#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x61 h SER 2 N 0.00 0.10 -3.29 1.61 4.64 -2.11 -3.40 113.55 111.09 1x61 h SER 2 Ca 0.00 -0.23 -0.57 0.00 -0.47 0.00 0.00 61.79 60.52 1x61 h SER 2 Cb 0.00 -0.03 -0.06 0.00 -0.31 0.00 0.00 62.40 62.01 1x61 h SER 2 CO 0.00 0.30 0.97 -0.44 -0.87 0.00 0.00 176.83 176.79 1x61 s SER 3 N -5.52 6.64 -0.58 4.97 0.01 -1.26 -4.92 113.70 113.03 1x61 s SER 3 Ca -0.14 0.99 0.03 0.00 1.31 0.00 0.00 55.95 58.14 1x61 s SER 3 Cb 0.05 -2.54 0.38 0.00 0.21 0.00 0.00 66.02 64.12 1x61 s SER 3 CO 0.68 -1.15 1.27 0.61 0.41 0.00 0.00 173.24 175.06 1x61 n GLY 4 N 4.49 5.85 0.13 3.44 0.00 -1.26 -4.72 105.19 113.12 1x61 n GLY 4 Ca 0.14 -2.72 -0.21 0.00 0.00 0.00 0.00 46.02 43.23 1x61 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x61 n SER 5 N -0.40 2.06 -0.33 1.61 3.41 -1.26 -4.28 113.62 114.42 1x61 n SER 5 Ca 0.40 0.17 0.06 0.00 -0.26 0.00 0.00 58.87 59.23 1x61 n SER 5 Cb 0.50 -0.78 0.21 0.00 -0.26 0.00 0.00 64.21 63.88 1x61 n SER 5 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1x61 h SER 6 N -0.12 0.81 -1.34 4.04 4.64 -1.92 -3.38 113.55 116.28 1x61 h SER 6 Ca -0.46 0.05 -0.43 0.00 -0.47 0.00 0.00 61.79 60.48 1x61 h SER 6 Cb 1.90 -0.11 0.12 0.00 -0.31 0.00 0.00 62.40 64.00 1x61 h SER 6 CO -0.01 0.43 -0.77 0.61 -0.87 0.00 0.00 176.83 176.23 1x61 n GLY 7 N -1.34 -2.17 3.49 -0.77 0.00 -1.26 -2.91 105.19 100.23 1x61 n GLY 7 Ca 0.17 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1x61 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x61 h GLY 9 N 9.77 0.33 0.00 0.00 0.00 -0.85 1.02 103.07 113.33 1x61 h GLY 9 Ca -0.26 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 46.99 1x61 h GLY 9 CO 0.93 0.01 0.00 0.61 0.00 0.00 0.00 176.54 178.09 1x61 n GLY 10 N -1.61 -1.39 0.09 4.60 0.00 -1.26 -4.54 105.19 101.08 1x61 n GLY 10 Ca 0.15 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.00 1x61 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x61 n GLY 12 N 1.62 3.34 3.47 0.00 0.00 0.35 -5.00 105.19 108.96 1x61 n GLY 12 Ca -0.16 -0.84 -0.35 0.00 0.00 0.00 0.00 46.02 44.67 1x61 n GLY 12 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x61 n GLU 13 N 0.00 0.08 -1.80 1.61 -0.58 -1.26 -2.78 120.64 115.91 1x61 n GLU 13 Ca 0.00 0.08 -0.35 0.00 -0.42 0.00 0.00 57.16 56.47 1x61 n GLU 13 Cb 0.00 -1.90 0.05 0.00 -0.57 0.00 0.00 31.44 29.02 1x61 n GLU 13 