#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rod n ALA 2 N 0.00 -0.19 -1.41 -0.43 0.00 -1.26 -4.89 120.51 112.33 1rod n ALA 2 Ca 0.00 -0.94 -0.54 0.00 0.00 0.00 0.00 53.44 51.96 1rod n ALA 2 Cb 0.00 0.09 -0.08 0.00 0.00 0.00 0.00 19.45 19.46 1rod n ALA 2 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1rod n LYS 3 N -2.08 0.80 -0.29 0.00 4.76 -1.26 -4.77 118.16 115.32 1rod n LYS 3 Ca 0.08 0.22 0.10 0.00 -2.87 0.00 0.00 58.31 55.85 1rod n LYS 3 Cb 0.29 -2.18 0.25 0.00 -1.84 0.00 0.00 35.03 31.55 1rod n LYS 3 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1rod h GLU 4 N 11.07 0.17 -6.22 1.97 5.08 -2.07 -3.40 114.58 121.18 1rod h GLU 4 Ca -0.24 -0.01 -0.69 0.00 -1.00 0.00 0.00 59.36 57.42 1rod h GLU 4 Cb 1.35 -0.04 0.02 0.00 0.50 0.00 0.00 28.75 30.58 1rod h GLU 4 CO 1.03 0.11 0.89 1.28 -1.00 0.00 0.00 179.01 181.32 1rod n LEU 5 N -5.27 2.62 0.00 1.33 4.77 -1.26 -4.93 117.00 114.26 1rod n LEU 5 Ca 0.19 1.05 0.00 0.00 -0.03 0.00 0.00 56.01 57.22 1rod n LEU 5 Cb 0.62 -1.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.48 1rod n LEU 5 CO 0.05 -0.40 0.00 0.54 -1.33 0.00 0.00 177.39 176.25 1rod n ARG 6 N 5.19 0.00 0.00 3.23 3.00 -1.26 -5.01 116.66 121.80 1rod n ARG 6 Ca 0.24 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 58.08 1rod n ARG 6 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.65 1rod n ARG 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1rod n GLN 8 N 0.00 0.00 -4.58 0.00 0.00 -1.26 -5.07 117.38 106.47 1rod n GLN 8 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 57.00 56.69 1rod n GLN 8 Cb 0.00 -0.23 -0.06 0.00 0.00 0.00 0.00 30.24 29.95 1rod n GLN 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1rod n ILE 10 N -1.22 0.03 -3.57 0.00 5.41 -1.26 -4.84 119.36 113.92 1rod n ILE 10 Ca -0.20 0.01 0.00 0.00 1.00 0.00 0.00 62.75 63.56 1rod n ILE 10 Cb 0.62 -0.63 0.00 0.00 -0.71 0.00 0.00 39.64 38.92 1rod n ILE 10 CO 0.00 0.00 0.00 2.29 0.00 0.00 0.00 176.55 178.84 1rod n LYS 11 N -2.76 2.79 -0.45 0.38 2.85 -1.26 -4.59 118.16 115.12 1rod n LYS 11 Ca 0.00 0.00 -0.28 0.00 -1.05 0.00 0.00 58.31 56.98 1rod n LYS 11 Cb 0.05 0.00 0.27 0.00 -0.65 0.00 0.00 35.03 34.70 1rod n LYS 11 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1rod s THR 12 N -0.15 2.00 0.00 0.58 -4.23 -1.25 -3.18 115.64 109.40 1rod s THR 12 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 1rod s THR 12 Cb 0.00 -2.00 0.00 0.00 1.34 0.00 0.00 72.50 71.84 1rod s THR 12 CO 0.00 -0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.08 1rod n TYR 13 N -5.08 0.00 1.13 3.99 4.11 -0.78 -4.77 117.16 115.75 