#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rod s ALA 2 N 0.00 1.81 -0.34 -0.43 0.00 -1.26 -4.79 121.76 116.75 1rod s ALA 2 Ca 0.00 0.47 -0.41 0.00 0.00 0.00 0.00 51.96 52.03 1rod s ALA 2 Cb 0.00 -3.38 -0.16 0.00 0.00 0.00 0.00 23.12 19.58 1rod s ALA 2 CO 0.00 -2.33 1.82 1.63 0.00 0.00 0.00 175.76 176.88 1rod n LYS 3 N -3.89 0.89 -0.28 0.00 5.02 -1.26 -4.79 118.16 113.85 1rod n LYS 3 Ca 0.11 0.31 -0.03 0.00 -2.02 0.00 0.00 58.31 56.68 1rod n LYS 3 Cb 0.52 -2.02 0.03 0.00 -0.02 0.00 0.00 35.03 33.55 1rod n LYS 3 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1rod h GLU 4 N 7.72 -0.08 -6.08 1.97 4.39 -2.07 -3.38 114.58 117.05 1rod h GLU 4 Ca -0.41 0.01 -0.70 0.00 0.34 0.00 0.00 59.36 58.60 1rod h GLU 4 Cb 1.33 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 30.00 1rod h GLU 4 CO 0.98 -0.06 1.16 1.28 -1.16 0.00 0.00 179.01 181.22 1rod n LEU 5 N -5.46 2.27 0.00 1.33 4.77 -1.26 -4.92 117.00 113.73 1rod n LEU 5 Ca 0.07 0.77 0.00 0.00 -0.03 0.00 0.00 56.01 56.82 1rod n LEU 5 Cb 0.38 -1.19 0.00 0.00 -2.33 0.00 0.00 43.42 40.28 1rod n LEU 5 CO -0.05 -0.53 0.00 0.54 -1.33 0.00 0.00 177.39 176.01 1rod n ARG 6 N 6.81 0.00 -0.82 3.23 1.74 -1.26 -4.65 116.66 121.71 1rod n ARG 6 Ca 0.34 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 57.28 1rod n ARG 6 Cb 0.17 0.00 0.03 0.00 -1.02 0.00 0.00 32.46 31.64 1rod n ARG 6 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1rod n GLN 8 N 0.53 2.75 -0.16 0.00 -0.06 -1.26 -4.13 117.38 115.05 1rod n GLN 8 Ca 0.25 -3.50 0.00 0.00 -2.00 0.00 0.00 57.00 51.75 1rod n GLN 8 Cb 0.57 -2.27 0.00 0.00 -4.06 0.00 0.00 30.24 24.48 1rod n GLN 8 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1rod n ILE 10 N 0.00 0.11 -4.24 0.00 5.41 -1.26 -4.28 119.36 115.10 1rod n ILE 10 Ca 0.00 -0.09 -0.18 0.00 1.00 0.00 0.00 62.75 63.48 1rod n ILE 10 Cb 0.55 -0.02 -0.11 0.00 -0.71 0.00 0.00 39.64 39.34 1rod n ILE 10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 1rod s LYS 11 N -1.82 1.03 1.14 0.38 -2.85 -1.26 -4.09 119.74 112.27 1rod s LYS 11 Ca 0.04 -1.25 -0.18 0.00 -1.00 0.00 0.00 55.97 53.58 1rod s LYS 11 Cb 0.02 -0.90 0.29 0.00 -2.06 0.00 0.00 37.83 35.18 1rod s LYS 11 CO 0.03 0.17 0.64 0.25 0.10 0.00 0.00 175.35 176.54 1rod n THR 12 N 0.50 0.00 0.00 3.79 -2.24 -1.26 -3.35 114.28 111.72 1rod n THR 12 Ca -0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1rod n THR 12 Cb 0.57 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 68.07 1rod n THR 12 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rod n TYR 13 N -5.10 0.00 1.32 4.78 4.11 -1.02 -4.59 117.16 116.66 1rod n TYR 13 Ca 0.10 0.00 0.13 0.00 -0.00 0.00 0.00 57.90 58.14 1rod n TYR 13 Cb 0.45 0.00 0.47 0.00 -0.00 0.00 0.00 39.34 40.26 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 0.86 -3.92 9.48 7.64 -1.26 -4.89 113.62 121.53 1rod n SER 14 Ca 0.00 -0.82 -0.09 0.00 1.01 0.00 0.00 58.87 58.96 1rod n SER 14 Cb 0.00 0.05 -0.09 0.00 -1.01 0.00 0.00 64.21 63.16 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 -2.45 0.63 0.28 1.43 1.02 -1.26 -5.15 119.74 114.23 1rod s LYS 15 Ca 0.27 -0.78 -0.04 0.00 0.02 0.00 0.00 55.97 55.44 1rod s LYS 15 Cb 0.20 0.25 -0.05 0.00 -0.52 0.00 0.00 37.83 37.71 1rod s LYS 15 CO 0.49 -0.16 0.52 -1.25 -0.92 0.00 0.00 175.35 174.03 1rod s PRO 16 N -2.81 3.60 0.03 -1.68 0.04 -1.26 -4.89 135.00 128.03 1rod s PRO 16 Ca -0.03 -0.09 -0.29 0.00 0.04 0.00 0.00 61.00 60.63 1rod s PRO 16 Cb 0.00 -2.68 0.10 0.00 0.04 0.00 0.00 34.50 31.96 1rod s PRO 16 CO -0.05 0.24 1.15 -0.59 0.04 0.00 0.00 177.00 177.79 1rod s PHE 17 N -2.07 -0.09 -0.17 0.56 -0.71 -1.26 -5.09 117.98 109.15 1rod s PHE 17 Ca 0.42 -0.08 -0.29 0.00 -1.04 0.00 0.00 56.93 55.95 1rod s PHE 17 Cb -0.11 0.58 -0.01 0.00 -1.21 0.00 0.00 43.02 42.27 1rod s PHE 17 CO 0.30 -0.47 1.24 -1.01 -1.34 0.00 0.00 175.22 173.94 1rod s HIS 18 N -2.75 2.90 -1.64 3.49 3.76 -1.26 -4.82 115.29 114.96 1rod s HIS 18 Ca 0.13 1.05 0.14 0.00 -0.15 0.00 0.00 55.06 56.23 1rod s HIS 18 Cb 0.02 -3.48 0.77 0.00 1.11 0.00 0.00 32.58 31.00 1rod s HIS 18 CO -0.02 -1.59 1.34 -0.35 -0.85 0.00 0.00 174.74 173.28 1rod n PRO 19 N 6.55 0.30 -0.28 8.40 -0.04 -1.26 -3.03 135.00 145.64 1rod n PRO 19 Ca 0.14 0.10 -0.03 0.00 -0.04 0.00 0.00 63.50 63.66 1rod n PRO 19 Cb 0.45 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.49 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 0.95 -1.00 0.54 1.57 -2.04 -1.17 116.57 115.42 1rod h LYS 20 Ca 0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1rod h LYS 20 Cb 0.08 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.18 1rod h LYS 20 CO 0.00 0.63 0.00 1.97 -0.57 0.00 0.00 179.45 181.48 1rod n PHE 21 N -4.60 0.00 -2.66 -1.35 -1.74 -1.17 -4.85 117.46 101.09 1rod n PHE 21 Ca 0.08 -0.06 -0.41 0.00 -0.56 0.00 0.00 57.45 56.50 1rod n PHE 21 Cb 0.06 -0.12 -0.04 0.00 1.52 0.00 0.00 39.48 40.91 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 -0.89 4.44 -0.04 1.97 -4.36 -0.44 -0.69 121.20 121.19 1rod s ILE 22 Ca 0.00 1.93 0.01 0.00 -0.26 0.00 0.00 60.65 62.33 1rod s ILE 22 Cb 0.00 -4.24 -0.26 0.00 1.25 0.00 0.00 42.46 39.22 1rod s ILE 22 CO 0.00 0.25 0.66 0.50 0.24 0.00 0.00 174.94 