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1x61 s ASP 14 N -1.73 4.94 -0.39 1.62 1.01 -1.26 0.10 116.67 120.96 1x61 s ASP 14 Ca 0.63 2.24 -0.07 0.00 0.71 0.00 0.00 52.55 56.07 1x61 s ASP 14 Cb -0.29 -2.58 0.07 0.00 1.01 0.00 0.00 42.92 41.13 1x61 s ASP 14 CO 0.61 -1.75 0.19 -0.69 0.21 0.00 0.00 175.17 173.73 1x61 s VAL 15 N -1.94 3.88 0.07 -1.27 1.01 -1.15 -4.76 120.40 116.25 1x61 s VAL 15 Ca 0.73 -1.43 0.09 0.00 0.00 0.00 0.00 61.98 61.37 1x61 s VAL 15 Cb -0.26 -3.36 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 1x61 s VAL 15 CO 0.38 -0.42 -0.22 -0.69 0.00 0.00 0.00 175.10 174.16 1x61 s VAL 16 N 1.36 2.55 0.00 2.92 1.01 -1.26 -4.90 120.40 122.08 1x61 s VAL 16 Ca 0.02 -1.39 0.00 0.00 0.00 0.00 0.00 61.98 60.61 1x61 s VAL 16 Cb -0.22 -2.08 0.00 0.00 0.00 0.00 0.00 36.38 34.08 1x61 s VAL 16 CO 0.01 0.26 0.00 0.61 0.00 0.00 0.00 175.10 175.98 1x61 n GLY 17 N 1.36 1.51 0.25 4.51 0.00 -1.26 -4.85 105.19 106.70 1x61 n GLY 17 Ca -0.17 0.22 0.09 0.00 0.00 0.00 0.00 46.02 46.17 1x61 n GLY 17 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1x61 n ASP 18 N 0.00 -0.13 -2.48 1.61 2.03 -1.26 0.62 116.55 116.95 1x61 n ASP 18 Ca 0.00 1.23 -0.29 0.00 0.52 0.00 0.00 54.79 56.25 1x61 n ASP 18 Cb 0.00 -0.43 0.01 0.00 -0.72 0.00 0.00 41.12 39.98 1x61 n ASP 18 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1x61 n GLY 19 N -1.38 5.98 3.34 0.27 0.00 -1.26 -5.02 105.19 107.12 1x61 n GLY 19 Ca 0.16 -2.69 -0.09 0.00 0.00 0.00 0.00 46.02 43.39 1x61 n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x61 s ALA 20 N -3.65 -0.15 0.00 4.61 0.00 0.20 -5.12 121.76 117.66 1x61 s ALA 20 Ca 0.50 -0.76 0.00 0.00 0.00 0.00 0.00 51.96 51.70 1x61 s ALA 20 Cb 0.41 0.81 0.00 0.00 0.00 0.00 0.00 23.12 24.34 1x61 s ALA 20 CO -0.19 -0.64 0.00 0.41 0.00 0.00 0.00 175.76 175.34 1x61 n GLY 21 N -0.21 1.70 3.56 0.00 0.00 -1.26 -4.60 105.19 104.37 1x61 n GLY 21 Ca -0.09 -0.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.68 1x61 n GLY 21 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x61 s VAL 22 N 0.00 4.87 -0.29 1.61 1.01 -0.68 -4.95 120.40 121.97 1x61 s VAL 22 Ca 0.00 0.46 -0.14 0.00 0.00 0.00 0.00 61.98 62.29 1x61 s VAL 22 Cb 0.00 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 1x61 s VAL 22 CO 0.00 -0.39 0.33 -0.69 0.00 0.00 0.00 175.10 174.35 1x61 s VAL 23 N 2.75 5.20 -0.15 2.92 1.01 -1.26 -0.80 