#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1psf s ILE 2 N 0.00 3.11 0.82 0.00 1.09 -1.26 -4.93 121.20 120.03 1psf s ILE 2 Ca 0.00 0.02 -0.14 0.00 -1.10 0.00 0.00 60.65 59.43 1psf s ILE 2 Cb 0.00 -3.27 0.19 0.00 -1.06 0.00 0.00 42.46 38.32 1psf s ILE 2 CO 0.00 -0.26 1.11 -0.62 -0.10 0.00 0.00 174.94 175.07 1psf n GLU 3 N 9.00 -1.09 -3.29 2.79 1.02 -1.26 -5.03 120.64 122.79 1psf n GLU 3 Ca 0.35 -1.72 -0.38 0.00 -0.02 0.00 0.00 57.16 55.39 1psf n GLU 3 Cb 0.52 -1.15 -0.06 0.00 -0.02 0.00 0.00 31.44 30.73 1psf n GLU 3 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1psf s ARG 4 N -5.43 4.22 -2.11 3.49 3.52 -1.26 -3.86 118.95 117.52 1psf s ARG 4 Ca 0.63 0.65 0.00 0.00 -0.13 0.00 0.00 55.73 56.88 1psf s ARG 4 Cb -0.02 -3.30 0.00 0.00 -1.56 0.00 0.00 34.95 30.07 1psf s ARG 4 CO 0.44 0.47 0.00 0.41 -0.81 0.00 0.00 175.30 175.82 1psf n GLY 5 N 2.24 1.62 3.92 8.12 0.00 -0.54 -4.93 105.19 115.62 1psf n GLY 5 Ca -0.09 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 1psf n GLY 5 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1psf s SER 6 N -2.69 6.26 -0.31 1.61 0.15 -1.25 -4.64 113.70 112.83 1psf s SER 6 Ca 0.00 0.71 -0.26 0.00 0.70 0.00 0.00 55.95 57.09 1psf s SER 6 Cb 0.00 -2.13 0.01 0.00 -1.71 0.00 0.00 66.02 62.19 1psf s SER 6 CO 0.00 -0.47 0.94 -0.54 1.20 0.00 0.00 173.24 174.37 1psf s LYS 7 N -4.56 4.03 -0.15 5.44 1.02 -1.26 -2.33 119.74 121.94 1psf s LYS 7 Ca 0.44 0.87 0.01 0.00 0.02 0.00 0.00 55.97 57.32 1psf s LYS 7 Cb -0.10 -3.72 0.02 0.00 -0.52 0.00 0.00 37.83 33.50 1psf s LYS 7 CO 0.41 -0.78 -0.17 0.14 -0.92 0.00 0.00 175.35 174.03 1psf s VAL 8 N 3.29 1.76 -0.29 3.17 -7.23 -0.99 -2.23 120.40 117.90 1psf s VAL 8 Ca 0.39 -0.77 -0.29 0.00 -1.81 0.00 0.00 61.98 59.50 1psf s VAL 8 Cb -0.13 -1.61 0.01 0.00 0.56 0.00 0.00 36.38 35.21 1psf s VAL 8 CO 0.13 0.49 1.10 -0.75 -0.31 0.00 0.00 175.10 175.76 1psf s LYS 9 N 1.20 4.11 0.20 4.82 2.20 -0.94 -1.98 119.74 129.34 1psf s LYS 9 Ca 0.00 1.19 -0.31 0.00 -0.36 0.00 0.00 55.97 56.49 1psf s LYS 9 Cb -0.14 -3.73 -0.10 0.00 -1.51 0.00 0.00 37.83 32.35 1psf s LYS 9 CO -0.07 -0.85 1.53 0.42 -0.36 0.00 0.00 175.35 176.02 1psf s ILE 10 N 3.60 2.58 -0.23 5.43 -1.09 -0.85 -2.20 121.20 128.45 1psf s ILE 10 Ca 0.47 0.44 0.10 0.00 -2.23 0.00 0.00 60.65 59.43 1psf s ILE 10 Cb -0.14 -3.28 0.43 0.00 -1.58 0.00 0.00 42.46 37.89 1psf s ILE 10 CO 0.14 0.05 1.24 0.18 -1.23 0.00 0.00 174.94 175.31 1psf n LEU 11 N 3.32 3.09 -4.63 2.97 7.99 -0.84 -3.20 117.00 125.69 1psf n LEU 11 Ca 0.11 -4.00 -0.40 0.00 -0.01 0.00 0.00 56.01 51.70 1psf n LEU 11 Cb 