176.59 1rod h LYS 23 N 5.94 0.17 -4.25 0.37 3.64 -1.45 -3.43 116.57 117.57 1rod h LYS 23 Ca -0.42 -0.30 -0.58 0.00 -1.27 0.00 0.00 60.65 58.08 1rod h LYS 23 Cb 1.21 0.11 -0.38 0.00 -0.41 0.00 0.00 32.23 32.76 1rod h LYS 23 CO 0.74 0.95 -0.79 -1.21 -2.27 0.00 0.00 179.45 176.87 1rod s GLU 24 N -2.60 1.54 -0.51 1.90 8.01 -1.09 -4.95 118.70 121.00 1rod s GLU 24 Ca -0.11 -0.73 -0.18 0.00 0.01 0.00 0.00 54.97 53.96 1rod s GLU 24 Cb 0.07 -2.29 0.07 0.00 -4.31 0.00 0.00 34.13 27.67 1rod s GLU 24 CO 0.82 -0.51 0.55 -1.17 0.01 0.00 0.00 175.26 174.97 1rod s LEU 25 N 1.53 5.29 -0.06 1.80 1.98 -1.26 0.32 118.68 128.28 1rod s LEU 25 Ca -0.02 -1.16 -0.10 0.00 -2.89 0.00 0.00 54.13 49.97 1rod s LEU 25 Cb -0.17 -2.33 -0.05 0.00 0.66 0.00 0.00 46.19 44.30 1rod s LEU 25 CO -0.07 -0.84 0.25 -0.60 -1.89 0.00 0.00 176.35 173.20 1rod s ARG 26 N 2.27 3.63 -0.20 1.98 3.52 -0.39 -4.83 118.95 124.93 1rod s ARG 26 Ca 0.10 0.07 0.01 0.00 -0.13 0.00 0.00 55.73 55.79 1rod s ARG 26 Cb -0.22 -3.19 0.04 0.00 -1.56 0.00 0.00 34.95 30.02 1rod s ARG 26 CO 0.09 0.73 -0.10 0.08 -0.81 0.00 0.00 175.30 175.29 1rod s VAL 27 N -1.08 1.63 -1.31 7.11 1.01 -1.26 0.32 120.40 126.82 1rod s VAL 27 Ca 0.20 -1.00 -0.17 0.00 0.00 0.00 0.00 61.98 61.01 1rod s VAL 27 Cb -0.14 -1.71 0.08 0.00 0.00 0.00 0.00 36.38 34.61 1rod s VAL 27 CO 0.09 0.17 1.77 2.30 0.00 0.00 0.00 175.10 179.43 1rod n ILE 28 N 4.69 3.92 -2.38 2.22 -5.35 -0.04 -4.79 119.36 117.64 1rod n ILE 28 Ca -0.15 -4.04 -0.38 0.00 -0.27 0.00 0.00 62.75 57.91 1rod n ILE 28 Cb 0.47 -2.39 0.02 0.00 -1.74 0.00 0.00 39.64 36.00 1rod n ILE 28 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 1rod n GLU 29 N 7.87 4.00 -0.00 6.28 2.13 -1.25 0.28 120.64 139.95 1rod n GLU 29 Ca 0.48 -4.23 0.00 0.00 0.66 0.00 0.00 57.16 54.07 1rod n GLU 29 Cb 0.45 -2.35 0.00 0.00 0.27 0.00 0.00 31.44 29.81 1rod n GLU 29 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1rod n SER 30 N -0.30 0.00 -3.87 4.31 2.88 -0.66 -4.89 113.62 111.09 1rod n SER 30 Ca 0.47 -0.89 0.00 0.00 -1.33 0.00 0.00 58.87 57.12 1rod n SER 30 Cb 0.30 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.76 1rod n SER 30 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1rod n GLY 31 N 5.00 -3.20 3.43 0.46 0.00 -1.26 -4.68 105.19 104.95 1rod n GLY 31 Ca 0.00 -1.07 -0.41 0.00 0.00 0.00 0.00 46.02 44.54 1rod n GLY 31 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1rod s PRO 32 N 0.00 3.02 0.00 1.61 0.04 -1.26 -4.68 135.00 133.73 1rod s PRO 32 Ca 0.00 -0.96 0.00 0.00 0.04 0.00 0.00 61.00 60.08 1rod s PRO 32 Cb 0.00 -3.80 