#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v1c n PHE 2 N 0.00 -3.45 -3.11 4.28 3.72 -1.26 -4.92 117.46 112.72 1v1c n PHE 2 Ca 0.00 1.70 -0.43 0.00 -0.05 0.00 0.00 57.45 58.67 1v1c n PHE 2 Cb 0.00 -3.47 -0.07 0.00 -0.94 0.00 0.00 39.48 35.00 1v1c n PHE 2 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1v1c s ASP 3 N -1.21 6.35 -0.32 4.37 1.11 -1.26 -4.80 116.67 120.91 1v1c s ASP 3 Ca -0.08 -0.18 -0.26 0.00 0.18 0.00 0.00 52.55 52.22 1v1c s ASP 3 Cb 0.01 -2.32 0.01 0.00 1.07 0.00 0.00 42.92 41.68 1v1c s ASP 3 CO 0.65 -0.71 0.90 -0.63 1.18 0.00 0.00 175.17 176.56 1v1c s ILE 4 N 2.78 4.68 0.05 0.77 1.01 -1.26 -1.42 121.20 127.81 1v1c s ILE 4 Ca 0.23 1.36 -0.10 0.00 0.00 0.00 0.00 60.65 62.14 1v1c s ILE 4 Cb -0.14 -4.26 -0.06 0.00 0.01 0.00 0.00 42.46 38.02 1v1c s ILE 4 CO 0.18 -0.36 0.38 -0.31 0.00 0.00 0.00 174.94 174.83 1v1c s TYR 5 N 3.24 3.61 -0.21 3.97 1.51 -0.51 -1.82 117.35 127.13 1v1c s TYR 5 Ca 0.37 0.79 -0.07 0.00 -1.01 0.00 0.00 57.07 57.15 1v1c s TYR 5 Cb -0.13 -2.16 -0.04 0.00 -0.11 0.00 0.00 41.96 39.52 1v1c s TYR 5 CO 0.14 0.56 0.06 0.54 -1.11 0.00 0.00 175.55 175.74 1v1c s VAL 6 N -1.33 4.56 -0.10 0.71 0.11 -0.51 -3.05 120.40 120.80 1v1c s VAL 6 Ca 0.30 -0.10 -0.30 0.00 -2.93 0.00 0.00 61.98 58.95 1v1c s VAL 6 Cb -0.14 -3.08 -0.02 0.00 -1.53 0.00 0.00 36.38 31.61 1v1c s VAL 6 CO 0.17 0.41 1.10 -0.69 -3.33 0.00 0.00 175.10 172.75 1v1c s VAL 7 N 0.88 4.55 -0.15 2.04 1.01 -1.10 -3.37 120.40 124.26 1v1c s VAL 7 Ca 0.03 1.84 0.18 0.00 0.00 0.00 0.00 61.98 64.03 1v1c s VAL 7 Cb -0.14 -4.18 0.36 0.00 0.00 0.00 0.00 36.38 32.41 1v1c s VAL 7 CO 0.02 -0.02 1.22 0.35 0.00 0.00 0.00 175.10 176.68 1v1c n THR 8 N 4.67 2.02 0.00 3.92 -2.24 -1.26 0.45 114.28 121.85 1v1c n THR 8 Ca 0.10 -2.29 0.00 0.00 -2.27 0.00 0.00 64.05 59.60 1v1c n THR 8 Cb 0.47 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 1v1c n THR 8 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1v1c n ALA 9 N -1.22 2.82 0.00 6.98 0.00 -1.26 -4.99 120.51 122.84 1v1c n ALA 9 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1v1c n ALA 9 Cb 0.71 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.16 1v1c n ALA 9 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1v1c n ASP 10 N -2.23 0.00 -2.87 0.00 2.03 -1.26 -4.52 116.55 107.71 1v1c n ASP 10 Ca 0.00 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.23 