#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 -2.68 -0.63 1.61 3.41 -1.26 -4.82 113.62 109.25 1itp n SER 2 Ca 0.00 -0.16 0.07 0.00 -0.26 0.00 0.00 58.87 58.52 1itp n SER 2 Cb 0.00 -0.75 0.22 0.00 -0.26 0.00 0.00 64.21 63.42 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 -4.09 2.47 0.00 7.33 0.00 -0.96 -5.01 120.51 120.25 1itp n ALA 3 Ca 0.01 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.86 1itp n ALA 3 Cb 0.54 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 1.09 0.57 3.90 0.00 0.00 -1.25 -3.79 105.19 105.71 1itp n GLY 4 Ca 0.13 -2.14 -0.33 0.00 0.00 0.00 0.00 46.02 43.68 1itp n GLY 4 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1itp s LYS 5 N -0.82 3.47 0.26 1.61 2.20 -1.26 -1.69 119.74 123.51 1itp s LYS 5 Ca 0.00 -0.30 0.02 0.00 -0.36 0.00 0.00 55.97 55.34 1itp s LYS 5 Cb 0.00 -3.07 -0.05 0.00 -1.51 0.00 0.00 37.83 33.20 1itp s LYS 5 CO 0.00 0.65 0.06 -0.06 -0.36 0.00 0.00 175.35 175.63 1itp s PHE 6 N -1.38 1.59 -0.19 4.03 0.40 0.18 -2.48 117.98 120.13 1itp s PHE 6 Ca 0.30 -1.06 -0.05 0.00 -0.60 0.00 0.00 56.93 55.52 1itp s PHE 6 Cb -0.13 -0.95 0.07 0.00 0.51 0.00 0.00 43.02 42.52 1itp s PHE 6 CO 0.21 -0.19 0.11 0.42 0.70 0.00 0.00 175.22 176.47 1itp s ILE 7 N -3.58 -0.11 0.27 0.64 1.01 -0.17 -2.56 121.20 116.70 1itp s ILE 7 Ca 0.34 -0.27 0.11 0.00 0.00 0.00 0.00 60.65 60.83 1itp s ILE 7 Cb 0.07 -0.66 -0.05 0.00 0.01 0.00 0.00 42.46 41.84 1itp s ILE 7 CO 0.12 -0.36 -0.11 0.68 0.00 0.00 0.00 174.94 175.28 1itp s VAL 8 N 2.15 2.95 0.05 2.92 -7.23 -1.15 -0.82 120.40 119.27 1itp s VAL 8 Ca 0.04 -2.15 0.01 0.00 -1.81 0.00 0.00 61.98 58.07 1itp s VAL 8 Cb -0.16 -2.56 -0.03 0.00 0.56 0.00 0.00 36.38 34.19 1itp s VAL 8 CO -0.14 -0.37 -0.06 -0.63 -0.31 0.00 0.00 175.10 173.58 1itp s ILE 9 N -2.38 0.42 -0.05 -0.62 1.09 0.12 -2.26 121.20 117.51 1itp s ILE 9 Ca 0.30 -1.26 0.03 0.00 -1.10 0.00 0.00 60.65 58.63 1itp s ILE 9 Cb -0.06 -0.79 -0.03 0.00 -1.06 0.00 0.00 42.46 40.52 1itp s ILE 9 CO 0.17 -0.56 -0.13 -0.36 -0.10 0.00 0.00 174.94 173.96 1itp s PHE 10 N -2.05 2.73 0.99 3.97 0.08 0.44 0.19 117.98 124.33 1itp s PHE 10 Ca -0.06 -0.13 -0.14 0.00 0.12 0.00 0.00 56.93 56.71 1itp s PHE 10 Cb -0.06 -1.64 0.13 0.00 -0.57 0.00 0.00 43.02 40.89 1itp s PHE 10 CO -0.02 0.21 0.17 0.36 -0.10 0.00 0.00 175.22 175.83 1itp n LYS 11 N 2.30 -1.95 -0.93 0.44 2.85 -0.97 -4.25 118.16 115.64 1itp n LYS 