1rod n TYR 13 Ca 0.02 0.00 0.12 0.00 -0.00 0.00 0.00 57.90 58.04 1rod n TYR 13 Cb 0.54 0.00 0.23 0.00 -0.00 0.00 0.00 39.34 40.11 1rod n TYR 13 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.86 177.29 1rod n SER 14 N 0.00 1.22 -3.42 9.48 7.64 -1.26 -4.72 113.62 122.56 1rod n SER 14 Ca 0.00 -0.98 -0.24 0.00 1.01 0.00 0.00 58.87 58.66 1rod n SER 14 Cb 0.00 0.30 -0.10 0.00 -1.01 0.00 0.00 64.21 63.40 1rod n SER 14 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1rod s LYS 15 N -2.60 0.56 0.74 1.43 1.02 -1.26 -5.13 119.74 114.51 1rod s LYS 15 Ca 0.20 -1.07 -0.15 0.00 0.02 0.00 0.00 55.97 54.97 1rod s LYS 15 Cb 0.18 -1.05 0.01 0.00 -0.52 0.00 0.00 37.83 36.46 1rod s LYS 15 CO 0.58 -1.19 0.91 -0.35 -0.92 0.00 0.00 175.35 174.38 1rod n PRO 16 N 4.22 0.39 -3.68 -1.68 -0.04 -1.26 -5.00 135.00 127.95 1rod n PRO 16 Ca 0.10 0.19 -0.05 0.00 -0.04 0.00 0.00 63.50 63.70 1rod n PRO 16 Cb 0.41 -2.17 0.02 0.00 -0.04 0.00 0.00 33.50 31.72 1rod n PRO 16 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1rod n PHE 17 N -2.65 -1.70 -2.46 0.54 -1.74 -1.26 -5.10 117.46 103.09 1rod n PHE 17 Ca 0.12 -1.42 -0.43 0.00 -0.56 0.00 0.00 57.45 55.17 1rod n PHE 17 Cb 0.50 0.70 -0.02 0.00 1.52 0.00 0.00 39.48 42.17 1rod n PHE 17 CO 0.00 0.00 0.00 -1.01 -0.56 0.00 0.00 176.76 175.19 1rod s HIS 18 N -2.42 3.10 -1.67 2.97 3.76 -1.26 -4.84 115.29 114.92 1rod s HIS 18 Ca 0.19 1.17 0.14 0.00 -0.15 0.00 0.00 55.06 56.41 1rod s HIS 18 Cb -0.03 -3.44 0.77 0.00 1.11 0.00 0.00 32.58 30.99 1rod s HIS 18 CO 0.08 -1.38 1.33 -0.35 -0.85 0.00 0.00 174.74 173.57 1rod n PRO 19 N 5.67 0.31 -0.36 8.40 -0.04 -1.26 -3.11 135.00 144.60 1rod n PRO 19 Ca 0.12 0.09 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 1rod n PRO 19 Cb 0.46 -1.50 0.15 0.00 -0.04 0.00 0.00 33.50 32.57 1rod n PRO 19 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1rod h LYS 20 N 0.00 1.22 -0.58 0.54 1.57 -2.03 -1.20 116.57 116.09 1rod h LYS 20 Ca 0.00 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1rod h LYS 20 Cb 0.07 -0.28 0.00 0.00 0.08 0.00 0.00 32.23 32.11 1rod h LYS 20 CO 0.00 0.81 0.00 1.97 -0.57 0.00 0.00 179.45 181.66 1rod n PHE 21 N -4.43 0.01 -2.72 -1.35 -1.74 -1.18 -4.82 117.46 101.23 1rod n PHE 21 Ca 0.13 -0.00 -0.42 0.00 -0.56 0.00 0.00 57.45 56.59 1rod n PHE 21 Cb 0.09 -0.06 -0.03 0.00 1.52 0.00 0.00 39.48 41.00 1rod n PHE 21 CO 0.00 0.00 0.00 0.96 -0.56 0.00 0.00 176.76 177.16 1rod s ILE 22 N -1.43 4.81 0.12 1.97 -4.36 -0.46 -1.68 121.20 120.18 1rod s ILE 22 Ca 0.00 2.00 0.02 0.00 -0.26 0.00 0.00 60.65 62.41 1rod s ILE 22 Cb 0.00 -4.29 -0.21 0.00 1.25 