0.39 -0.52 -0.07 0.00 -0.11 0.00 0.00 43.42 43.12 1psf n LEU 11 CO 0.61 1.49 0.34 -0.60 -1.51 0.00 0.00 177.39 177.72 1psf s ARG 12 N -3.29 4.11 0.06 3.23 3.00 -1.26 -4.98 118.95 119.82 1psf s ARG 12 Ca 0.40 0.48 -0.31 0.00 -1.00 0.00 0.00 55.73 55.30 1psf s ARG 12 Cb 0.38 -3.64 -0.16 0.00 0.00 0.00 0.00 34.95 31.53 1psf s ARG 12 CO -0.05 -0.36 1.47 0.87 0.00 0.00 0.00 175.30 177.22 1psf h LYS 13 N 7.87 -0.99 -5.43 5.12 1.57 -1.98 -3.28 116.57 119.44 1psf h LYS 13 Ca -0.28 0.07 -0.70 0.00 -1.87 0.00 0.00 60.65 57.87 1psf h LYS 13 Cb 1.13 0.22 -0.11 0.00 0.08 0.00 0.00 32.23 33.56 1psf h LYS 13 CO 0.75 -0.66 1.98 0.39 -0.57 0.00 0.00 179.45 181.35 1psf n GLU 14 N -5.00 3.25 -3.81 3.15 1.02 -1.26 -4.85 120.64 113.13 1psf n GLU 14 Ca -0.13 -3.44 -0.12 0.00 -0.02 0.00 0.00 57.16 53.45 1psf n GLU 14 Cb 0.42 -3.35 -0.12 0.00 -0.02 0.00 0.00 31.44 28.37 1psf n GLU 14 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1psf s SER 15 N 3.72 -0.18 0.60 1.62 0.01 -1.24 -5.02 113.70 113.21 1psf s SER 15 Ca 0.50 0.35 0.37 0.00 1.31 0.00 0.00 55.95 58.49 1psf s SER 15 Cb 0.02 0.35 1.81 0.00 0.21 0.00 0.00 66.02 68.42 1psf s SER 15 CO 0.05 -0.06 2.15 0.22 0.41 0.00 0.00 173.24 176.01 1psf h TYR 16 N 5.89 0.00 0.00 2.43 3.20 -1.92 -2.69 116.97 123.89 1psf h TYR 16 Ca -0.25 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.61 1psf h TYR 16 Cb 1.20 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.45 1psf h TYR 16 CO 0.41 0.02 -0.44 0.91 -1.64 0.00 0.00 178.16 177.41 1psf n TRP 17 N -3.15 0.00 -1.95 -3.82 8.01 -1.26 -5.05 117.44 110.21 1psf n TRP 17 Ca -0.01 -1.33 -0.41 0.00 -1.31 0.00 0.00 57.50 54.44 1psf n TRP 17 Cb 0.20 -0.22 -0.01 0.00 -2.01 0.00 0.00 31.31 29.27 1psf n TRP 17 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.69 176.21 1psf s TYR 18 N -2.95 2.83 0.00 -5.99 5.04 -1.02 -2.13 117.35 113.13 1psf s TYR 18 Ca 0.36 1.24 0.00 0.00 -2.44 0.00 0.00 57.07 56.23 1psf s TYR 18 Cb 0.35 -3.86 0.00 0.00 0.35 0.00 0.00 41.96 38.80 1psf s TYR 18 CO -0.06 -2.52 0.00 0.41 -1.34 0.00 0.00 175.55 172.05 1psf n GLY 19 N 0.85 2.04 3.78 8.97 0.00 -1.19 -5.03 105.19 114.62 1psf n GLY 19 Ca 0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 1psf n GLY 19 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1psf s ASP 20 N -2.62 5.32 0.36 1.61 1.01 -0.91 -4.90 116.67 116.54 1psf s ASP 20 Ca 0.00 -0.32 0.02 0.00 0.71 0.00 0.00 52.55 52.96 1psf s ASP 20 Cb 0.00 -1.29 -0.02 0.00 1.01 0.00 0.00 42.92 42.62 1psf s ASP 20 CO 0.00 -0.02 0.53 -0.69 0.21 0.00 0.00 175.17 175.20 1psf s VAL 21 N -2.14 4.60 0.08 -1.27 1.01 -1.26 -2.01 120.40 119.41 1psf s VAL 21 Ca 0.32 -0.68 -0.08 0.00 0.00 0.00 0.00 61.98 61.55 1psf s VAL 21 Cb -0.08 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.64 1psf s VAL 21 CO 0.24 -0.37 0.17 -0.83 0.00 0.00 0.00 175.10 174.30 1psf s GLY 22 N -4.11 0.13 -0.32 4.51 0.00 -0.84 -4.90 107.32 101.79 1psf s GLY 22 Ca 0.42 -0.66 -0.19 0.00 0.00 0.00 0.00 44.72 44.30 1psf s GLY 22 CO 0.34 -0.84 0.55 -1.59 0.00 0.00 0.00 173.10 171.56 1psf s THR 23 N -3.79 5.00 -0.02 0.90 2.01 -0.88 -2.34 115.64 116.52 1psf s THR 23 Ca 0.04 0.62 -0.36 0.00 0.31 0.00 0.00 61.69 62.30 1psf s THR 23 Cb 0.05 -3.94 -0.15 0.00 0.01 0.00 0.00 72.50 68.47 1psf s THR 23 CO -0.11 -0.13 1.61 0.52 -0.69 0.00 0.00 174.62 175.83 1psf n VAL 24 N 5.37 0.20 -0.12 3.82 0.31 -0.98 -1.50 118.33 125.42 1psf n VAL 24 Ca -0.04 -0.04 -0.25 0.00 -0.01 0.00 0.00 64.34 64.01 1psf n VAL 24 Cb 0.49 -1.31 -0.11 0.00 -0.91 0.00 0.00 33.84 32.00 1psf n VAL 24 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1psf n ALA 25 N 4.30 1.14 -3.57 3.52 0.00 -0.97 -1.47 120.51 123.46 1psf n ALA 25 Ca 0.21 -0.94 -0.06 0.00 0.00 0.00 0.00 53.44 52.66 1psf n ALA 25 Cb 0.22 -0.12 -0.02 0.00 0.00 0.00 0.00 19.45 19.53 1psf n ALA 25 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1psf s SER 26 N -7.14 -0.21 0.33 0.00 0.15 -1.23 -4.81 113.70 100.80 1psf s SER 26 Ca -0.35 0.01 0.09 0.00 0.70 0.00 0.00 55.95 56.40 1psf s SER 26 Cb 0.11 0.22 -0.05 0.00 -1.71 0.00 0.00 66.02 64.59 1psf s SER 26 CO 0.56 -0.35 0.04 -0.63 1.20 0.00 0.00 173.24 174.06 1psf s ILE 27 N -2.59 2.84 0.08 6.45 -1.09 -1.26 -2.48 121.20 123.15 1psf s ILE 27 Ca 0.08 -1.90 0.01 0.00 -2.23 0.00 0.00 60.65 56.61 1psf s ILE 27 Cb -0.01 -2.84 0.01 0.00 -1.58 0.00 0.00 42.46 38.04 1psf s ILE 27 CO -0.06 -0.22 0.07 -0.67 -1.23 0.00 0.00 174.94 172.83 1psf n ASP 28 N -0.99 1.07 -2.20 3.58 2.03 -1.01 -4.96 116.55 114.07 1psf n ASP 28 Ca -0.04 -1.26 -0.29 0.00 0.52 0.00 0.00 54.79 53.71 1psf n ASP 28 Cb 0.61 -0.02 0.07 0.00 -0.72 0.00 0.00 41.12 41.07 1psf n ASP 28 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1psf n LYS 29 N -0.78 2.42 -2.49 -0.67 3.00 -1.26 -4.81 118.16 113.56 1psf n LYS 29 Ca 0.00 -2.79 -0.21 0.00 -0.00 0.00 0.00 58.31 55.31 1psf n LYS 29 Cb 0.09 -2.09 -0.00 0.00 0.00 0.00 0.00 35.03 33.02 1psf n LYS 29 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1psf n SER 30 N -0.59 -5.96 0.10 3.14 7.64 -1.26 -4.86 113.62 111.84 1psf n SER 30 Ca 0.54 -0.06 -0.04 0.00 1.01 0.00 0.00 58.87 60.32 1psf n SER 30 Cb 0.69 -4.94 0.05 0.00 -1.01 0.00 0.00 64.21 59.00 