11 Ca -0.17 -0.58 -0.19 0.00 -1.05 0.00 0.00 58.31 56.32 1itp n LYS 11 Cb 0.52 -1.45 0.09 0.00 -0.65 0.00 0.00 35.03 33.55 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 -0.83 4.95 0.00 -5.58 5.15 -1.26 -3.87 115.26 113.82 1itp n ASN 12 Ca 0.04 -3.20 0.00 0.00 -0.60 0.00 0.00 54.58 50.83 1itp n ASN 12 Cb 0.39 -0.85 0.00 0.00 -0.53 0.00 0.00 39.78 38.78 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 -0.42 2.45 -3.78 1.20 2.03 -1.26 -5.07 116.55 111.69 1itp n ASP 13 Ca 0.41 0.00 -0.34 0.00 0.52 0.00 0.00 54.79 55.38 1itp n ASP 13 Cb 1.01 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 41.43 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 -2.38 0.00 -2.60 5.18 3.14 -1.25 -4.93 118.33 115.49 1itp n VAL 14 Ca 0.00 -0.45 -0.23 0.00 -2.96 0.00 0.00 64.34 60.69 1itp n VAL 14 Cb 0.38 0.00 0.04 0.00 -1.06 0.00 0.00 33.84 33.19 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 -0.91 5.35 -0.01 6.55 1.04 -1.26 -4.98 113.70 119.49 1itp s SER 15 Ca 0.46 0.24 -0.23 0.00 0.48 0.00 0.00 55.95 56.89 1itp s SER 15 Cb -0.35 -1.17 -0.15 0.00 0.10 0.00 0.00 66.02 64.45 1itp s SER 15 CO 0.66 -1.12 1.07 -0.08 0.98 0.00 0.00 173.24 174.74 1itp h GLU 16 N -0.02 -0.47 -0.47 4.02 4.57 -2.00 -1.90 114.58 118.31 1itp h GLU 16 Ca -0.44 0.03 0.06 0.00 -1.18 0.00 0.00 59.36 57.83 1itp h GLU 16 Cb 1.29 0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.96 1itp h GLU 16 CO 0.56 -0.16 0.31 -0.44 -1.18 0.00 0.00 179.01 178.11 1itp h ASP 17 N -0.91 0.34 -0.33 1.04 3.32 -1.99 -0.67 116.42 117.22 1itp h ASP 17 Ca -0.05 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 1itp h ASP 17 Cb 0.54 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 1itp h ASP 17 CO 0.08 0.22 0.18 0.11 -1.72 0.00 0.00 179.24 178.11 1itp h LYS 18 N 0.39 0.46 0.39 3.56 6.56 -1.93 0.16 116.57 126.15 1itp h LYS 18 Ca 0.20 -0.05 -0.00 0.00 -1.06 0.00 0.00 60.65 59.74 1itp h LYS 18 Cb 0.32 -0.09 -0.03 0.00 -0.57 0.00 0.00 32.23 31.86 1itp h LYS 18 CO -0.05 0.39 -0.46 0.82 -2.06 0.00 0.00 179.45 178.08 1itp h ILE 19 N 0.40 0.09 -0.41 1.86 2.04 -0.30 0.36 117.51 121.56 1itp h ILE 19 Ca 0.11 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.08 1itp h ILE 19 Cb 0.06 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.21 1itp h ILE 19 CO -0.02 0.00 0.29 0.03 0.00 0.00 0.00 178.15 178.45 1itp h ARG 20 N -0.88 0.06 0.14 2.37 3.08 -1.30 -1.48 