0.00 0.00 42.46 39.20 1rod s ILE 22 CO 0.00 0.03 1.27 0.50 0.24 0.00 0.00 174.94 176.98 1rod h LYS 23 N 7.07 0.13 -3.28 0.37 3.64 -1.15 -3.43 116.57 119.92 1rod h LYS 23 Ca -0.32 -0.20 -0.47 0.00 -1.27 0.00 0.00 60.65 58.39 1rod h LYS 23 Cb 1.16 0.07 -0.40 0.00 -0.41 0.00 0.00 32.23 32.64 1rod h LYS 23 CO 0.84 1.05 -0.75 -1.21 -2.27 0.00 0.00 179.45 177.10 1rod s GLU 24 N -2.83 0.28 -0.61 1.90 8.01 -1.11 -4.96 118.70 119.38 1rod s GLU 24 Ca -0.02 -0.15 -0.22 0.00 0.01 0.00 0.00 54.97 54.59 1rod s GLU 24 Cb 0.09 -1.76 0.06 0.00 -4.31 0.00 0.00 34.13 28.21 1rod s GLU 24 CO 0.84 -0.61 0.91 -1.17 0.01 0.00 0.00 175.26 175.24 1rod s LEU 25 N 2.04 4.42 -0.18 1.80 1.98 -1.26 0.32 118.68 127.79 1rod s LEU 25 Ca 0.01 -0.84 -0.11 0.00 -2.89 0.00 0.00 54.13 50.31 1rod s LEU 25 Cb -0.16 -2.52 -0.05 0.00 0.66 0.00 0.00 46.19 44.12 1rod s LEU 25 CO -0.08 -1.31 0.17 -0.60 -1.89 0.00 0.00 176.35 172.64 1rod s ARG 26 N 3.81 4.14 -0.42 1.98 3.52 -0.16 -4.82 118.95 127.01 1rod s ARG 26 Ca 0.23 -0.13 -0.09 0.00 -0.13 0.00 0.00 55.73 55.61 1rod s ARG 26 Cb -0.16 -3.40 0.08 0.00 -1.56 0.00 0.00 34.95 29.90 1rod s ARG 26 CO 0.13 0.33 0.26 0.08 -0.81 0.00 0.00 175.30 175.28 1rod s VAL 27 N 0.25 4.24 -1.13 7.11 1.01 -1.26 0.29 120.40 130.91 1rod s VAL 27 Ca 0.11 -1.39 -0.21 0.00 0.00 0.00 0.00 61.98 60.48 1rod s VAL 27 Cb -0.12 -3.59 0.01 0.00 0.00 0.00 0.00 36.38 32.69 1rod s VAL 27 CO 0.00 -0.50 1.73 0.27 0.00 0.00 0.00 175.10 176.60 1rod s ILE 28 N 1.43 3.83 -0.28 2.22 -4.36 -0.54 -4.83 121.20 118.67 1rod s ILE 28 Ca 0.03 -1.12 -0.28 0.00 -0.26 0.00 0.00 60.65 59.02 1rod s ILE 28 Cb -0.23 -4.83 0.01 0.00 1.25 0.00 0.00 42.46 38.66 1rod s ILE 28 CO 0.02 -1.61 0.99 -0.70 0.24 0.00 0.00 174.94 173.88 1rod s GLU 29 N 5.37 4.12 1.01 0.37 2.12 -1.26 0.23 118.70 130.66 1rod s GLU 29 Ca 0.57 1.06 -0.24 0.00 0.36 0.00 0.00 54.97 56.72 1rod s GLU 29 Cb 0.00 -3.69 -0.17 0.00 0.26 0.00 0.00 34.13 30.53 1rod s GLU 29 CO 0.02 -0.73 -1.24 -1.13 -0.54 0.00 0.00 175.26 171.64 1rod n SER 30 N 6.48 -3.77 0.00 -1.70 3.41 0.34 -4.72 113.62 113.67 1rod n SER 30 Ca 0.10 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 1rod n SER 30 Cb 0.47 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 1rod n SER 30 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rod n GLY 31 N 3.38 1.99 0.04 5.00 0.00 -1.26 -4.92 105.19 109.42 1rod n GLY 31 Ca -0.02 -0.23 0.09 0.00 0.00 0.00 0.00 46.02 45.86 1rod n GLY 31 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rod n PRO 32 N 0.00 0.06 0.00 1.61 -0.04 -1.26 -4.88 135.00 130.50 1rod n PRO 32 Ca 0.00 0.27 0.00 