1psf n SER 30 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1psf h GLY 31 N -0.21 0.03 -2.03 0.23 0.00 -1.98 -3.46 103.07 95.66 1psf h GLY 31 Ca -0.50 -0.06 -0.49 0.00 0.00 0.00 0.00 47.33 46.29 1psf h GLY 31 CO 0.58 0.05 -0.61 -0.26 0.00 0.00 0.00 176.54 176.30 1psf s ILE 32 N -3.25 1.29 0.31 2.60 -4.36 -1.26 -5.02 121.20 111.50 1psf s ILE 32 Ca -0.01 -2.01 0.26 0.00 -0.26 0.00 0.00 60.65 58.64 1psf s ILE 32 Cb 0.11 -2.78 0.27 0.00 1.25 0.00 0.00 42.46 41.31 1psf s ILE 32 CO 0.79 -0.03 1.98 -0.29 0.24 0.00 0.00 174.94 177.63 1psf h ILE 33 N 2.10 0.55 -2.56 8.37 2.10 -1.99 -3.31 117.51 122.78 1psf h ILE 33 Ca -0.41 -0.76 -0.60 0.00 1.08 0.00 0.00 64.86 64.17 1psf h ILE 33 Cb 1.24 1.51 -0.41 0.00 -1.09 0.00 0.00 36.82 38.07 1psf h ILE 33 CO 0.70 0.16 -0.71 -1.22 -1.08 0.00 0.00 178.15 176.00 1psf n TYR 34 N -3.53 2.21 0.54 2.19 4.01 -1.26 -3.96 117.16 117.36 1psf n TYR 34 Ca -0.01 -4.00 0.12 0.00 -0.16 0.00 0.00 57.90 53.85 1psf n TYR 34 Cb 0.31 -0.42 0.28 0.00 -0.31 0.00 0.00 39.34 39.20 1psf n TYR 34 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1psf h PRO 35 N 4.89 0.00 -5.75 -0.72 0.13 -1.65 -3.34 132.00 125.57 1psf h PRO 35 Ca 0.18 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.68 1psf h PRO 35 Cb 0.77 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 31.78 1psf h PRO 35 CO 0.66 0.00 0.34 0.08 -0.23 0.00 0.00 178.00 178.85 1psf s VAL 36 N -3.15 4.72 -0.27 1.56 1.01 -0.88 -2.40 120.40 120.99 1psf s VAL 36 Ca 0.08 0.66 -0.13 0.00 0.00 0.00 0.00 61.98 62.59 1psf s VAL 36 Cb 0.12 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 1psf s VAL 36 CO 0.66 -0.54 0.27 -0.51 0.00 0.00 0.00 175.10 174.98 1psf s ILE 37 N 3.13 5.25 0.35 2.22 1.10 -1.03 -0.67 121.20 131.55 1psf s ILE 37 Ca 0.30 0.36 0.04 0.00 -0.51 0.00 0.00 60.65 60.84 1psf s ILE 37 Cb -0.13 -3.61 -0.01 0.00 0.15 0.00 0.00 42.46 38.86 1psf s ILE 37 CO 0.19 0.22 0.51 -0.69 -2.11 0.00 0.00 174.94 173.05 1psf s VAL 38 N 1.83 4.35 -0.10 4.00 1.01 -0.96 -2.30 120.40 128.23 1psf s VAL 38 Ca 0.11 -0.83 -0.02 0.00 0.00 0.00 0.00 61.98 61.24 1psf s VAL 38 Cb -0.16 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1psf s VAL 38 CO 0.10 -0.26 -0.02 -0.13 0.00 0.00 0.00 175.10 174.79 1psf s ARG 39 N -4.24 3.16 0.00 2.72 0.52 -0.56 -2.89 118.95 117.65 1psf s ARG 39 Ca 0.43 -0.45 0.00 0.00 -0.52 0.00 0.00 55.73 55.19 1psf s ARG 39 Cb -0.10 -2.81 0.00 0.00 0.52 0.00 0.00 34.95 32.56 1psf s ARG 39 CO 0.33 0.56 0.04 1.19 0.02 0.00 0.00 175.30 177.44 1psf n PHE 40 N 2.56 0.00 -1.78 -0.53 3.01 -1.22 -2.08 117.46 117.42 1psf