114.38 116.38 1itp h ARG 20 Ca -0.04 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 1itp h ARG 20 Cb 0.80 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.84 1itp h ARG 20 CO -0.11 0.04 -0.07 0.93 -1.07 0.00 0.00 179.97 179.69 1itp h GLU 21 N 0.06 -0.18 -0.91 0.04 5.08 0.93 0.10 114.58 119.70 1itp h GLU 21 Ca 0.19 0.01 0.24 0.00 -1.00 0.00 0.00 59.36 58.81 1itp h GLU 21 Cb 0.69 0.04 -0.16 0.00 0.50 0.00 0.00 28.75 29.82 1itp h GLU 21 CO -0.01 -0.12 0.05 1.15 -1.00 0.00 0.00 179.01 179.07 1itp h THR 22 N -0.29 0.14 -0.21 1.13 2.02 -0.13 1.66 112.91 117.23 1itp h THR 22 Ca -0.02 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 1itp h THR 22 Cb 0.15 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 66.62 1itp h THR 22 CO 0.03 0.01 0.10 0.11 0.37 0.00 0.00 175.52 176.14 1itp h LYS 23 N 0.06 0.31 -0.85 6.66 6.56 -1.32 -2.18 116.57 125.82 1itp h LYS 23 Ca 0.54 -0.05 -0.02 0.00 -1.06 0.00 0.00 60.65 60.06 1itp h LYS 23 Cb 1.08 -0.05 -0.04 0.00 -0.57 0.00 0.00 32.23 32.64 1itp h LYS 23 CO -0.82 0.35 0.46 -0.44 -2.06 0.00 0.00 179.45 176.94 1itp h ASP 24 N 0.21 1.07 -0.65 0.86 5.19 0.31 -0.32 116.42 123.09 1itp h ASP 24 Ca 0.07 -0.10 0.10 0.00 -0.62 0.00 0.00 57.03 56.49 1itp h ASP 24 Cb 0.14 -0.27 -0.04 0.00 0.18 0.00 0.00 39.33 39.34 1itp h ASP 24 CO -0.01 0.86 0.43 -0.08 -3.12 0.00 0.00 179.24 177.33 1itp h GLU 25 N 1.19 0.46 0.14 3.56 4.81 0.25 0.21 114.58 125.21 1itp h GLU 25 Ca 0.30 -0.03 -0.29 0.00 -0.13 0.00 0.00 59.36 59.21 1itp h GLU 25 Cb 0.04 -0.10 0.02 0.00 0.63 0.00 0.00 28.75 29.33 1itp h GLU 25 CO -0.05 0.31 -1.27 -0.24 -0.73 0.00 0.00 179.01 177.03 1itp h VAL 26 N 0.48 1.38 0.01 0.32 3.04 -0.64 0.19 116.25 121.04 1itp h VAL 26 Ca 0.30 -2.75 0.00 0.00 -1.01 0.00 0.00 66.70 63.24 1itp h VAL 26 Cb 0.54 2.84 -0.00 0.00 -2.01 0.00 0.00 31.29 32.66 1itp h VAL 26 CO -0.09 0.82 -0.02 0.40 -1.01 0.00 0.00 177.57 177.66 1itp h ILE 27 N 0.16 0.94 -0.07 3.17 1.08 0.60 0.56 117.51 123.96 1itp h ILE 27 Ca -0.17 0.00 -0.07 0.00 -0.39 0.00 0.00 64.86 64.23 1itp h ILE 27 Cb 1.96 0.94 0.00 0.00 -3.07 0.00 0.00 36.82 36.65 1itp h ILE 27 CO 0.23 0.00 -0.21 0.00 -0.69 0.00 0.00 178.15 177.47 1itp h ALA 28 N 0.94 0.11 -0.08 1.87 0.00 -0.76 -3.35 119.26 117.99 1itp h ALA 28 Ca 0.01 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1itp h ALA 28 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1itp