57 0.00 0.00 179.45 179.49 1itp h ILE 19 N 0.35 0.06 -0.57 1.86 2.04 -1.14 0.46 117.51 120.57 1itp h ILE 19 Ca 0.38 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.35 1itp h ILE 19 Cb 0.58 0.06 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 1itp h ILE 19 CO -0.42 0.00 0.39 0.03 0.00 0.00 0.00 178.15 178.15 1itp h ARG 20 N -0.76 0.29 0.26 2.37 2.47 0.50 -1.63 114.38 117.87 1itp h ARG 20 Ca -0.00 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.68 1itp h ARG 20 Cb 0.75 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.01 1itp h ARG 20 CO -0.23 0.19 -0.13 0.93 0.56 0.00 0.00 179.97 181.29 1itp h GLU 21 N 0.30 -0.34 -1.18 0.04 5.08 0.15 -0.87 114.58 117.77 1itp h GLU 21 Ca 0.27 0.02 0.38 0.00 -1.00 0.00 0.00 59.36 59.03 1itp h GLU 21 Cb 0.65 0.08 -0.13 0.00 0.50 0.00 0.00 28.75 29.84 1itp h GLU 21 CO -0.06 -0.23 0.74 1.15 -1.00 0.00 0.00 179.01 179.61 1itp h THR 22 N -0.46 0.22 0.07 1.13 2.02 0.07 1.27 112.91 117.22 1itp h THR 22 Ca -0.04 -0.06 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 1itp h THR 22 Cb 0.27 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.70 1itp h THR 22 CO 0.06 0.03 -0.04 0.11 0.37 0.00 0.00 175.52 176.06 1itp h LYS 23 N 0.18 -0.10 -0.72 6.66 1.57 -1.23 -1.68 116.57 121.26 1itp h LYS 23 Ca 0.77 0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 59.51 1itp h LYS 23 Cb 2.19 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 34.49 1itp h LYS 23 CO -0.46 0.19 0.27 -0.44 -0.57 0.00 0.00 179.45 178.44 1itp h ASP 24 N -0.39 1.01 -0.93 0.86 3.32 0.19 0.15 116.42 120.64 1itp h ASP 24 Ca -0.01 -0.18 0.12 0.00 0.02 0.00 0.00 57.03 56.98 1itp h ASP 24 Cb 0.33 -0.26 -0.08 0.00 0.22 0.00 0.00 39.33 39.54 1itp h ASP 24 CO 0.02 0.92 0.55 -0.33 -1.72 0.00 0.00 179.24 178.68 1itp h GLU 25 N 1.04 0.83 0.02 3.56 5.08 0.13 -0.04 114.58 125.20 1itp h GLU 25 Ca 0.24 -0.05 -0.27 0.00 -1.00 0.00 0.00 59.36 58.28 1itp h GLU 25 Cb 0.24 -0.19 0.02 0.00 0.50 0.00 0.00 28.75 29.33 1itp h GLU 25 CO -0.02 0.55 -1.07 0.28 -1.00 0.00 0.00 179.01 177.75 1itp h VAL 26 N 0.86 1.28 -0.24 3.13 2.07 -0.74 0.14 116.25 122.74 1itp h VAL 26 Ca 0.47 -2.28 0.06 0.00 0.82 0.00 0.00 66.70 65.77 1itp h VAL 26 Cb 0.52 2.42 -0.08 0.00 -1.52 0.00 0.00 31.29 32.64 1itp h VAL 26 CO -0.29 0.70 -0.36 0.40 0.02 0.00 0.00 177.57 178.05 1itp h ILE 27 N 0.38 0.22 0.29 4.57 1.08 0.70 0.37 117.51 125.12 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 1.73 0.22 0.00 0.00 -3.07 0.00 0.00 36.82 