120.40 130.07 1x61 s VAL 23 Ca 0.24 0.32 -0.13 0.00 0.00 0.00 0.00 61.98 62.41 1x61 s VAL 23 Cb -0.14 -3.70 0.04 0.00 0.00 0.00 0.00 36.38 32.57 1x61 s VAL 23 CO 0.16 0.10 0.38 0.00 0.00 0.00 0.00 175.10 175.74 1x61 s ALA 24 N 1.99 -0.95 -1.37 5.51 0.00 -0.57 -4.91 121.76 121.47 1x61 s ALA 24 Ca 0.12 1.11 -0.09 0.00 0.00 0.00 0.00 51.96 53.11 1x61 s ALA 24 Cb -0.16 -0.65 0.02 0.00 0.00 0.00 0.00 23.12 22.33 1x61 s ALA 24 CO 0.11 -0.19 1.12 1.28 0.00 0.00 0.00 175.76 178.08 1x61 n LEU 25 N 2.98 -3.33 -2.75 0.00 4.77 -1.26 -1.48 117.00 115.93 1x61 n LEU 25 Ca -0.14 -0.60 -0.21 0.00 -0.03 0.00 0.00 56.01 55.04 1x61 n LEU 25 Cb 0.57 -2.96 0.01 0.00 -2.33 0.00 0.00 43.42 38.71 1x61 n LEU 25 CO 0.13 0.59 -0.12 0.47 -1.33 0.00 0.00 177.39 177.13 1x61 n ASP 26 N -3.00 -5.55 -3.52 -1.43 8.00 -1.26 -4.96 116.55 104.83 1x61 n ASP 26 Ca -0.02 -0.13 -0.19 0.00 0.71 0.00 0.00 54.79 55.16 1x61 n ASP 26 Cb 0.57 -4.57 -0.08 0.00 -0.02 0.00 0.00 41.12 37.02 1x61 n ASP 26 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1x61 s ARG 27 N -5.40 1.68 -0.06 -1.24 1.81 -0.55 -5.11 118.95 110.07 1x61 s ARG 27 Ca 0.16 -1.97 0.02 0.00 -1.72 0.00 0.00 55.73 52.22 1x61 s ARG 27 Cb -0.07 0.27 0.02 0.00 -0.45 0.00 0.00 34.95 34.71 1x61 s ARG 27 CO 0.20 -0.60 -0.09 0.08 -0.68 0.00 0.00 175.30 174.21 1x61 s VAL 28 N -3.54 0.90 0.04 3.52 1.01 -1.26 -1.51 120.40 119.57 1x61 s VAL 28 Ca 0.40 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 62.07 1x61 s VAL 28 Cb 0.03 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.53 1x61 s VAL 28 CO 0.25 0.31 -0.09 -0.36 0.00 0.00 0.00 175.10 175.21 1x61 s PHE 29 N 0.80 0.75 0.29 5.22 0.40 0.02 -0.14 117.98 125.33 1x61 s PHE 29 Ca -0.12 -0.47 -0.29 0.00 -0.60 0.00 0.00 56.93 55.44 1x61 s PHE 29 Cb -0.15 -0.45 -0.10 0.00 0.51 0.00 0.00 43.02 42.84 1x61 s PHE 29 CO 0.02 -0.06 1.20 -1.01 0.70 0.00 0.00 175.22 176.07 1x61 s HIS 30 N -1.29 3.35 0.49 0.36 3.76 -1.26 -1.68 115.29 119.02 1x61 s HIS 30 Ca -0.08 1.54 0.41 0.00 -0.15 0.00 0.00 55.06 56.79 1x61 s HIS 30 Cb -0.10 -3.46 1.57 0.00 1.11 0.00 0.00 32.58 31.70 1x61 s HIS 30 CO 0.01 -1.17 1.50 1.33 -0.85 0.00 0.00 174.74 175.56 1x61 n VAL 31 N 1.22 -0.11 -0.08 -0.90 0.24 -1.26 -0.13 118.33 117.32 1x61 n VAL 31 Ca 0.00 1.57 -0.17 0.00 -2.04 0.00 0.00 64.34 63.70 1x61 n VAL 31 Cb 0.43 -2.59 -0.12 0.00 -1.47 0.00 0.00 33.84 30.10 1x61 n VAL 