n PHE 40 Ca -0.18 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.09 1psf n PHE 40 Cb 0.53 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.94 1psf n PHE 40 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1psf n ASN 41 N -0.49 -5.07 -4.26 4.37 3.02 -1.26 -4.95 115.26 106.62 1psf n ASN 41 Ca 0.00 0.35 -0.30 0.00 -0.03 0.00 0.00 54.58 54.59 1psf n ASN 41 Cb 0.01 -4.44 -0.16 0.00 -0.61 0.00 0.00 39.78 34.58 1psf n ASN 41 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1psf s LYS 42 N -3.98 2.32 0.07 3.52 2.47 -1.26 -5.07 119.74 117.80 1psf s LYS 42 Ca 0.00 -0.87 0.05 0.00 -1.56 0.00 0.00 55.97 53.59 1psf s LYS 42 Cb 0.00 -2.03 -0.04 0.00 -1.46 0.00 0.00 37.83 34.30 1psf s LYS 42 CO 0.00 0.41 -0.02 0.08 0.16 0.00 0.00 175.35 175.98 1psf s VAL 43 N -0.26 3.89 -0.53 4.02 1.01 -1.26 -3.63 120.40 123.64 1psf s VAL 43 Ca 0.00 -0.96 0.07 0.00 0.00 0.00 0.00 61.98 61.09 1psf s VAL 43 Cb -0.12 -2.82 0.26 0.00 0.00 0.00 0.00 36.38 33.70 1psf s VAL 43 CO 0.02 0.18 0.69 -3.20 0.00 0.00 0.00 175.10 172.79 1psf n ASN 44 N 0.79 2.41 -4.64 3.32 2.85 -1.26 -5.04 115.26 113.69 1psf n ASN 44 Ca -0.12 -3.18 -0.43 0.00 -0.11 0.00 0.00 54.58 50.74 1psf n ASN 44 Cb 0.52 -0.65 -0.03 0.00 1.24 0.00 0.00 39.78 40.87 1psf n ASN 44 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 1psf s TYR 45 N -2.12 1.63 -0.04 1.20 2.02 -1.26 -4.81 117.35 113.97 1psf s TYR 45 Ca 0.39 0.20 0.25 0.00 -0.37 0.00 0.00 57.07 57.54 1psf s TYR 45 Cb 0.18 -4.04 0.44 0.00 -0.40 0.00 0.00 41.96 38.14 1psf s TYR 45 CO -0.06 -4.09 1.17 -1.71 -1.57 0.00 0.00 175.55 169.28 1psf n ASN 46 N 8.74 1.11 0.00 2.29 5.15 -1.26 -4.95 115.26 126.34 1psf n ASN 46 Ca 0.21 -2.10 0.00 0.00 -0.60 0.00 0.00 54.58 52.09 1psf n ASN 46 Cb 0.44 -0.33 0.00 0.00 -0.53 0.00 0.00 39.78 39.36 1psf n ASN 46 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1psf n GLY 47 N 0.31 -0.76 3.69 8.20 0.00 -1.26 -5.17 105.19 110.20 1psf n GLY 47 Ca 0.07 0.13 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 1psf n GLY 47 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1psf s PHE 48 N 0.00 2.99 -0.30 1.61 -0.12 -1.26 -5.04 117.98 115.86 1psf s PHE 48 Ca 0.00 -0.03 -0.17 0.00 -0.05 0.00 0.00 56.93 56.68 1psf s PHE 48 Cb 0.00 -1.53 0.19 0.00 -0.63 0.00 0.00 43.02 41.05 1psf s PHE 48 CO 0.00 0.49 1.20 -1.12 -0.05 0.00 0.00 175.22 175.74 1psf s SER 49 N -2.38 -0.18 0.00 1.98 0.01 -1.26 -5.06 113.70 106.80 1psf s SER 49 Ca 0.26 0.27 0.00 0.00 1.31 0.00 0.00 55.95 57.79 1psf s SER 49 Cb -0.11 1.14 0.00 0.00 0.21 0.00 0.00 66.02 67.26 1psf s SER 49 CO 0.19 -0.04 0.00 0.61 0.41 0.00 0.00 173.24 174.41 1psf n GLY 50 N 3.90 1.90 3.71 3.44 0.00 -1.26 -4.84 105.19 112.03 1psf n GLY 50 Ca -0.13 -0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 1psf n GLY 50 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1psf s SER 51 N -4.00 7.19 -0.52 1.61 0.01 -1.26 -4.94 113.70 111.79 1psf s SER 51 Ca 0.00 1.84 -0.27 0.00 1.31 0.00 0.00 55.95 58.83 1psf s SER 51 Cb 0.00 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.63 1psf s SER 51 CO 0.00 -0.40 1.94 0.00 0.41 0.00 0.00 173.24 175.19 1psf s ALA 52 N 1.21 2.25 0.00 1.44 0.00 -1.26 -4.91 121.76 120.49 1psf s ALA 52 Ca 0.55 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.19 1psf s ALA 52 Cb -0.25 -4.24 0.00 0.00 0.00 0.00 0.00 23.12 18.62 1psf s ALA 52 CO 0.27 -3.69 0.00 0.41 0.00 0.00 0.00 175.76 172.75 1psf n GLY 53 N 5.69 -0.90 0.59 0.00 0.00 -1.26 -5.04 105.19 104.26 1psf n GLY 53 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1psf n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1psf n GLY 54 N 1.14 -3.55 0.30 -0.02 0.00 -1.26 -5.05 105.19 96.74 1psf n GLY 54 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.01 1psf n GLY 54 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1psf n LEU 55 N -1.09 0.00 -0.12 0.99 4.32 -1.26 -4.98 117.00 114.85 1psf n LEU 55 Ca 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 56.01 55.97 1psf n LEU 55 Cb 0.02 -0.04 -0.01 0.00 -1.62 0.00 0.00 43.42 41.78 1psf n LEU 55 CO 0.00 -0.19 -0.01 0.59 -1.22 0.00 0.00 177.39 176.56 1psf n ASN 56 N -1.63 -4.93 -3.67 -1.43 3.02 -1.24 -4.94 115.26 100.44 1psf n ASN 56 Ca 0.00 0.04 -0.09 0.00 -0.03 0.00 0.00 54.58 54.50 1psf n ASN 56 Cb 0.00 -2.57 -0.09 0.00 -0.61 0.00 0.00 39.78 36.51 1psf n ASN 56 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1psf s THR 57 N -1.48 -0.01 -0.07 3.41 -4.23 -1.26 -3.45 115.64 108.55 1psf s THR 57 Ca 0.00 0.05 0.04 0.00 -1.18 0.00 0.00 61.69 60.61 1psf s THR 57 Cb 0.00 -0.78 -0.01 0.00 1.34 0.00 0.00 72.50 73.04 1psf s THR 57 CO 0.00 0.02 -0.21 0.20 -0.54 0.00 0.00 174.62 174.10 1psf s ASN 58 N 1.49 3.45 0.48 3.99 -0.87 -1.14 -4.90 114.94 117.43 1psf s ASN 58 Ca -0.10 -0.41 -0.22 0.00 -1.57 0.00 0.00 52.86 50.57 1psf s ASN 58 Cb -0.07 -0.97 -0.08 0.00 -0.02 0.00 0.00 41.25 40.12 1psf s ASN 58 CO -0.16 0.26 1.11 0.20 -2.57 0.00 0.00 177.10 175.93 1psf s ASN 59 N -0.21 6.20 -0.17 -1.22 -0.87 -1.26 -2.27 114.94 115.14 1psf s ASN 59 Ca -0.01 2.14 -0.25 0.00 -1.57 0.00 0.00 52.86 53.17 1psf s ASN 59 Cb -0.13 -2.58 0.06 0.00 -0.02 0.00 0.00 41.25 38.57 1psf s ASN 59 