35.70 1itp h ILE 27 CO 0.21 0.00 -0.14 0.00 -0.69 0.00 0.00 178.15 177.53 1itp h ALA 28 N 0.45 -0.40 -0.59 1.87 0.00 -1.14 -3.36 119.26 116.10 1itp h ALA 28 Ca 0.12 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1itp h ALA 28 Cb 0.57 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1itp h ALA 28 CO -0.44 -0.40 0.00 -1.91 0.00 0.00 0.00 179.25 176.50 1itp n GLU 29 N -5.04 0.00 0.00 0.00 0.00 0.48 -4.85 120.64 111.23 1itp n GLU 29 Ca -0.07 0.79 0.00 0.00 0.00 0.00 0.00 57.16 57.89 1itp n GLU 29 Cb 0.22 -1.24 0.00 0.00 0.00 0.00 0.00 31.44 30.42 1itp n GLU 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1itp n GLY 30 N -0.99 -1.41 3.08 8.31 0.00 0.12 -5.05 105.19 109.25 1itp n GLY 30 Ca 0.00 0.36 -0.35 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.65 -2.75 1.90 -0.02 0.00 -0.54 -4.70 105.19 98.43 1itp n GLY 31 Ca 0.00 -0.35 -0.12 0.00 0.00 0.00 0.00 46.02 45.56 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 -3.82 0.00 -3.82 2.61 -1.04 0.18 -2.50 114.28 105.88 1itp n THR 32 Ca -0.01 -1.45 -0.19 0.00 -2.04 0.00 0.00 64.05 60.36 1itp n THR 32 Cb 0.68 0.72 -0.17 0.00 -1.82 0.00 0.00 70.33 69.74 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 -2.80 0.14 -0.05 12.58 -1.09 -1.26 -2.17 121.20 126.54 1itp s ILE 33 Ca 0.24 0.19 0.03 0.00 -2.23 0.00 0.00 60.65 58.88 1itp s ILE 33 Cb 0.01 -0.29 -0.05 0.00 -1.58 0.00 0.00 42.46 40.55 1itp s ILE 33 CO 0.17 0.18 0.00 0.35 -1.23 0.00 0.00 174.94 174.41 1itp n THR 34 N 4.65 0.32 -3.31 2.92 -2.24 -1.05 -4.97 114.28 110.60 1itp n THR 34 Ca -0.16 -0.18 -0.07 0.00 -2.27 0.00 0.00 64.05 61.36 1itp n THR 34 Cb 0.50 -0.84 -0.06 0.00 -2.10 0.00 0.00 70.33 67.83 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 -3.78 -0.03 0.51 3.42 -0.87 -0.02 -5.04 114.94 109.13 1itp s ASN 35 Ca -0.03 0.25 -0.01 0.00 -1.57 0.00 0.00 52.86 51.49 1itp s ASN 35 Cb 0.02 1.30 0.01 0.00 -0.02 0.00 0.00 41.25 42.55 1itp s ASN 35 CO 0.18 -0.30 0.76 -1.83 -2.57 0.00 0.00 177.10 173.34 1itp s GLU 36 N 2.60 2.91 -0.72 -0.60 1.03 -1.26 -0.29 118.70 122.38 1itp s GLU 36 Ca 0.14 -0.40 0.04 0.00 0.03 0.00 0.00 54.97 54.78 1itp s GLU 36 Cb -0.15 -2.46 0.17 0.00 -0.80 0.00 0.00 34.13 30.90 1itp s GLU 36 CO -0.19 -0.49 0.52 0.71 -1.33 0.00 0.00 175.26 174.48 1itp s TYR 37 N -2.73 3.59 -1.26 4.83 2.02 0.11 -4.82 117.35 119.09 1itp s TYR 37 Ca 0.52 -3.28 -0.17 0.00 -0.37 0.00 0.00 57.07 53.77 1itp s TYR 37 Cb -0.10 -2.80 0.10 0.00 -0.40 0.00 0.00 41.96 38.76 1itp s