h ALA 28 CO -0.02 0.09 0.00 -1.91 0.00 0.00 0.00 179.25 177.41 1itp n GLU 29 N -4.53 0.00 0.02 0.00 2.13 0.66 -4.95 120.64 113.97 1itp n GLU 29 Ca -0.08 0.65 0.00 0.00 0.66 0.00 0.00 57.16 58.39 1itp n GLU 29 Cb 0.43 -1.49 0.00 0.00 0.27 0.00 0.00 31.44 30.66 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 -0.99 -1.88 3.04 8.31 0.00 0.18 -5.04 105.19 108.81 1itp n GLY 30 Ca 0.00 0.50 -0.37 0.00 0.00 0.00 0.00 46.02 46.15 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 -1.49 -3.64 2.67 -0.02 0.00 -0.40 -4.67 105.19 97.64 1itp n GLY 31 Ca 0.00 -0.49 -0.19 0.00 0.00 0.00 0.00 46.02 45.34 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 -3.13 0.00 -4.34 2.61 -1.04 0.19 -2.68 114.28 105.89 1itp n THR 32 Ca -0.01 -1.94 -0.21 0.00 -2.04 0.00 0.00 64.05 59.84 1itp n THR 32 Cb 0.65 0.80 -0.16 0.00 -1.82 0.00 0.00 70.33 69.80 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 -2.91 0.75 -0.06 12.58 -1.09 -1.26 -1.89 121.20 127.32 1itp s ILE 33 Ca 0.22 -0.28 0.05 0.00 -2.23 0.00 0.00 60.65 58.42 1itp s ILE 33 Cb 0.01 -0.71 -0.08 0.00 -1.58 0.00 0.00 42.46 40.11 1itp s ILE 33 CO 0.16 0.26 0.03 1.07 -1.23 0.00 0.00 174.94 175.23 1itp n THR 34 N 3.72 0.39 -3.76 2.92 5.66 -0.98 -4.88 114.28 117.35 1itp n THR 34 Ca -0.22 -0.25 -0.10 0.00 -3.05 0.00 0.00 64.05 60.43 1itp n THR 34 Cb 0.52 -0.76 -0.05 0.00 -1.55 0.00 0.00 70.33 68.49 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 -3.68 -0.13 0.22 1.09 3.84 0.15 -4.99 114.94 111.45 1itp s ASN 35 Ca -0.03 -0.51 0.01 0.00 0.21 0.00 0.00 52.86 52.54 1itp s ASN 35 Cb 0.02 0.46 -0.05 0.00 -0.55 0.00 0.00 41.25 41.14 1itp s ASN 35 CO 0.25 -0.88 0.07 -1.83 -2.79 0.00 0.00 177.10 171.91 1itp s GLU 36 N -3.86 1.27 -0.32 0.43 1.03 -1.26 -0.35 118.70 115.64 1itp s GLU 36 Ca 0.07 -1.66 0.01 0.00 0.03 0.00 0.00 54.97 53.42 1itp s GLU 36 Cb 0.02 -0.20 0.10 0.00 -0.80 0.00 0.00 34.13 33.25 1itp s GLU 36 CO -0.08 -0.25 0.09 0.71 -1.33 0.00 0.00 175.26 174.41 1itp s TYR 37 N -3.77 2.32 -0.94 4.83 2.02 0.81 -4.79 117.35 117.82 1itp s TYR 37 Ca 0.33 -2.13 -0.01 0.00 -0.37 0.00 0.00 57.07 54.89 1itp s TYR 37 Cb 0.07 -2.08 0.29 0.00 -0.40 0.00 0.00 41.96 39.84 1itp s TYR 37 CO 0.10 -0.90 1.26 0.27 -1.57 0.00 0.00 175.55 174.71 1itp n ASN 38 N 4.63 5.61 -4.88 2.29 0.23 -1.26 -2.50 115.26 119.37 1itp n ASN 38 Ca 0.00 -3.43 -0.21 0.00 -0.53 0.00 0.00 54.58 50.41 1itp n ASN 38 Cb 