0.00 0.00 0.04 0.00 0.00 34.50 30.74 1rod s PRO 32 CO 0.00 -0.65 0.00 -2.39 0.04 0.00 0.00 177.00 174.00 1rod n HIS 33 N 5.06 0.00 0.00 0.56 1.44 -1.26 -5.06 115.22 115.96 1rod n HIS 33 Ca -0.12 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.59 1rod n HIS 33 Cb 0.47 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.58 1rod n HIS 33 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1rod n ALA 35 N -0.19 0.00 -3.14 0.00 0.00 -1.26 -4.46 120.51 111.46 1rod n ALA 35 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1rod n ALA 35 Cb 0.00 0.01 -0.13 0.00 0.00 0.00 0.00 19.45 19.33 1rod n ALA 35 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1rod s ASN 36 N -2.10 4.59 0.00 0.00 0.01 -1.26 -4.83 114.94 111.34 1rod s ASN 36 Ca 0.00 -0.24 0.00 0.00 -0.71 0.00 0.00 52.86 51.91 1rod s ASN 36 Cb 0.00 -1.76 0.00 0.00 0.41 0.00 0.00 41.25 39.90 1rod s ASN 36 CO 0.00 0.09 0.00 1.07 -1.51 0.00 0.00 177.10 176.75 1rod n THR 37 N 4.06 0.00 -2.46 1.60 5.66 0.81 -1.65 114.28 122.30 1rod n THR 37 Ca -0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 1rod n THR 37 Cb 0.52 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 1rod n THR 37 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1rod n GLU 38 N 0.00 3.08 -3.85 1.09 2.13 0.16 -4.80 120.64 118.45 1rod n GLU 38 Ca 0.00 0.00 -0.22 0.00 0.66 0.00 0.00 57.16 57.60 1rod n GLU 38 Cb 0.21 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 31.88 1rod n GLU 38 CO 0.00 0.00 0.00 -1.50 -0.41 0.00 0.00 177.13 175.22 1rod s ILE 39 N 1.21 3.22 0.26 6.31 2.07 -0.68 -0.86 121.20 132.73 1rod s ILE 39 Ca 0.00 -1.46 -0.07 0.00 -1.41 0.00 0.00 60.65 57.72 1rod s ILE 39 Cb 0.00 -3.10 -0.01 0.00 0.13 0.00 0.00 42.46 39.48 1rod s ILE 39 CO 0.00 -0.14 0.38 -0.63 -1.91 0.00 0.00 174.94 172.64 1rod s ILE 40 N -2.37 0.00 0.23 2.00 -1.09 0.95 -0.27 121.20 120.64 1rod s ILE 40 Ca 0.41 -1.62 -0.21 0.00 -2.23 0.00 0.00 60.65 57.00 1rod s ILE 40 Cb -0.04 -2.40 0.07 0.00 -1.58 0.00 0.00 42.46 38.51 1rod s ILE 40 CO 0.26 0.00 0.97 0.54 -1.23 0.00 0.00 174.94 175.47 1rod s VAL 41 N -3.79 0.00 -0.40 2.92 0.11 -0.60 -1.26 120.40 117.38 1rod s VAL 41 Ca 0.29 -0.70 0.07 0.00 -2.93 0.00 0.00 61.98 58.71 1rod s VAL 41 Cb 0.01 -2.77 0.23 0.00 -1.53 0.00 0.00 36.38 32.32 1rod s VAL 41 CO 0.13 0.00 0.48 1.17 -3.33 0.00 0.00 175.10 173.55 1rod n LYS 42 N -0.63 0.58 -1.12 1.54 4.81 0.95 -1.73 118.16 122.56 1rod n LYS 42 Ca -0.05 -3.18 -0.43 0.00 -0.87 0.00 0.00 58.31 53.78 1rod n LYS 42 Cb 0.60 -1.33 -0.06 0.00 0.02 0.00 0.00 35.03 34.26 1rod n LYS 42 