0.00 -0.04 0.00 0.00 63.50 63.73 1rod n PRO 32 Cb 0.00 -1.61 0.00 0.00 -0.04 0.00 0.00 33.50 31.85 1rod n PRO 32 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1rod n HIS 33 N -1.73 0.00 -1.14 0.54 8.25 -1.26 -5.03 115.22 114.85 1rod n HIS 33 Ca 0.04 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.44 1rod n HIS 33 Cb 0.21 0.00 0.26 0.00 1.12 0.00 0.00 29.99 31.58 1rod n HIS 33 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1rod h ALA 35 N 2.00 1.26 -4.20 0.00 0.00 -1.96 -3.41 119.26 112.95 1rod h ALA 35 Ca 0.27 -0.01 -0.64 0.00 0.00 0.00 0.00 54.91 54.52 1rod h ALA 35 Cb 2.16 -0.26 -0.26 0.00 0.00 0.00 0.00 17.79 19.43 1rod h ALA 35 CO 0.65 0.34 -0.86 -0.80 0.00 0.00 0.00 179.25 178.58 1rod s ASN 36 N -5.82 2.84 0.00 0.00 0.01 -1.26 -4.38 114.94 106.33 1rod s ASN 36 Ca -0.13 -0.55 0.00 0.00 -0.71 0.00 0.00 52.86 51.47 1rod s ASN 36 Cb 0.19 -0.25 0.00 0.00 0.41 0.00 0.00 41.25 41.60 1rod s ASN 36 CO 0.80 0.22 0.00 1.07 -1.51 0.00 0.00 177.10 177.68 1rod n THR 37 N 1.83 0.00 -4.48 1.60 5.66 0.64 0.13 114.28 119.66 1rod n THR 37 Ca -0.17 0.00 -0.23 0.00 -3.05 0.00 0.00 64.05 60.60 1rod n THR 37 Cb 0.53 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.20 1rod n THR 37 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 1rod s GLU 38 N 0.00 1.71 -0.83 1.09 2.56 -0.84 -4.75 118.70 117.64 1rod s GLU 38 Ca 0.00 -1.94 -0.20 0.00 0.00 0.00 0.00 54.97 52.83 1rod s GLU 38 Cb 0.00 -1.07 0.11 0.00 2.00 0.00 0.00 34.13 35.18 1rod s GLU 38 CO 0.00 -0.13 1.05 0.42 -0.56 0.00 0.00 175.26 176.04 1rod s ILE 39 N -3.14 4.62 0.93 -3.70 1.01 -0.22 -1.46 121.20 119.24 1rod s ILE 39 Ca 0.35 -1.18 -0.14 0.00 0.00 0.00 0.00 60.65 59.68 1rod s ILE 39 Cb 0.08 -4.73 0.16 0.00 0.01 0.00 0.00 42.46 37.98 1rod s ILE 39 CO 0.16 -1.47 1.20 -0.63 0.00 0.00 0.00 174.94 174.20 1rod s ILE 40 N 3.09 1.96 0.34 2.92 -1.09 0.85 0.21 121.20 129.47 1rod s ILE 40 Ca 0.28 0.00 -0.17 0.00 -2.23 0.00 0.00 60.65 58.53 1rod s ILE 40 Cb -0.10 -2.86 0.06 0.00 -1.58 0.00 0.00 42.46 37.97 1rod s ILE 40 CO -0.03 0.00 0.83 0.54 -1.23 0.00 0.00 174.94 175.05 1rod s VAL 41 N -3.52 0.00 -0.43 2.92 0.11 0.24 -0.99 120.40 118.73 1rod s VAL 41 Ca 0.67 -0.93 0.03 0.00 -2.93 0.00 0.00 61.98 58.82 1rod s VAL 41 Cb -0.10 -2.81 0.15 0.00 -1.53 0.00 0.00 36.38 32.10 1rod s VAL 41 CO 0.52 0.00 0.30 -0.54 -3.33 0.00 0.00 175.10 172.05 1rod s LYS 42 N -2.41 1.05 0.04 1.54 1.02 0.94 -1.63 119.74 120.29 1rod s LYS 42 Ca 0.16 -1.99 -0.36 0.00 0.02 0.00 0.00 55.97 53.80 1rod s LYS 42 Cb -0.05 -1.80 -0.15 0.00 -0.52 0.00 0.00 37.83 35.31 1rod s LYS 42 CO 0.10 -1.28 1.53 