31 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1x61 h GLY 32 N 0.00 0.00 0.41 7.63 0.00 -2.02 -3.39 103.07 105.71 1x61 h GLY 32 Ca 0.88 0.00 0.04 0.00 0.00 0.00 0.00 47.33 48.25 1x61 h GLY 32 CO -0.20 0.00 -0.20 0.00 0.00 0.00 0.00 176.54 176.14 1x61 n PHE 34 N -5.33 1.50 -3.97 0.00 7.35 0.08 -4.87 117.46 112.22 1x61 n PHE 34 Ca -0.03 0.14 -0.10 0.00 -0.76 0.00 0.00 57.45 56.70 1x61 n PHE 34 Cb 0.25 -2.60 -0.03 0.00 0.35 0.00 0.00 39.48 37.45 1x61 n PHE 34 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 1x61 s VAL 35 N 9.47 0.00 1.13 -2.13 -7.23 -1.26 -2.99 120.40 117.39 1x61 s VAL 35 Ca 1.07 -1.32 -0.12 0.00 -1.81 0.00 0.00 61.98 59.79 1x61 s VAL 35 Cb -0.55 -2.37 0.27 0.00 0.56 0.00 0.00 36.38 34.29 1x61 s VAL 35 CO 0.38 0.00 1.04 0.00 -0.31 0.00 0.00 175.10 176.21 1x61 n SER 37 N -4.81 0.72 -0.09 0.00 2.88 -0.46 -3.41 113.62 108.45 1x61 n SER 37 Ca 0.04 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.49 1x61 n SER 37 Cb 0.54 1.61 -0.03 0.00 -0.75 0.00 0.00 64.21 65.58 1x61 n SER 37 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1x61 n THR 38 N -2.28 1.48 0.75 2.46 -1.04 -1.26 -4.60 114.28 109.78 1x61 n THR 38 Ca -0.10 0.14 0.12 0.00 -2.04 0.00 0.00 64.05 62.16 1x61 n THR 38 Cb 0.64 -2.34 0.12 0.00 -1.82 0.00 0.00 70.33 66.93 1x61 n THR 38 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1x61 n ARG 40 N -1.80 -5.61 -2.90 0.00 5.12 -1.22 -4.92 116.66 105.33 1x61 n ARG 40 Ca 0.04 0.63 -0.31 0.00 -1.93 0.00 0.00 57.85 56.28 1x61 n ARG 40 Cb 0.40 -5.45 -0.04 0.00 -1.16 0.00 0.00 32.46 26.21 1x61 n ARG 40 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1x61 s ALA 41 N -3.40 3.33 -0.07 7.54 0.00 -1.26 -4.50 121.76 123.39 1x61 s ALA 41 Ca 0.47 -0.14 -0.29 0.00 0.00 0.00 0.00 51.96 52.00 1x61 s ALA 41 Cb -0.23 -2.73 -0.07 0.00 0.00 0.00 0.00 23.12 20.09 1x61 s ALA 41 CO 0.82 0.05 1.94 -0.65 0.00 0.00 0.00 175.76 177.91 1x61 s GLN 42 N -3.68 3.85 -0.15 0.00 -0.21 -1.26 -1.51 119.66 116.70 1x61 s GLN 42 Ca 0.52 2.28 0.15 0.00 0.02 0.00 0.00 55.36 58.34 1x61 s GLN 42 Cb -0.10 -4.17 0.52 0.00 1.00 0.00 0.00 33.01 30.26 1x61 s GLN 42 CO 0.29 -1.27 1.43 1.28 -2.12 0.00 0.00 175.29 174.90 1x61 n LEU 43 N 8.62 3.91 -0.37 2.90 4.77 -1.16 -4.74 117.00 130.93 1x61 n LEU 43 Ca 0.22 -2.80 -0.04 0.00 -0.03 0.00 0.00 56.01 53.35 1x61 n LEU 43 Cb 0.43 -0.50 -0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1x61 n LEU 43 CO 0.66 0.69 0.56 -0.09 -1.33 0.00 0.00 177.39 177.88 1x61 h ARG 44 N 2.14 -0.02 -2.48 3.23 2.43 -1.76 -3.33 114.38 114.58 1x61 h ARG 44 Ca 0.00 0.00 -0.54 0.00 -0.81 0.00 0.00 59.98 58.63 1x61 h ARG 44 Cb 1.36 0.01 -0.38 0.00 -0.42 0.00 0.00 29.97 30.54 1x61 h ARG 44 CO 0.21 -0.02 -0.82 0.20 -1.51 0.00 0.00 179.97 178.03 1x61 s GLY 45 N -3.20 0.67 0.18 2.80 0.00 -1.26 -5.02 107.32 101.48 1x61 s GLY 45 Ca -0.13 -1.66 -0.23 0.00 0.00 0.00 0.00 44.72 42.70 1x61 s GLY 45 CO 0.69 2.21 1.03 -0.86 0.00 0.00 0.00 173.10 176.16 1x61 s GLN 46 N 1.20 1.29 -0.39 2.90 -2.07 -1.25 -5.13 119.66 116.21 1x61 s GLN 46 Ca 0.17 -0.81 -0.25 0.00 -1.82 0.00 0.00 55.36 52.65 1x61 s GLN 46 Cb -0.21 0.37 0.02 0.00 -1.09 0.00 0.00 33.01 32.10 1x61 s GLN 46 CO -0.02 -0.60 0.91 -1.01 -1.32 0.00 0.00 175.29 173.25 1x61 s HIS 47 N -2.39 3.05 0.41 9.60 3.76 -1.26 -5.02 115.29 123.43 1x61 s HIS 47 Ca 0.20 0.66 0.03 0.00 -0.15 0.00 0.00 55.06 55.80 1x61 s HIS 47 Cb -0.02 -3.69 -0.03 0.00 1.11 0.00 0.00 32.58 29.95 1x61 s HIS 47 CO 0.05 -0.87 0.08 -0.59 -0.85 0.00 0.00 174.74 172.55 1x61 s PHE 48 N 3.49 1.88 0.25 1.40 -0.71 -1.26 -2.53 117.98 120.50 1x61 s PHE 48 Ca 0.37 -1.11 0.09 0.00 -1.04 0.00 0.00 56.93 55.24 1x61 s PHE 48 Cb -0.12 -1.32 -0.05 0.00 -1.21 0.00 0.00 43.02 40.33 1x61 s PHE 48 CO 0.20 -0.08 -0.14 0.71 -1.34 0.00 0.00 175.22 174.57 1x61 s TYR 49 N -3.13 2.00 -0.23 3.49 1.51 0.96 -4.85 117.35 117.10 1x61 s TYR 49 Ca 0.23 -0.51 0.01 0.00 -1.01 0.00 0.00 57.07 55.80 1x61 s TYR 49 Cb 0.04 -0.97 0.05 0.00 -0.11 0.00 0.00 41.96 40.98 1x61 s TYR 49 CO 0.12 0.48 -0.09 0.00 -1.11 0.00 0.00 175.55 174.96 1x61 s ALA 50 N -2.80 2.13 -0.04 3.71 0.00 -1.26 -1.67 121.76 121.83 1x61 s ALA 50 Ca 0.27 -1.39 -0.01 0.00 0.00 0.00 0.00 51.96 50.83 1x61 s ALA 50 Cb -0.01 -1.40 0.03 0.00 0.00 0.00 0.00 23.12 21.74 1x61 s ALA 50 CO 0.11 -1.03 0.04 0.08 0.00 0.00 0.00 175.76 174.97 1x61 s VAL 51 N 1.32 0.01 -1.25 0.00 1.01 -1.16 -4.84 120.40 115.49 1x61 s VAL 51 Ca -0.05 0.32 -0.06 0.00 0.00 0.00 0.00 61.98 62.19 1x61 s VAL 51 Cb -0.18 -0.22 0.01 0.00 0.00 0.00 0.00 36.38 35.99 1x61 s VAL 51 CO -0.07 0.18 0.86 -0.62 0.00 0.00 0.00 175.10 175.45 1x61 n GLU 52 N 5.01 -6.02 -3.30 2.72 1.02 -1.26 -2.21 120.64 116.60 1x61 n GLU 52 Ca -0.09 0.75 -0.21 0.00 -0.02 0.00 0.00 57.16 57.59 1x61 n GLU 52 