1v1c n ASP 10 Cb 0.00 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.41 1v1c n ASP 10 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1v1c n TYR 11 N 0.00 -3.46 -4.45 -0.67 9.36 -1.26 -3.18 117.16 113.50 1v1c n TYR 11 Ca 0.00 1.39 -0.33 0.00 3.32 0.00 0.00 57.90 62.28 1v1c n TYR 11 Cb 0.00 -4.09 -0.16 0.00 -0.63 0.00 0.00 39.34 34.46 1v1c n TYR 11 CO 0.00 0.00 0.00 -1.17 0.22 0.00 0.00 176.86 175.91 1v1c s LEU 12 N -2.72 2.31 0.15 2.98 2.96 -1.26 -2.92 118.68 120.19 1v1c s LEU 12 Ca 0.23 -0.55 -0.32 0.00 -0.22 0.00 0.00 54.13 53.28 1v1c s LEU 12 Cb -0.06 -1.52 -0.11 0.00 0.50 0.00 0.00 46.19 44.99 1v1c s LEU 12 CO 0.77 0.06 1.78 -2.65 -1.32 0.00 0.00 176.35 174.99 1v1c n PRO 13 N 4.23 2.74 -3.19 0.98 -0.02 -1.26 -4.94 135.00 133.53 1v1c n PRO 13 Ca -0.20 0.99 -0.45 0.00 -2.02 0.00 0.00 63.50 61.82 1v1c n PRO 13 Cb 0.51 -2.86 -0.04 0.00 -0.02 0.00 0.00 33.50 31.09 1v1c n PRO 13 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1v1c s LEU 14 N 2.05 5.88 0.00 2.45 1.43 -1.26 -4.93 118.68 124.30 1v1c s LEU 14 Ca 0.79 -1.89 0.00 0.00 -1.03 0.00 0.00 54.13 52.01 1v1c s LEU 14 Cb -0.51 -2.27 0.00 0.00 0.03 0.00 0.00 46.19 43.45 1v1c s LEU 14 CO 0.36 -0.92 0.00 0.61 0.23 0.00 0.00 176.35 176.63 1v1c n GLY 15 N 4.99 -0.37 3.27 -3.19 0.00 -1.26 -4.86 105.19 103.76 1v1c n GLY 15 Ca -0.02 -1.99 -0.44 0.00 0.00 0.00 0.00 46.02 43.57 1v1c n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v1c s ALA 16 N -2.00 3.63 -0.25 4.61 0.00 -1.26 -5.02 121.76 121.46 1v1c s ALA 16 Ca 0.00 -2.70 0.01 0.00 0.00 0.00 0.00 51.96 49.27 1v1c s ALA 16 Cb 0.00 -3.12 0.07 0.00 0.00 0.00 0.00 23.12 20.06 1v1c s ALA 16 CO 0.00 -2.03 -0.03 -1.21 0.00 0.00 0.00 175.76 172.49 1v1c s GLU 17 N 1.20 1.57 -0.67 0.00 2.02 -1.26 -5.08 118.70 116.48 1v1c s GLU 17 Ca 0.07 -1.11 -0.18 0.00 0.02 0.00 0.00 54.97 53.77 1v1c s GLU 17 Cb -0.25 -2.62 0.13 0.00 0.10 0.00 0.00 34.13 31.48 1v1c s GLU 17 CO -0.01 -0.66 0.77 -0.65 0.02 0.00 0.00 175.26 174.73 1v1c s GLN 18 N 1.35 3.20 0.00 1.61 -1.52 -1.26 -4.10 119.66 118.94 1v1c s GLN 18 Ca -0.03 -1.57 0.00 0.00 -1.95 0.00 0.00 55.36 51.81 1v1c s GLN 18 Cb -0.19 -4.38 0.00 0.00 -0.22 0.00 0.00 33.01 28.22 1v1c s GLN 18 CO -0.08 -1.53 0.00 -0.40 -0.25 0.00 0.00 175.29 173.03 1v1c n ASP 19 N 5.97 0.00 -4.96 5.90 5.75 -1.26 -5.15 116.55 122.80 1v1c n ASP 19 Ca -0.02 0.00 -0.22 0.00 -0.01 