1.28 -0.92 0.00 0.00 175.35 176.06 1rod n LEU 43 N 3.25 2.40 0.00 3.17 4.32 -1.11 -0.64 117.00 128.39 1rod n LEU 43 Ca 0.19 1.09 0.05 0.00 -0.02 0.00 0.00 56.01 57.31 1rod n LEU 43 Cb 0.40 -1.28 0.23 0.00 -1.62 0.00 0.00 43.42 41.16 1rod n LEU 43 CO 0.15 -0.61 0.60 -0.24 -1.22 0.00 0.00 177.39 176.07 1rod n SER 44 N 3.65 0.00 -1.18 -1.43 2.88 -0.68 -1.05 113.62 115.82 1rod n SER 44 Ca 0.20 0.20 0.11 0.00 -1.33 0.00 0.00 58.87 58.04 1rod n SER 44 Cb 0.22 -0.32 0.28 0.00 -0.75 0.00 0.00 64.21 63.65 1rod n SER 44 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1rod n ASP 45 N -1.32 3.44 0.00 -3.46 8.00 -1.26 -4.88 116.55 117.07 1rod n ASP 45 Ca 0.04 -1.99 0.00 0.00 0.71 0.00 0.00 54.79 53.55 1rod n ASP 45 Cb 0.08 -0.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.79 1rod n ASP 45 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rod n GLY 46 N 1.53 0.94 2.73 0.44 0.00 -0.21 -5.00 105.19 105.61 1rod n GLY 46 Ca 0.21 -0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 1rod n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rod n ARG 47 N -2.10 3.26 -2.33 1.61 1.74 -1.07 -4.92 116.66 112.86 1rod n ARG 47 Ca 0.00 -4.07 -0.43 0.00 -0.77 0.00 0.00 57.85 52.58 1rod n ARG 47 Cb 0.00 -2.28 -0.02 0.00 -1.02 0.00 0.00 32.46 29.14 1rod n ARG 47 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 1rod s GLU 48 N -3.86 4.07 0.00 5.56 -1.05 -1.26 -2.75 118.70 119.41 1rod s GLU 48 Ca 0.49 1.61 0.00 0.00 -0.15 0.00 0.00 54.97 56.93 1rod s GLU 48 Cb 0.39 -3.86 0.00 0.00 -0.44 0.00 0.00 34.13 30.22 1rod s GLU 48 CO -0.29 -0.92 0.00 -0.11 0.95 0.00 0.00 175.26 174.88 1rod n LEU 49 N 7.22 0.00 -4.86 1.83 7.94 -0.65 -4.87 117.00 123.62 1rod n LEU 49 Ca 0.15 0.00 -0.30 0.00 -1.11 0.00 0.00 56.01 54.76 1rod n LEU 49 Cb 0.45 0.00 0.07 0.00 0.53 0.00 0.00 43.42 44.47 1rod n LEU 49 CO 0.60 0.00 0.75 0.00 -1.11 0.00 0.00 177.39 177.63 1rod s LEU 51 N -5.55 -0.48 -0.45 0.00 2.96 0.56 -1.87 118.68 113.84 1rod s LEU 51 Ca 0.60 -0.14 0.06 0.00 -0.22 0.00 0.00 54.13 54.44 1rod s LEU 51 Cb -0.12 2.57 0.32 0.00 0.50 0.00 0.00 46.19 49.47 1rod s LEU 51 CO 0.52 -1.02 1.12 -0.90 -1.32 0.00 0.00 176.35 174.75 1rod n ASP 52 N -0.39 -2.24 -3.14 3.68 5.75 -1.24 -1.05 116.55 117.93 1rod n ASP 52 Ca -0.13 -3.63 0.00 0.00 -0.01 0.00 0.00 54.79 51.02 1rod n ASP 52 Cb 0.63 1.82 0.00 0.00 -1.03 0.00 0.00 41.12 42.55 1rod n ASP 52 CO 0.00 0.00 0.00 -0.81 -0.11 0.00 0.00 177.20 176.28 1rod n PRO 53 N 0.31 1.25 -0.63 0.11 -0.04 -1.26 -4.90 135.00 129.83 1rod n PRO 53 Ca 0.06 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.33 1rod n PRO 53 