0.42 -1.08 -0.03 0.00 -2.08 0.00 0.00 39.78 37.00 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 -2.70 3.03 -0.56 -3.83 -1.94 -0.85 -5.04 119.30 107.41 1itp s MET 39 Ca 0.34 -1.02 -0.28 0.00 -1.71 0.00 0.00 55.69 53.02 1itp s MET 39 Cb 0.08 -2.65 0.01 0.00 2.01 0.00 0.00 34.83 34.27 1itp s MET 39 CO 0.07 0.31 1.50 -1.25 -0.01 0.00 0.00 175.02 175.64 1itp s PRO 40 N -3.94 3.21 0.00 2.03 0.04 -1.26 -2.32 135.00 132.76 1itp s PRO 40 Ca 0.36 0.51 0.00 0.00 0.04 0.00 0.00 61.00 61.91 1itp s PRO 40 Cb -0.08 -4.17 0.00 0.00 0.04 0.00 0.00 34.50 30.29 1itp s PRO 40 CO 0.27 -2.05 0.00 0.41 0.04 0.00 0.00 177.00 175.67 1itp n GLY 41 N 5.34 0.48 3.04 0.56 0.00 -1.26 -5.04 105.19 108.30 1itp n GLY 41 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.99 2.34 -0.46 1.61 0.00 -0.98 -4.84 119.30 115.98 1itp s MET 42 Ca 0.00 -0.79 0.04 0.00 0.00 0.00 0.00 55.69 54.94 1itp s MET 42 Cb 0.00 -2.39 0.12 0.00 0.00 0.00 0.00 34.83 32.56 1itp s MET 42 CO 0.00 -0.33 0.20 0.15 0.00 0.00 0.00 175.02 175.04 1itp s LYS 43 N 1.38 1.76 0.10 4.11 1.02 -1.26 -2.00 119.74 124.85 1itp s LYS 43 Ca 0.01 -2.35 0.02 0.00 0.02 0.00 0.00 55.97 53.68 1itp s LYS 43 Cb -0.15 -3.17 -0.01 0.00 -0.52 0.00 0.00 37.83 33.98 1itp s LYS 43 CO -0.10 -1.07 0.09 0.41 -0.92 0.00 0.00 175.35 173.76 1itp n GLY 44 N 3.47 3.67 3.51 -3.33 0.00 -1.04 -0.42 105.19 111.04 1itp n GLY 44 Ca 0.05 -1.72 -0.09 0.00 0.00 0.00 0.00 46.02 44.26 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 -2.46 -0.38 0.01 1.61 -0.71 -0.96 -0.14 117.98 114.96 1itp s PHE 45 Ca 0.12 0.20 0.04 0.00 -1.04 0.00 0.00 56.93 56.25 1itp s PHE 45 Cb 0.01 0.56 -0.01 0.00 -1.21 0.00 0.00 43.02 42.36 1itp s PHE 45 CO 0.09 -0.67 -0.12 0.00 -1.34 0.00 0.00 175.22 173.18 1itp s ALA 46 N -3.33 0.96 0.00 1.99 0.00 0.52 -2.94 121.76 118.97 1itp s ALA 46 Ca 0.05 -0.61 0.00 0.00 0.00 0.00 0.00 51.96 51.40 1itp s ALA 46 Cb -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.92 1itp s ALA 46 CO -0.09 0.20 0.00 0.41 0.00 0.00 0.00 175.76 176.28 1itp n GLY 47 N 2.38 -0.84 3.69 0.00 0.00 -1.06 0.34 105.19 109.70 1itp n GLY 47 Ca -0.16 -0.22 -0.35 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.02 4.02 0.00 1.61 2.02 -0.80 -0.64 118.70 124.89 1itp s GLU 48 Ca 0.00 -0.28 0.00 0.00 0.02 0.00 0.00 54.97 54.71 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 0.32 0.00 1.28 0.02 0.00 0.00 175.26 