Cb 0.50 -5.44 0.06 0.00 -0.02 0.00 0.00 31.44 26.54 1x61 n GLU 52 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1x61 n ARG 53 N -4.14 -6.25 -4.46 3.49 1.74 -1.26 -5.00 116.66 100.78 1x61 n ARG 53 Ca -0.03 0.77 -0.23 0.00 -0.77 0.00 0.00 57.85 57.59 1x61 n ARG 53 Cb 0.57 -5.51 -0.09 0.00 -1.02 0.00 0.00 32.46 26.42 1x61 n ARG 53 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1x61 s ARG 54 N -5.98 1.79 -0.16 5.56 0.52 -0.94 -5.15 118.95 114.58 1x61 s ARG 54 Ca 0.44 -2.05 0.01 0.00 -0.52 0.00 0.00 55.73 53.61 1x61 s ARG 54 Cb -0.20 -0.54 0.03 0.00 0.52 0.00 0.00 34.95 34.77 1x61 s ARG 54 CO 0.55 -0.41 -0.13 0.00 0.02 0.00 0.00 175.30 175.33 1x61 s ALA 55 N -3.33 1.91 -0.15 2.13 0.00 -1.26 -3.00 121.76 118.05 1x61 s ALA 55 Ca 0.29 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 51.26 1x61 s ALA 55 Cb 0.04 -1.13 0.02 0.00 0.00 0.00 0.00 23.12 22.06 1x61 s ALA 55 CO 0.15 -0.52 -0.15 0.71 0.00 0.00 0.00 175.76 175.95 1x61 s TYR 56 N 1.46 2.29 0.47 0.00 1.51 -0.67 -1.35 117.35 121.05 1x61 s TYR 56 Ca 0.03 -1.30 -0.24 0.00 -1.01 0.00 0.00 57.07 54.55 1x61 s TYR 56 Cb -0.14 -1.66 -0.07 0.00 -0.11 0.00 0.00 41.96 39.98 1x61 s TYR 56 CO -0.10 -0.69 1.37 0.00 -1.11 0.00 0.00 175.55 175.02 1x61 n GLU 58 N -0.35 -0.22 -0.01 0.00 2.13 -1.05 -0.22 120.64 120.93 1x61 n GLU 58 Ca 0.06 1.12 -0.15 0.00 0.66 0.00 0.00 57.16 58.86 1x61 n GLU 58 Cb 0.43 -1.66 -0.09 0.00 0.27 0.00 0.00 31.44 30.40 1x61 n GLU 58 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1x61 h GLY 59 N 0.00 -1.00 0.57 8.31 0.00 -1.89 -1.48 103.07 107.58 1x61 h GLY 59 Ca 0.21 0.65 -0.02 0.00 0.00 0.00 0.00 47.33 48.17 1x61 h GLY 59 CO -0.71 -0.20 -0.47 0.00 0.00 0.00 0.00 176.54 175.15 1x61 n TYR 61 N -5.34 1.04 0.02 0.00 9.36 0.08 0.13 117.16 122.45 1x61 n TYR 61 Ca -0.12 1.05 -0.19 0.00 3.32 0.00 0.00 57.90 61.96 1x61 n TYR 61 Cb 0.45 -1.46 -0.11 0.00 -0.63 0.00 0.00 39.34 37.59 1x61 n TYR 61 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 1x61 h VAL 62 N 0.00 1.38 -0.89 2.97 2.07 -0.63 -3.26 116.25 117.90 1x61 h VAL 62 Ca 0.81 -2.17 0.01 0.00 0.82 0.00 0.00 66.70 66.17 1x61 h VAL 62 Cb 2.22 2.58 -0.04 0.00 -1.52 0.00 0.00 31.29 34.52 1x61 h VAL 62 CO -0.68 0.64 0.57 0.00 0.02 0.00 0.00 177.57 178.12 1x61 h ALA 63 N 0.33 1.13 -0.46 1.67 0.00 0.29 -2.70 119.26 119.51 1x61 h ALA 63 Ca -0.10 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.81 