Cb 0.71 0.00 0.11 0.00 -0.04 0.00 0.00 33.50 34.28 1rod n PRO 53 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rod n ALA 54 N -3.00 -0.82 -2.22 0.55 0.00 -1.26 -4.63 120.51 109.13 1rod n ALA 54 Ca 0.00 -0.94 -0.03 0.00 0.00 0.00 0.00 53.44 52.47 1rod n ALA 54 Cb 0.00 -0.80 -0.03 0.00 0.00 0.00 0.00 19.45 18.62 1rod n ALA 54 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1rod n SER 55 N -0.09 -1.83 -0.33 0.00 2.88 -1.26 -4.81 113.62 108.19 1rod n SER 55 Ca 0.03 0.89 0.00 0.00 -1.33 0.00 0.00 58.87 58.46 1rod n SER 55 Cb 0.38 -3.79 0.00 0.00 -0.75 0.00 0.00 64.21 60.05 1rod n SER 55 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1rod n PRO 56 N 0.98 0.89 -0.15 -1.46 -0.04 -1.26 -4.30 135.00 129.66 1rod n PRO 56 Ca -0.23 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.15 1rod n PRO 56 Cb 0.35 -1.29 -0.03 0.00 -0.04 0.00 0.00 33.50 32.49 1rod n PRO 56 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1rod h ILE 57 N 0.00 0.13 0.00 0.52 1.08 -1.94 0.55 117.51 117.85 1rod h ILE 57 Ca 0.00 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.42 1rod h ILE 57 Cb 0.29 0.13 -0.01 0.00 -3.07 0.00 0.00 36.82 34.17 1rod h ILE 57 CO 0.00 0.00 -0.22 1.62 -0.69 0.00 0.00 178.15 178.86 1rod h VAL 58 N -0.28 1.04 0.00 1.67 3.04 -1.91 0.11 116.25 119.91 1rod h VAL 58 Ca 0.16 -0.78 -0.05 0.00 -1.01 0.00 0.00 66.70 65.02 1rod h VAL 58 Cb 0.57 1.43 -0.01 0.00 -2.01 0.00 0.00 31.29 31.28 1rod h VAL 58 CO -0.60 0.21 -0.22 0.11 -1.01 0.00 0.00 177.57 176.06 1rod h LYS 59 N 0.00 0.00 0.00 4.17 1.57 -0.41 -2.33 116.57 119.57 1rod h LYS 59 Ca -0.00 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.63 1rod h LYS 59 Cb 0.42 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 1rod h LYS 59 CO 0.03 0.22 -0.72 0.87 -0.57 0.00 0.00 179.45 179.28 1rod h LYS 60 N 0.00 0.00 -0.04 3.15 1.57 0.22 0.36 116.57 121.82 1rod h LYS 60 Ca -0.00 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 1rod h LYS 60 Cb 0.79 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.09 1rod h LYS 60 CO 0.03 0.72 -0.68 0.82 -0.57 0.00 0.00 179.45 179.76 1rod h ILE 61 N 0.00 1.43 0.00 1.86 5.03 -0.88 -1.97 117.51 122.97 1rod h ILE 61 Ca -0.01 -2.18 -0.20 0.00 -0.12 0.00 0.00 64.86 62.34 1rod h ILE 61 Cb 1.43 2.15 -0.03 0.00 -3.03 0.00 0.00 36.82 37.34 1rod h ILE 61 CO 0.09 0.64 -1.02 0.40 -0.68 0.00 0.00 178.15 177.58 1rod h ILE 62 N 0.13 1.50 0.64 -0.67 1.08 -1.35 -3.28 117.51 115.57 1rod h ILE 62 Ca -0.02 -3.18 -0.03 0.00 -0.39 0.00 0.00 64.86 61.24 1rod h ILE 62 Cb 1.22 2.74 0.01 0.00 -3.07 0.00 0.00 36.82 37.71 1rod h ILE 62 CO 0.10 