176.88 1itp n LEU 49 N 3.41 0.00 0.00 1.80 4.32 -0.68 0.55 117.00 126.40 1itp n LEU 49 Ca -0.17 0.00 -0.06 0.00 -0.02 0.00 0.00 56.01 55.77 1itp n LEU 49 Cb 0.52 0.00 0.01 0.00 -1.62 0.00 0.00 43.42 42.33 1itp n LEU 49 CO 0.36 0.00 0.25 0.41 -1.22 0.00 0.00 177.39 177.19 1itp n THR 50 N 0.00 0.00 0.12 -5.08 -1.04 -1.26 -2.28 114.28 104.74 1itp n THR 50 Ca 0.00 -0.67 -0.02 0.00 -2.04 0.00 0.00 64.05 61.33 1itp n THR 50 Cb 0.00 0.57 0.10 0.00 -1.82 0.00 0.00 70.33 69.18 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 0.52 -2.82 0.13 -1.99 -2.76 132.00 125.07 1itp h PRO 51 Ca -0.18 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.92 1itp h PRO 51 Cb 0.69 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.82 1itp h PRO 51 CO 0.23 0.68 -0.25 1.96 -0.23 0.00 0.00 178.00 180.40 1itp h GLN 52 N 0.00 -0.67 -0.98 0.86 7.50 -2.00 -2.81 115.11 117.01 1itp h GLN 52 Ca -0.01 0.05 0.21 0.00 0.50 0.00 0.00 58.65 59.40 1itp h GLN 52 Cb 1.28 0.15 -0.09 0.00 0.05 0.00 0.00 27.48 28.87 1itp h GLN 52 CO 0.09 -0.45 0.62 0.77 -1.50 0.00 0.00 178.83 178.36 1itp h SER 53 N -1.07 0.59 0.00 1.46 0.02 -1.97 -2.48 113.55 110.10 1itp h SER 53 Ca -0.07 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1itp h SER 53 Cb 0.53 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.04 1itp h SER 53 CO 0.12 0.20 0.00 0.18 -1.14 0.00 0.00 176.83 176.19 1itp n LEU 54 N -4.64 0.00 -0.59 5.07 4.32 -1.04 -1.18 117.00 118.93 1itp n LEU 54 Ca 0.22 0.86 0.45 0.00 -0.02 0.00 0.00 56.01 57.52 1itp n LEU 54 Cb 0.67 -0.36 0.70 0.00 -1.62 0.00 0.00 43.42 42.80 1itp n LEU 54 CO 0.26 -0.36 1.26 0.41 -1.22 0.00 0.00 177.39 177.73 1itp n THR 55 N -1.89 -0.03 0.00 -5.08 -1.04 -0.96 0.21 114.28 105.49 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 -2.19 0.00 0.00 -1.82 0.00 0.00 70.33 66.32 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 -3.75 0.00 -0.40 -2.82 0.00 -0.33 -2.76 118.16 108.11 1itp n LYS 56 Ca 0.38 0.43 0.05 0.00 0.00 0.00 0.00 58.31 59.17 1itp n LYS 56 Cb 1.70 -1.41 0.21 0.00 0.00 0.00 0.00 35.03 35.52 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 -1.77 0.94 -0.01 5.64 1.16 0.70 -3.80 117.46 120.31 1itp n PHE 57 Ca 0.00 -0.35 -0.20 0.00 -1.87 0.00 0.00 57.45 55.03 1itp n PHE 57 Cb 0.00 -0.22 -0.14 0.00 -1.61 0.00 0.00 39.48 37.51 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 0.45 0.74 0.05 3.97 6.02 0.57 -3.45 117.38 125.72 1itp n GLN 58 Ca 0.14 0.25 -0.22 0.00 -0.01 0.00 0.00 57.00 57.16 1itp n GLN 58 Cb 0.63 -1.69 -0.15 0.00 1.02 0.00 0.00 30.24 30.05 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 1.48 0.38 1.71 1.08 0.00 -1.63 -3.25 103.07 102.86 1itp h GLY 59 Ca -0.43 -0.98 0.00 0.00 0.00 0.00 0.00 47.33 45.92 1itp h GLY 59 CO 0.07 0.86 0.00 -0.10 0.00 0.00 0.00 176.54 177.37 1itp n LEU 60 N -3.87 0.00 -4.08 3.11 7.94 -1.25 -4.82 117.00 114.02 1itp n LEU 60 Ca -0.21 0.36 -0.37 0.00 -1.11 0.00 0.00 56.01 54.68 1itp n LEU 60 Cb 0.95 -0.36 0.07 0.00 0.53 0.00 0.00 43.42 44.61 1itp n LEU 60 CO 0.48 -0.17 -1.50 1.67 -1.11 0.00 0.00 177.39 176.76 1itp n GLN 61 N -1.36 -0.32 0.00 1.96 7.27 -1.22 -2.68 117.38 121.03 1itp n GLN 61 Ca 0.06 -0.09 0.00 0.00 0.07 0.00 0.00 57.00 57.04 1itp n GLN 61 Cb 0.14 -1.20 0.00 0.00 2.41 0.00 0.00 30.24 31.60 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 3.07 1.77 0.90 1.69 0.00 -0.90 -4.52 105.19 107.20 1itp n GLY 62 Ca -0.01 -0.29 0.04 0.00 0.00 0.00 0.00 46.02 45.76 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 1.85 3.16 0.12 1.61 2.03 -1.09 -4.77 116.55 119.46 1itp n ASP 63 Ca 0.00 -3.32 0.00 0.00 0.52 0.00 0.00 54.79 51.99 1itp n ASP 63 Cb 0.00 -0.57 0.00 0.00 -0.72 0.00 0.00 41.12 39.83 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 -0.86 -2.20 -4.69 -2.67 7.94 -1.25 -4.94 117.00 108.33 1itp n LEU 64 Ca 0.25 0.47 -0.38 0.00 -1.11 0.00 0.00 56.01 55.25 1itp n LEU 64 Cb 0.92 2.29 -0.07 0.00 0.53 0.00 0.00 43.42 47.08 1itp n LEU 64 CO 0.15 -0.08 0.11 -0.63 -1.11 0.00 0.00 177.39 175.83 1itp s ILE 65 N -1.49 5.21 -0.02 1.96 1.01 -1.26 -2.30 121.20 124.30 1itp s ILE 65 Ca 0.00 0.75 -0.14 0.00 0.00 0.00 0.00 60.65 61.27 1itp s ILE 65 Cb 0.00 -3.74 -0.32 0.00 0.01 0.00 0.00 42.46 38.40 1itp s ILE 65 CO 0.00 0.28 0.79 -0.78 0.00 0.00 0.00 174.94 175.23 1itp h ASP 66 N 7.12 0.69 -3.76 3.58 3.58 0.17 -2.38 116.42 125.43 1itp h ASP 66 Ca -0.38 -0.93 -0.16 0.00 0.42 0.00 0.00 57.03 55.98 1itp h ASP 66 Cb 1.17 -0.22 -0.26 0.00 1.72 0.00 0.00 39.33 41.73 1itp h ASP 66 CO 0.73 1.74 -0.41 -0.44 -2.88 0.00 0.00 179.24 177.98 1itp s SER 67 N -7.38 -0.28 -0.06 2.28 0.01 -1.15 -4.92 113.70 102.20 1itp s SER 67 Ca -0.14 0.54 0.04 0.00 1.31 0.00 0.00 55.95 57.70 1itp s SER 67 Cb 0.05 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.81 1itp s SER 67 CO 0.88 -0.10 -0.18 -0.51 0.41 0.00 0.00 173.24 173.74 1itp s ILE 68 N 0.29 1.52 -0.27 1.44 2.07 -1.26 0.10 121.20 125.10 1itp s ILE 68 Ca -0.01 -0.73 -0.03 0.00 -1.41 0.00 0.00 60.65 58.46 1itp s ILE 68 Cb -0.03 -1.33 0.09 0.00 0.13 0.00 0.00 42.46 41.32 1itp s ILE 68 CO -0.01 0.44 0.10 -0.70 -1.91 0.00 0.00 174.94 172.86 1itp s GLU 69 N 0.29 0.36 0.00 3.50 -6.30 0.00 -5.00 118.70 111.56 1itp s GLU 69 Ca -0.11 -0.59 -0.22 0.00 -2.50 0.00 0.00 54.97 51.55 1itp s GLU 69 Cb -0.15 -1.58 -0.05 0.00 0.00 0.00 0.00 34.13 32.36 1itp s GLU 69 CO 0.04 -0.92 0.66 -1.83 0.02 0.00 0.00 175.26 173.24 1itp s GLU 70 N 1.96 4.39 -0.05 4.30 4.04 -1.26 -1.00 118.70 131.08 1itp s GLU 70 Ca 0.07 0.86 0.07 0.00 0.04 0.00 0.00 54.97 56.01 1itp s GLU 70 Cb -0.16 -3.36 0.10 0.00 0.02 0.00 0.00 34.13 30.72 1itp s GLU 70 CO -0.27 0.30 0.97 -3.47 -1.84 0.00 0.00 175.26 170.96 1itp n ASP 71 N 2.89 1.38 -0.10 0.83 2.03 -1.04 -4.78 116.55 117.76 1itp n ASP 71 Ca -0.05 -2.22 -0.17 0.00 0.52 0.00 0.00 54.79 52.87 1itp n ASP 71 Cb 0.51 -0.19 -0.07 0.00 -0.72 0.00 0.00 41.12 40.64 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 -0.65 -0.76 2.65 0.27 0.00 -1.21 -4.42 105.19 101.08 1itp n GLY 72 Ca 0.06 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1itp n GLY 72 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1itp n ILE 73 N -4.45 4.48 -0.04 -0.61 5.41 -1.25 -4.43 119.36 118.47 1itp n ILE 73 Ca -0.28 -3.91 -0.05 0.00 1.00 0.00 0.00 62.75 59.51 1itp n ILE 73 Cb 0.59 -2.35 -0.02 0.00 -0.71 0.00 0.00 39.64 37.15 1itp n ILE 73 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1itp n VAL 74 N 3.15 1.07 -1.41 1.39 0.31 -1.26 -5.12 118.33 116.46 1itp n VAL 74 Ca 0.54 0.25 0.01 0.00 -0.01 0.00 0.00 64.34 65.13 1itp n VAL 74 Cb 0.31 -1.96 -0.01 0.00 -0.91 0.00 0.00 33.84 31.27 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 -3.79 -2.48 -3.07 2.52 -1.04 -1.26 -4.91 114.28 100.25 1itp n THR 75 Ca -0.08 1.28 -0.00 0.00 -2.04 0.00 0.00 64.05 63.21 1itp n THR 75 Cb 0.29 -2.12 -0.00 0.00 -1.82 0.00 0.00 70.33 66.68 1itp n THR 75 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1itp n THR 76 N -2.65 -4.41 0.90 12.58 -2.24 -1.26 -5.22 114.28 111.98 1itp n THR 76 Ca -0.01 0.82 0.11 0.00 -2.27 0.00 0.00 64.05 62.70 1itp n THR 76 Cb 0.46 -3.93 0.09 0.00 -2.10 0.00 0.00 70.33 64.85 1itp n THR 76 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50