1x61 h ALA 63 Cb 1.47 -0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.83 1x61 h ALA 63 CO 0.15 0.55 0.11 1.79 0.00 0.00 0.00 179.25 181.84 1x61 h THR 64 N 1.21 0.77 -0.63 0.00 1.35 -0.66 -1.83 112.91 113.11 1x61 h THR 64 Ca 0.32 -0.08 0.10 0.00 -0.55 0.00 0.00 66.41 66.20 1x61 h THR 64 Cb -0.12 0.50 -0.08 0.00 -1.73 0.00 0.00 68.15 66.72 1x61 h THR 64 CO -0.07 0.05 0.23 -0.07 -0.25 0.00 0.00 175.52 175.41 1x61 h LEU 65 N 0.25 0.21 -0.12 3.87 3.38 -1.52 -1.93 115.31 119.45 1x61 h LEU 65 Ca 0.23 0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.33 1x61 h LEU 65 Cb 0.28 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 1x61 h LEU 65 CO -0.29 0.12 -0.20 -0.33 0.09 0.00 0.00 178.44 177.83 1x61 h GLU 66 N 0.40 -0.25 -2.13 1.13 4.39 -1.27 -3.40 114.58 113.44 1x61 h GLU 66 Ca 0.33 0.02 -0.29 0.00 0.34 0.00 0.00 59.36 59.76 1x61 h GLU 66 Cb 0.43 0.06 -0.33 0.00 -0.10 0.00 0.00 28.75 28.81 1x61 h GLU 66 CO -0.33 -0.17 -0.60 0.45 -1.16 0.00 0.00 179.01 177.20 1x61 s SER 67 N -5.01 1.29 0.00 1.42 0.15 -0.81 -5.06 113.70 105.68 1x61 s SER 67 Ca -0.15 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.02 1x61 s SER 67 Cb 0.10 0.63 0.00 0.00 -1.71 0.00 0.00 66.02 65.05 1x61 s SER 67 CO 0.67 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 175.36 1x61 n GLY 68 N 5.32 2.11 0.00 9.45 0.00 -0.79 -4.64 105.19 116.64 1x61 n GLY 68 Ca -0.03 0.03 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1x61 n GLY 68 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x61 n PRO 69 N 0.00 0.49 -0.22 1.61 -0.04 -1.26 -4.01 135.00 131.58 1x61 n PRO 69 Ca 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 1x61 n PRO 69 Cb 0.00 -1.36 -0.08 0.00 -0.04 0.00 0.00 33.50 32.02 1x61 n PRO 69 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1x61 h SER 70 N 0.00 -1.67 -2.86 3.54 0.02 -1.87 -3.40 113.55 107.30 1x61 h SER 70 Ca 0.00 0.24 -0.51 0.00 -0.84 0.00 0.00 61.79 60.68 1x61 h SER 70 Cb 0.00 0.71 -0.01 0.00 0.14 0.00 0.00 62.40 63.24 1x61 h SER 70 CO 0.00 -0.28 -0.26 -0.44 -1.14 0.00 0.00 176.83 174.71 1x61 s SER 71 N -4.85 6.37 0.00 3.07 0.01 -1.26 -5.22 113.70 111.82 1x61 s SER 71 Ca -0.11 0.45 0.00 0.00 1.31 0.00 0.00 55.95 57.60 1x61 s SER 71 Cb 0.08 -2.03 0.00 0.00 0.21 0.00 0.00 66.02 64.28 1x61 s SER 71 CO 0.52 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.63