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1rod n LEU 43 N 1.77 0.70 0.00 3.14 4.32 0.86 -1.37 117.00 126.42 1rod n LEU 43 Ca 0.23 0.77 0.00 0.00 -0.02 0.00 0.00 56.01 56.99 1rod n LEU 43 Cb 0.52 -0.57 0.00 0.00 -1.62 0.00 0.00 43.42 41.74 1rod n LEU 43 CO 0.15 -0.62 0.00 -0.24 -1.22 0.00 0.00 177.39 175.46 1rod n SER 44 N 2.41 0.00 -2.66 -1.43 2.88 0.14 -2.34 113.62 112.63 1rod n SER 44 Ca 0.19 0.00 -0.37 0.00 -1.33 0.00 0.00 58.87 57.36 1rod n SER 44 Cb -0.03 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 63.49 1rod n SER 44 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1rod n ASP 45 N 0.00 7.46 0.06 -3.46 5.75 -1.26 -4.51 116.55 120.60 1rod n ASP 45 Ca 0.00 -3.81 0.00 0.00 -0.01 0.00 0.00 54.79 50.97 1rod n ASP 45 Cb 0.00 -1.00 0.00 0.00 -1.03 0.00 0.00 41.12 39.09 1rod n ASP 45 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1rod n GLY 46 N -0.69 -0.36 3.30 6.12 0.00 -1.03 -5.13 105.19 107.41 1rod n GLY 46 Ca 0.57 0.04 -0.26 0.00 0.00 0.00 0.00 46.02 46.38 1rod n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rod s ARG 47 N -2.00 1.27 -0.27 1.61 0.52 -0.99 -5.00 118.95 114.09 1rod s ARG 47 Ca 0.00 -1.16 -0.03 0.00 -0.52 0.00 0.00 55.73 54.03 1rod s ARG 47 Cb 0.00 -1.55 0.16 0.00 0.52 0.00 0.00 34.95 34.08 1rod s ARG 47 CO 0.00 0.37 0.51 -1.21 0.02 0.00 0.00 175.30 174.99 1rod s GLU 48 N -1.76 0.47 0.00 3.54 2.02 -1.26 0.30 118.70 122.00 1rod s GLU 48 Ca 0.08 0.87 0.00 0.00 0.02 0.00 0.00 54.97 55.94 1rod s GLU 48 Cb -0.10 0.17 0.00 0.00 0.10 0.00 0.00 34.13 34.30 1rod s GLU 48 CO 0.04 -0.57 0.00 -0.11 0.02 0.00 0.00 175.26 174.64 1rod n LEU 49 N 5.40 0.00 -4.91 1.80 7.94 -0.70 -4.93 117.00 121.59 1rod n LEU 49 Ca -0.03 0.00 -0.30 0.00 -1.11 0.00 0.00 56.01 54.57 1rod n LEU 49 Cb 0.50 0.00 0.17 0.00 0.53 0.00 0.00 43.42 44.62 1rod n LEU 49 CO 0.03 0.00 0.85 0.00 -1.11 0.00 0.00 177.39 177.17 1rod s LEU 51 N -5.87 -0.76 0.35 0.00 1.43 0.62 -2.43 118.68 112.03 1rod s LEU 51 Ca 0.72 1.45 0.00 0.00 -1.03 0.00 0.00 54.13 55.27 1rod s LEU 51 Cb -0.05 2.47 0.00 0.00 0.03 0.00 0.00 46.19 48.63 1rod s LEU 51 CO 0.52 -0.25 0.00 -0.67 0.23 0.00 0.00 176.35 176.18 1rod n ASP 52 N 2.75 -3.19 -3.04 2.29 -0.08 -1.26 -1.69 116.55 112.34 1rod n ASP 52 Ca -0.14 0.72 0.00 0.00 -1.51 0.00 0.00 54.79 53.85 1rod n ASP 52 Cb 0.55 3.07 0.00 0.00 2.34 0.00 0.00 41.12 47.09 1rod n ASP 52 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1rod n PRO 53 N -3.22 0.44 0.00 -0.67 -0.04 -1.26 -4.05 135.00 126.19 1rod n PRO 53 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1rod n PRO 53 