0.00 0.00 54.79 54.55 1v1c n ASP 19 Cb 0.44 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.52 1v1c n ASP 19 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1v1c s ALA 20 N 0.00 3.89 -0.19 2.12 0.00 -1.26 -2.73 121.76 123.59 1v1c s ALA 20 Ca 0.00 -1.14 -0.03 0.00 0.00 0.00 0.00 51.96 50.78 1v1c s ALA 20 Cb 0.00 -1.93 -0.02 0.00 0.00 0.00 0.00 23.12 21.17 1v1c s ALA 20 CO 0.00 -0.04 -0.05 -1.50 0.00 0.00 0.00 175.76 174.17 1v1c s ILE 21 N -2.26 3.58 -0.18 0.00 2.07 -1.26 -4.81 121.20 118.33 1v1c s ILE 21 Ca 0.42 -0.45 -0.28 0.00 -1.41 0.00 0.00 60.65 58.92 1v1c s ILE 21 Cb -0.10 -2.59 -0.05 0.00 0.13 0.00 0.00 42.46 39.85 1v1c s ILE 21 CO 0.34 0.46 2.10 -0.89 -1.91 0.00 0.00 174.94 175.03 1v1c s THR 22 N 0.92 3.09 0.36 4.00 2.01 -1.26 -4.94 115.64 119.82 1v1c s THR 22 Ca -0.00 0.10 0.08 0.00 0.31 0.00 0.00 61.69 62.18 1v1c s THR 22 Cb -0.15 -3.11 -0.04 0.00 0.01 0.00 0.00 72.50 69.22 1v1c s THR 22 CO 0.01 -0.06 0.21 -0.76 -0.69 0.00 0.00 174.62 173.33 1v1c s LEU 23 N 7.27 3.34 0.07 4.42 1.43 -1.15 -5.08 118.68 128.98 1v1c s LEU 23 Ca 0.95 -0.74 0.06 0.00 -1.03 0.00 0.00 54.13 53.37 1v1c s LEU 23 Cb -0.33 -1.86 -0.03 0.00 0.03 0.00 0.00 46.19 44.00 1v1c s LEU 23 CO 0.36 -0.38 -0.17 -0.13 0.23 0.00 0.00 176.35 176.26 1v1c s ARG 24 N -3.92 1.02 -0.68 1.70 0.52 -1.19 -4.40 118.95 112.00 1v1c s ARG 24 Ca 0.40 -0.95 -0.26 0.00 -0.52 0.00 0.00 55.73 54.40 1v1c s ARG 24 Cb -0.03 -1.12 -0.13 0.00 0.52 0.00 0.00 34.95 34.20 1v1c s ARG 24 CO 0.24 0.27 2.45 -1.91 0.02 0.00 0.00 175.30 176.36 1v1c n GLU 25 N 1.50 0.68 0.00 3.54 2.13 -1.21 -1.65 120.64 125.62 1v1c n GLU 25 Ca -0.19 -0.21 0.00 0.00 0.66 0.00 0.00 57.16 57.42 1v1c n GLU 25 Cb 0.54 -3.02 0.00 0.00 0.27 0.00 0.00 31.44 29.23 1v1c n GLU 25 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1v1c n GLY 26 N 6.24 1.84 3.85 8.31 0.00 0.17 -4.92 105.19 120.69 1v1c n GLY 26 Ca 0.46 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.14 1v1c n GLY 26 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1v1c s GLN 27 N -0.17 3.30 -0.17 1.61 -1.52 -0.66 -4.82 119.66 117.23 1v1c s GLN 27 Ca 0.00 -0.34 -0.07 0.00 -1.95 0.00 0.00 55.36 53.00 1v1c s GLN 27 Cb 0.00 -3.03 -0.04 0.00 -0.22 0.00 0.00 33.01 29.72 1v1c s GLN 27 CO 0.00 0.69 0.07 0.71 -0.25 0.00 0.00 175.29 176.50 1v1c s TYR 28 N -1.20 3.27 -0.29 0.91 2.02 -1.26 -2.71 117.35 118.09 