TYR 37 CO 0.40 -0.59 1.63 0.54 -1.57 0.00 0.00 175.55 175.96 1itp s ASN 38 N -1.17 6.92 0.22 2.29 2.20 -1.26 -2.33 114.94 121.80 1itp s ASN 38 Ca 0.25 -2.62 0.08 0.00 -0.94 0.00 0.00 52.86 49.62 1itp s ASN 38 Cb -0.07 -2.52 -0.05 0.00 -2.00 0.00 0.00 41.25 36.62 1itp s ASN 38 CO -0.15 -1.03 -0.13 -0.04 -2.94 0.00 0.00 177.10 172.81 1itp s MET 39 N 3.31 1.40 -0.01 3.55 -1.94 -0.47 -5.04 119.30 120.11 1itp s MET 39 Ca 0.50 -1.64 -0.21 0.00 -1.71 0.00 0.00 55.69 52.62 1itp s MET 39 Cb 0.02 -1.19 -0.22 0.00 2.01 0.00 0.00 34.83 35.45 1itp s MET 39 CO 0.05 0.17 1.11 -1.00 -0.01 0.00 0.00 175.02 175.34 1itp h PRO 40 N 2.48 0.33 -0.25 2.03 0.13 -2.02 -3.23 132.00 131.47 1itp h PRO 40 Ca -0.39 -0.32 0.00 0.00 -0.87 0.00 0.00 66.00 64.43 1itp h PRO 40 Cb 1.23 0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1itp h PRO 40 CO 0.63 0.99 0.00 0.41 -0.23 0.00 0.00 178.00 179.80 1itp n GLY 41 N 0.94 0.82 2.95 1.56 0.00 -1.26 -4.65 105.19 105.54 1itp n GLY 41 Ca -0.09 -0.54 -0.08 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.68 0.57 -0.90 1.61 0.00 -1.22 -5.07 119.30 112.60 1itp s MET 42 Ca 0.34 -0.19 -0.05 0.00 0.00 0.00 0.00 55.69 55.79 1itp s MET 42 Cb 0.19 -0.29 0.23 0.00 0.00 0.00 0.00 34.83 34.96 1itp s MET 42 CO 0.28 -1.11 0.81 -1.59 0.00 0.00 0.00 175.02 173.41 1itp s LYS 43 N 2.12 3.44 0.02 4.11 -2.85 -1.23 -1.36 119.74 123.99 1itp s LYS 43 Ca 0.13 -3.08 0.01 0.00 -1.00 0.00 0.00 55.97 52.03 1itp s LYS 43 Cb -0.11 -4.12 -0.00 0.00 -2.06 0.00 0.00 37.83 31.53 1itp s LYS 43 CO -0.18 -1.25 0.02 0.41 0.10 0.00 0.00 175.35 174.45 1itp n GLY 44 N 2.75 3.93 3.24 0.59 0.00 -0.99 -2.36 105.19 112.37 1itp n GLY 44 Ca 0.19 -1.67 -0.09 0.00 0.00 0.00 0.00 46.02 44.45 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 -2.15 0.12 -0.04 1.61 -0.12 -0.75 0.05 117.98 116.70 1itp s PHE 45 Ca 0.03 -0.53 -0.01 0.00 -0.05 0.00 0.00 56.93 56.37 1itp s PHE 45 Cb 0.00 -0.00 0.03 0.00 -0.63 0.00 0.00 43.02 42.42 1itp s PHE 45 CO 0.02 -0.60 0.03 0.00 -0.05 0.00 0.00 175.22 174.62 1itp s ALA 46 N -3.87 0.36 0.00 1.99 0.00 0.61 -2.62 121.76 118.22 1itp s ALA 46 Ca 0.06 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.14 1itp s ALA 46 Cb 0.04 -0.56 0.00 0.00 0.00 0.00 0.00 23.12 22.61 1itp s ALA 46 CO -0.10 -0.36 0.00 0.41 0.00 0.00 0.00 175.76 175.71 1itp n GLY 47 N 4.92 2.55 3.42 0.00 0.00 -0.44 -0.84 105.19 114.80 1itp n GLY 47 Ca -0.11 0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 