CO 0.03 -0.89 0.63 -0.36 -2.57 0.00 0.00 177.10 173.95 1psf s PHE 60 N -1.72 -0.66 0.72 2.20 0.08 0.16 -4.95 117.98 113.81 1psf s PHE 60 Ca 0.66 1.44 -0.11 0.00 0.12 0.00 0.00 56.93 59.03 1psf s PHE 60 Cb -0.23 0.28 0.02 0.00 -0.57 0.00 0.00 43.02 42.52 1psf s PHE 60 CO 0.28 -0.43 1.10 0.00 -0.10 0.00 0.00 175.22 176.07 1psf s ALA 61 N -0.25 2.78 0.10 5.36 0.00 -1.25 -2.08 121.76 126.42 1psf s ALA 61 Ca -0.04 -0.32 -0.21 0.00 0.00 0.00 0.00 51.96 51.39 1psf s ALA 61 Cb -0.03 -3.04 -0.10 0.00 0.00 0.00 0.00 23.12 19.95 1psf s ALA 61 CO 0.04 -1.24 1.70 0.93 0.00 0.00 0.00 175.76 177.19 1psf h GLU 62 N -0.73 0.22 0.00 0.00 5.08 -1.93 -1.80 114.58 115.41 1psf h GLU 62 Ca -0.45 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1psf h GLU 62 Cb 1.26 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1psf h GLU 62 CO 0.63 0.22 0.00 1.12 -1.00 0.00 0.00 179.01 179.98 1psf h HIS 63 N 0.15 0.00 0.00 4.33 2.07 -1.96 -2.49 115.15 117.25 1psf h HIS 63 Ca 0.05 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.57 1psf h HIS 63 Cb 0.07 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.04 1psf h HIS 63 CO -0.04 0.00 -0.04 0.93 -3.07 0.00 0.00 177.93 175.71 1psf h GLU 64 N 0.00 0.00 -5.91 5.12 5.08 -1.69 -3.45 114.58 113.73 1psf h GLU 64 Ca 0.00 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.73 1psf h GLU 64 Cb 0.39 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.59 1psf h GLU 64 CO 0.00 0.04 -0.51 -0.51 -1.00 0.00 0.00 179.01 177.03 1psf s LEU 65 N -6.23 4.28 -0.46 1.33 1.43 -0.94 -1.98 118.68 116.10 1psf s LEU 65 Ca 0.07 0.26 0.03 0.00 -1.03 0.00 0.00 54.13 53.46 1psf s LEU 65 Cb 0.05 -2.75 0.12 0.00 0.03 0.00 0.00 46.19 43.65 1psf s LEU 65 CO 0.67 0.21 0.20 -0.70 0.23 0.00 0.00 176.35 176.96 1psf s GLU 66 N -2.25 1.87 -0.33 1.70 2.12 -0.93 -4.94 118.70 115.94 1psf s GLU 66 Ca 0.31 -2.31 -0.28 0.00 0.36 0.00 0.00 54.97 53.04 1psf s GLU 66 Cb -0.13 -3.34 -0.07 0.00 0.26 0.00 0.00 34.13 30.86 1psf s GLU 66 CO 0.23 -1.06 2.29 0.28 -0.54 0.00 0.00 175.26 176.47 1psf n VAL 67 N 3.62 0.19 -1.44 3.70 0.31 -1.26 -2.22 118.33 121.23 1psf n VAL 67 Ca 0.04 -0.53 -0.11 0.00 -0.01 0.00 0.00 64.34 63.74 1psf n VAL 67 Cb 0.37 -2.49 0.18 0.00 -0.91 0.00 0.00 33.84 30.99 1psf n VAL 67 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1psf n VAL 68 N 7.77 2.73 1.87 2.52 0.24 -0.94 -4.98 118.33 127.54 1psf n VAL 68 Ca 0.34 -2.68 0.15 0.00 -2.04 0.00 0.00 64.34 60.12 1psf n VAL 68 Cb 0.44 -0.42 0.84 0.00 -1.47 0.00 0.00 33.84 33.23 1psf n VAL 68 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30