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 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 0.00 -2.55 0.55 0.00 -1.26 -4.22 120.51 110.03 1rod n ALA 54 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 1rod n ALA 54 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 1rod n ALA 54 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1rod s SER 55 N -4.00 6.19 0.00 0.00 0.01 -1.26 -4.94 113.70 109.70 1rod s SER 55 Ca 0.00 -0.78 0.00 0.00 1.31 0.00 0.00 55.95 56.48 1rod s SER 55 Cb 0.00 -2.22 0.00 0.00 0.21 0.00 0.00 66.02 64.01 1rod s SER 55 CO 0.00 -0.62 1.75 -0.81 0.41 0.00 0.00 173.24 173.97 1rod n PRO 56 N 5.60 0.94 -0.07 12.44 -0.04 -1.26 -4.55 135.00 148.07 1rod n PRO 56 Ca -0.08 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.26 1rod n PRO 56 Cb 0.47 -1.03 -0.06 0.00 -0.04 0.00 0.00 33.50 32.84 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 0.91 0.10 0.00 0.52 1.08 -1.91 0.14 117.51 118.36 1rod h ILE 57 Ca 0.00 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.44 1rod h ILE 57 Cb 0.94 0.10 -0.00 0.00 -3.07 0.00 0.00 36.82 34.79 1rod h ILE 57 CO 0.00 0.00 -0.14 1.62 -0.69 0.00 0.00 178.15 178.94 1rod h VAL 58 N -0.42 1.04 0.00 1.67 3.04 -1.90 0.27 116.25 119.94 1rod h VAL 58 Ca 0.10 -0.48 -0.08 0.00 -1.01 0.00 0.00 66.70 65.22 1rod h VAL 58 Cb 0.61 1.27 -0.01 0.00 -2.01 0.00 0.00 31.29 31.15 1rod h VAL 58 CO -0.49 0.14 -0.40 0.50 -1.01 0.00 0.00 177.57 176.31 1rod h LYS 59 N 0.00 0.00 0.00 4.17 3.11 -1.17 -2.00 116.57 120.68 1rod h LYS 59 Ca -0.00 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.83 1rod h LYS 59 Cb 0.25 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.48 1rod h LYS 59 CO 0.02 0.40 -0.18 0.87 -2.81 0.00 0.00 179.45 177.74 1rod h LYS 60 N 0.00 0.00 0.05 1.90 1.57 0.16 -1.28 116.57 118.97 1rod h LYS 60 Ca -0.00 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.53 1rod h LYS 60 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.09 1rod h LYS 60 CO 0.05 0.05 -1.05 0.82 -0.57 0.00 0.00 179.45 178.75 1rod h ILE 61 N 0.00 1.43 0.04 1.86 5.03 -0.40 -1.15 117.51 124.32 1rod h ILE 61 Ca -0.00 -2.66 -0.25 0.00 -0.12 0.00 0.00 64.86 61.83 1rod h ILE 61 Cb 1.04 2.61 -0.03 0.00 -3.03 0.00 0.00 36.82 37.41 1rod h ILE 61 CO 0.01 0.79 -1.27 0.40 -0.68 0.00 0.00 178.15 177.39 1rod h ILE 62 N 0.17 1.41 -0.01 -0.67 1.08 -1.48 -3.23 117.51 114.79 1rod h ILE 62 Ca -0.10 -3.12 -0.08 0.00 -0.39 0.00 0.00 64.86 61.17 1rod h ILE 62 Cb 1.72 2.76 -0.01 0.00 -3.07 0.00 0.00 36.82 38.22 1rod h ILE 62 CO 0.18 0.84 -0.39 -0.33 -0.69 0.00 0.00 178.15 177.75 