0.86 -0.31 -0.33 -0.69 0.00 0.00 178.15 177.78 1rod h GLU 63 N 0.00 -0.83 0.00 2.37 4.39 -0.66 -2.51 114.58 117.34 1rod h GLU 63 Ca -0.04 0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1rod h GLU 63 Cb 1.74 0.19 0.00 0.00 -0.10 0.00 0.00 28.75 30.58 1rod h GLU 63 CO 0.12 -0.51 0.00 0.87 -1.16 0.00 0.00 179.01 178.32 1rod h LYS 64 N -1.00 0.00 0.66 2.33 1.79 -1.48 -2.40 116.57 116.48 1rod h LYS 64 Ca -0.09 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.35 1rod h LYS 64 Cb 0.70 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.35 1rod h LYS 64 CO 0.14 0.00 -0.32 1.98 -1.08 0.00 0.00 179.45 180.18 1rod h MET 65 N 0.00 -0.86 -0.35 3.15 4.05 -1.50 -1.60 114.93 117.82 1rod h MET 65 Ca 0.00 0.06 0.01 0.00 -0.28 0.00 0.00 59.70 59.49 1rod h MET 65 Cb 0.02 0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 30.99 1rod h MET 65 CO 0.00 -0.57 0.21 -0.07 0.23 0.00 0.00 176.91 176.71 1rod h LEU 66 N -1.16 0.35 -0.20 3.39 -0.00 -1.49 -1.49 115.31 114.71 1rod h LEU 66 Ca -0.09 -0.00 0.06 0.00 -0.00 0.00 0.00 57.88 57.84 1rod h LEU 66 Cb 0.68 -0.08 -0.07 0.00 -0.00 0.00 0.00 40.66 41.20 1rod h LEU 66 CO 0.15 0.26 -0.26 0.78 -0.00 0.00 0.00 178.44 179.36 1rod h ASN 67 N 0.44 -0.84 0.68 -0.43 2.35 -1.47 0.47 115.58 116.78 1rod h ASN 67 Ca 0.13 0.14 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 1rod h ASN 67 Cb -0.02 0.38 0.00 0.00 0.05 0.00 0.00 38.32 38.73 1rod h ASN 67 CO -0.05 -0.30 0.00 -1.28 -1.65 0.00 0.00 177.43 174.15 1rod h SER 68 N -0.30 0.00 1.89 5.81 0.87 -1.11 -0.22 113.55 120.50 1rod h SER 68 Ca 0.12 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 1rod h SER 68 Cb 0.48 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 1rod h SER 68 CO -0.37 0.00 -0.09 -0.78 -0.53 0.00 0.00 176.83 175.06 1rod h ASP 69 N 0.00 0.00 -0.43 6.23 3.58 0.74 -3.31 116.42 123.23 1rod h ASP 69 Ca 0.00 -0.00 -0.28 0.00 0.42 0.00 0.00 57.03 57.17 1rod h ASP 69 Cb 0.34 0.00 -0.11 0.00 1.72 0.00 0.00 39.33 41.29 1rod h ASP 69 CO 0.00 0.00 0.06 0.29 -2.88 0.00 0.00 179.24 176.71 1rod n LYS 70 N -3.03 1.94 -0.34 0.28 5.02 0.12 -3.52 118.16 118.63 1rod n LYS 70 Ca 0.04 -1.38 0.00 0.00 -2.02 0.00 0.00 58.31 54.95 1rod n LYS 70 Cb 0.53 -1.82 0.00 0.00 -0.02 0.00 0.00 35.03 33.72 1rod n LYS 70 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1rod n SER 71 N 1.44 0.00 0.00 4.39 7.64 -1.25 -5.04 113.62 120.80 1rod n SER 71 Ca 0.36 -1.24 0.00 0.00 1.01 0.00 0.00 58.87 59.00 1rod n SER 71 Cb 0.68 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.83 1rod n SER 71 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83