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 4.32 2.30 0.00 1.61 2.02 -0.92 -0.30 118.70 127.73 1itp s GLU 48 Ca 0.00 -0.82 0.00 0.00 0.02 0.00 0.00 54.97 54.17 1itp s GLU 48 Cb 0.00 -2.24 0.00 0.00 0.10 0.00 0.00 34.13 31.99 1itp s GLU 48 CO 0.00 0.59 0.00 1.28 0.02 0.00 0.00 175.26 177.15 1itp n LEU 49 N 2.19 0.00 0.00 1.80 4.77 -0.93 0.49 117.00 125.32 1itp n LEU 49 Ca -0.17 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.76 1itp n LEU 49 Cb 0.52 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.61 1itp n LEU 49 CO 0.25 0.00 0.15 0.41 -1.33 0.00 0.00 177.39 176.87 1itp n THR 50 N 0.00 0.00 0.07 -5.08 -1.04 -1.26 -2.03 114.28 104.94 1itp n THR 50 Ca 0.00 -0.60 -0.10 0.00 -2.04 0.00 0.00 64.05 61.31 1itp n THR 50 Cb 0.00 0.45 -0.00 0.00 -1.82 0.00 0.00 70.33 68.96 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 0.32 0.67 -2.82 0.13 -1.99 -2.58 132.00 125.73 1itp h PRO 51 Ca -0.13 -0.31 -0.03 0.00 -0.87 0.00 0.00 66.00 64.65 1itp h PRO 51 Cb 0.52 0.08 0.01 0.00 0.13 0.00 0.00 31.00 31.74 1itp h PRO 51 CO 0.17 0.99 -0.32 0.37 -0.23 0.00 0.00 178.00 178.98 1itp h GLN 52 N 0.19 -0.87 -0.78 0.86 4.15 -2.01 -2.80 115.11 113.86 1itp h GLN 52 Ca -0.05 0.06 0.13 0.00 0.77 0.00 0.00 58.65 59.57 1itp h GLN 52 Cb 1.45 0.20 -0.05 0.00 0.21 0.00 0.00 27.48 29.28 1itp h GLN 52 CO 0.14 -0.55 0.52 0.77 -1.93 0.00 0.00 178.83 177.78 1itp h SER 53 N -1.13 0.50 0.00 -0.69 0.02 -1.97 -2.79 113.55 107.48 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 0.73 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1itp h SER 53 CO 0.15 0.27 0.00 0.18 -1.14 0.00 0.00 176.83 176.29 1itp n LEU 54 N -4.50 0.00 -0.63 5.07 4.32 -0.97 -1.14 117.00 119.14 1itp n LEU 54 Ca 0.15 0.67 0.48 0.00 -0.02 0.00 0.00 56.01 57.28 1itp n LEU 54 Cb 0.47 -0.17 0.74 0.00 -1.62 0.00 0.00 43.42 42.84 1itp n LEU 54 CO 0.32 -0.17 1.35 0.41 -1.22 0.00 0.00 177.39 178.08 1itp n THR 55 N -1.28 0.00 0.00 -5.08 -1.04 -1.07 0.24 114.28 106.05 1itp n THR 55 Ca 0.00 1.35 0.00 0.00 -2.04 0.00 0.00 64.05 63.36 1itp n THR 55 Cb 0.00 -2.26 0.00 0.00 -1.82 0.00 0.00 70.33 66.25 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 -3.72 0.00 0.00 -2.82 0.00 -0.30 -3.06 118.16 108.27 1itp n LYS 56 Ca 0.40 0.51 0.14 0.00 0.00 0.00 0.00 58.31 59.36 1itp n LYS 56 Cb 1.83 -1.38 0.53 0.00 0.00 0.00 0.00 35.03 36.01 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 -1.87 0.00 -2.72 5.64 1.16 0.29 -4.77 117.46 115.19 1itp n PHE 57 Ca 0.00 0.00 -0.43 0.00 -1.87 0.00 0.00 57.45 55.15 1itp n PHE 57 Cb 0.00 -0.07 -0.03 0.00 -1.61 0.00 0.00 39.48 37.78 1itp n PHE 57 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 1itp s GLN 58 N -2.23 4.25 0.00 3.97 -1.52 0.67 -3.24 119.66 121.56 1itp s GLN 58 Ca 0.33 1.25 0.00 0.00 -1.95 0.00 0.00 55.36 54.99 1itp s GLN 58 Cb 0.20 -3.64 0.00 0.00 -0.22 0.00 0.00 33.01 29.36 1itp s GLN 58 CO 0.42 -0.58 0.00 0.41 -0.25 0.00 0.00 175.29 175.28 1itp n GLY 59 N 3.42 1.76 0.00 3.09 0.00 -1.26 -4.65 105.19 107.55 1itp n GLY 59 Ca 0.10 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.23 1itp n GLY 59 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1itp n LEU 60 N 0.00 0.00 -4.29 0.99 4.32 -1.20 -4.87 117.00 111.95 1itp n LEU 60 Ca 0.00 0.43 -0.42 0.00 -0.02 0.00 0.00 56.01 56.01 1itp n LEU 60 Cb 0.00 -0.43 -0.00 0.00 -1.62 0.00 0.00 43.42 41.37 1itp n LEU 60 CO 0.00 -0.10 -0.45 0.00 -1.22 0.00 0.00 177.39 175.62 1itp n GLN 61 N -1.43 0.00 0.00 3.23 6.02 -1.26 -0.88 117.38 123.06 1itp n GLN 61 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.06 1itp n GLN 61 Cb 0.24 -1.00 0.00 0.00 1.02 0.00 0.00 30.24 30.50 1itp n GLN 61 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1itp n GLY 62 N 2.35 3.05 0.01 1.08 0.00 0.47 -4.61 105.19 107.55 1itp n GLY 62 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 0.19 0.61 0.12 1.61 2.03 -0.06 -4.93 116.55 116.11 1itp n ASP 63 Ca 0.00 -0.80 0.00 0.00 0.52 0.00 0.00 54.79 54.51 1itp n ASP 63 Cb 0.00 0.44 0.00 0.00 -0.72 0.00 0.00 41.12 40.84 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 -0.42 -2.19 -4.69 -2.67 7.94 -1.09 -4.96 117.00 108.91 1itp n LEU 64 Ca 0.00 0.47 -0.42 0.00 -1.11 0.00 0.00 56.01 54.95 1itp n LEU 64 Cb 0.01 2.27 -0.03 0.00 0.53 0.00 0.00 43.42 46.21 1itp n LEU 64 CO 0.01 -0.09 0.77 -0.63 -1.11 0.00 0.00 177.39 176.34 1itp s ILE 65 N -1.49 4.76 -0.15 1.96 1.01 -1.26 0.75 121.20 126.78 1itp s ILE 65 Ca 0.00 2.01 -0.05 0.00 0.00 0.00 0.00 60.65 62.61 1itp s ILE 65 Cb 0.00 -4.29 -0.24 0.00 0.01 0.00 0.00 42.46 37.94 1itp s ILE 65 CO 0.00 0.06 0.24 -0.67 0.00 0.00 0.00 174.94 174.56 1itp n ASP 66 N 4.64 2.09 -3.71 3.58 2.03 -0.74 -0.39 116.55 124.06 1itp n ASP 66 Ca 0.08 0.14 -0.12 0.00 0.52 0.00 0.00 54.79 55.41 1itp n ASP 66 Cb 0.49 -0.77 -0.10 0.00 -0.72 0.00 0.00 41.12 40.02 1itp n ASP 66 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1itp s SER 67 N -6.93 -0.51 -0.13 1.67 0.01 -1.24 -4.84 113.70 101.72 1itp s SER 67 Ca -0.25 0.93 