1rod h GLU 63 N 0.02 0.01 0.00 2.37 4.39 -1.21 -2.32 114.58 117.85 1rod h GLU 63 Ca -0.12 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.57 1rod h GLU 63 Cb 1.89 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.54 1rod h GLU 63 CO 0.14 0.41 0.00 1.63 -1.16 0.00 0.00 179.01 180.02 1rod n LYS 64 N -4.07 0.13 0.09 2.33 4.76 -0.44 -2.04 118.16 118.92 1rod n LYS 64 Ca -0.02 0.20 -0.07 0.00 -2.87 0.00 0.00 58.31 55.55 1rod n LYS 64 Cb 0.43 -1.50 -0.04 0.00 -1.84 0.00 0.00 35.03 32.08 1rod n LYS 64 CO 0.00 0.00 0.00 1.98 -1.37 0.00 0.00 177.40 178.01 1rod h MET 65 N 0.00 -0.30 0.35 1.97 4.05 -1.57 0.69 114.93 120.12 1rod h MET 65 Ca 0.00 0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.44 1rod h MET 65 Cb 0.14 0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 30.99 1rod h MET 65 CO 0.00 -0.07 -0.34 -0.07 0.23 0.00 0.00 176.91 176.65 1rod h LEU 66 N -1.04 -0.92 -1.07 3.39 4.07 -1.67 -1.90 115.31 116.18 1rod h LEU 66 Ca -0.03 0.08 0.11 0.00 0.08 0.00 0.00 57.88 58.12 1rod h LEU 66 Cb 0.37 0.31 -0.08 0.00 1.08 0.00 0.00 40.66 42.34 1rod h LEU 66 CO 0.05 -0.48 0.62 0.78 -1.08 0.00 0.00 178.44 178.33 1rod h ASN 67 N -0.72 0.90 0.16 -0.43 2.35 -1.53 0.20 115.58 116.52 1rod h ASN 67 Ca -0.02 0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 1rod h ASN 67 Cb 0.65 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.87 1rod h ASN 67 CO -0.06 0.50 -0.10 -1.28 -1.65 0.00 0.00 177.43 174.84 1rod h SER 68 N 0.98 0.00 1.35 5.81 0.87 -0.20 0.66 113.55 123.01 1rod h SER 68 Ca 0.47 0.00 -0.13 0.00 -1.23 0.00 0.00 61.79 60.90 1rod h SER 68 Cb 0.44 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.39 1rod h SER 68 CO -0.23 0.10 -0.60 -0.78 -0.53 0.00 0.00 176.83 174.79 1rod h ASP 69 N 0.00 0.00 -1.11 6.23 1.82 0.11 -3.28 116.42 120.19 1rod h ASP 69 Ca -0.00 0.00 -0.52 0.00 -0.39 0.00 0.00 57.03 56.12 1rod h ASP 69 Cb 0.21 0.00 -0.19 0.00 0.68 0.00 0.00 39.33 40.03 1rod h ASP 69 CO 0.01 0.60 0.51 0.29 -1.61 0.00 0.00 179.24 179.05 1rod n LYS 70 N -3.27 2.38 -0.38 0.28 5.02 0.22 -3.88 118.16 118.53 1rod n LYS 70 Ca 0.01 -2.44 0.00 0.00 -2.02 0.00 0.00 58.31 53.86 1rod n LYS 70 Cb 0.77 -2.09 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 1rod n LYS 70 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1rod n SER 71 N 0.52 0.00 0.00 4.39 2.88 -1.23 -4.98 113.62 115.20 1rod n SER 71 Ca 0.48 -1.29 0.00 0.00 -1.33 0.00 0.00 58.87 56.72 1rod n SER 71 Cb 0.52 -0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.92 1rod n SER 71 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40