0.02 0.00 1.31 0.00 0.00 55.95 57.96 1itp s SER 67 Cb 0.07 0.88 0.01 0.00 0.21 0.00 0.00 66.02 67.19 1itp s SER 67 CO 0.73 -0.18 -0.19 -0.51 0.41 0.00 0.00 173.24 173.50 1itp s ILE 68 N 0.78 1.85 -0.60 1.44 1.10 -1.26 -0.12 121.20 124.38 1itp s ILE 68 Ca -0.04 -0.85 0.06 0.00 -0.51 0.00 0.00 60.65 59.31 1itp s ILE 68 Cb -0.05 -1.65 0.23 0.00 0.15 0.00 0.00 42.46 41.14 1itp s ILE 68 CO -0.06 0.51 0.64 1.21 -2.11 0.00 0.00 174.94 175.13 1itp n GLU 69 N 4.12 1.95 -2.17 3.50 2.13 -0.48 -5.00 120.64 124.68 1itp n GLU 69 Ca -0.20 -4.30 -0.42 0.00 0.66 0.00 0.00 57.16 52.90 1itp n GLU 69 Cb 0.51 -2.05 -0.03 0.00 0.27 0.00 0.00 31.44 30.14 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 -1.91 4.34 -0.08 5.31 4.04 -1.26 -2.63 118.70 126.50 1itp s GLU 70 Ca 0.36 2.08 0.17 0.00 0.04 0.00 0.00 54.97 57.62 1itp s GLU 70 Cb 0.11 -3.22 0.36 0.00 0.02 0.00 0.00 34.13 31.40 1itp s GLU 70 CO -0.07 -0.38 1.16 -3.47 -1.84 0.00 0.00 175.26 170.66 1itp n ASP 71 N 3.48 1.22 -4.89 0.83 -0.08 -1.07 -5.00 116.55 111.05 1itp n ASP 71 Ca 0.10 -2.71 -0.32 0.00 -1.51 0.00 0.00 54.79 50.34 1itp n ASP 71 Cb 0.42 -0.37 -0.05 0.00 2.34 0.00 0.00 41.12 43.46 1itp n ASP 71 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 1itp s GLY 72 N -2.36 2.26 -0.01 0.27 0.00 -1.24 -4.12 107.32 102.12 1itp s GLY 72 Ca 0.31 -0.50 -0.02 0.00 0.00 0.00 0.00 44.72 44.51 1itp s GLY 72 CO -0.10 -0.38 0.05 -0.42 0.00 0.00 0.00 173.10 172.25 1itp s ILE 73 N -1.62 0.02 0.00 0.90 1.01 0.24 -4.91 121.20 116.84 1itp s ILE 73 Ca 0.40 -0.18 0.00 0.00 0.00 0.00 0.00 60.65 60.86 1itp s ILE 73 Cb -0.12 -0.15 0.00 0.00 0.01 0.00 0.00 42.46 42.20 1itp s ILE 73 CO 0.23 -0.10 0.00 0.52 0.00 0.00 0.00 174.94 175.59 1itp n VAL 74 N 2.71 0.00 -1.56 2.92 0.31 -1.26 -4.62 118.33 116.83 1itp n VAL 74 Ca -0.15 0.00 -0.46 0.00 -0.01 0.00 0.00 64.34 63.72 1itp n VAL 74 Cb 0.59 -0.61 -0.02 0.00 -0.91 0.00 0.00 33.84 32.88 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 -1.11 1.76 -0.11 2.52 -1.04 -1.26 -4.92 114.28 110.12 1itp n THR 75 Ca 0.00 -0.44 -0.19 0.00 -2.04 0.00 0.00 64.05 61.38 1itp n THR 75 Cb 0.00 -0.84 -0.07 0.00 -1.82 0.00 0.00 70.33 67.60 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 0.46 1.51 0.37 12.58 -1.04 -1.26 -5.27 114.28 121.62 1itp n THR 76 Ca 0.12 -0.09 0.04 0.00 -2.04 0.00 0.00 64.05 62.08 1itp n THR 76 Cb 0.29 -2.11 0.04 0.00 -1.82 0.00 0.00 70.33 66.73 1itp n THR 76 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43