1v1c s TYR 28 Ca 0.23 0.11 -0.12 0.00 -0.37 0.00 0.00 57.07 56.92 1v1c s TYR 28 Cb -0.12 -2.06 0.11 0.00 -0.40 0.00 0.00 41.96 39.49 1v1c s TYR 28 CO 0.13 0.21 0.65 0.54 -1.57 0.00 0.00 175.55 175.52 1v1c s VAL 29 N 0.22 -0.58 0.49 0.71 0.11 -1.17 -4.35 120.40 115.84 1v1c s VAL 29 Ca 0.04 0.01 -0.18 0.00 -2.93 0.00 0.00 61.98 58.92 1v1c s VAL 29 Cb -0.12 -0.98 -0.09 0.00 -1.53 0.00 0.00 36.38 33.66 1v1c s VAL 29 CO 0.00 0.00 0.98 -1.83 -3.33 0.00 0.00 175.10 170.92 1v1c s GLU 30 N 2.37 4.02 0.20 1.54 1.03 -1.26 -1.42 118.70 125.18 1v1c s GLU 30 Ca -0.07 1.00 -0.19 0.00 0.03 0.00 0.00 54.97 55.74 1v1c s GLU 30 Cb -0.09 -2.15 -0.08 0.00 -0.80 0.00 0.00 34.13 31.01 1v1c s GLU 30 CO -0.19 -0.21 0.68 0.54 -1.33 0.00 0.00 175.26 174.75 1v1c s VAL 31 N -2.51 4.63 -0.02 1.83 0.11 -0.51 -3.26 120.40 120.68 1v1c s VAL 31 Ca 0.60 1.19 -0.02 0.00 -2.93 0.00 0.00 61.98 60.82 1v1c s VAL 31 Cb -0.10 -3.84 -0.01 0.00 -1.53 0.00 0.00 36.38 30.91 1v1c s VAL 31 CO 0.27 0.23 -0.05 0.18 -3.33 0.00 0.00 175.10 172.40 1v1c n LEU 32 N 0.79 0.31 0.00 2.54 4.77 -0.12 -4.35 117.00 120.93 1v1c n LEU 32 Ca -0.03 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1v1c n LEU 32 Cb 0.51 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1v1c n LEU 32 CO 0.43 -0.48 0.39 -0.67 -1.33 0.00 0.00 177.39 175.73 1v1c n ASP 33 N -2.81 0.00 -2.92 -1.43 -0.08 -1.14 -4.98 116.55 103.20 1v1c n ASP 33 Ca -0.02 0.78 -0.09 0.00 -1.51 0.00 0.00 54.79 53.95 1v1c n ASP 33 Cb 0.07 -0.28 0.01 0.00 2.34 0.00 0.00 41.12 43.26 1v1c n ASP 33 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1v1c n ALA 34 N -1.42 -2.92 0.00 -1.67 0.00 -1.26 -4.93 120.51 108.30 1v1c n ALA 34 Ca 0.00 1.01 0.00 0.00 0.00 0.00 0.00 53.44 54.45 1v1c n ALA 34 Cb 0.00 -3.48 0.00 0.00 0.00 0.00 0.00 19.45 15.97 1v1c n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v1c n ALA 35 N -0.46 0.00 -2.57 0.00 0.00 -1.26 -5.10 120.51 111.12 1v1c n ALA 35 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.11 1v1c n ALA 35 Cb 0.48 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.88 1v1c n ALA 35 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1v1c s HIS 36 N -0.84 3.03 0.60 0.00 3.76 -1.26 -4.92 115.29 115.65 1v1c s HIS 36 Ca 0.00 0.46 0.29 0.00 -0.15 0.00 0.00 55.06 55.66 1v1c s HIS 36 Cb 0.00 -3.66 1.63 0.00 1.11 0.00 0.00 32.58 31.65 1v1c s HIS 36 CO 0.00 -0.91 2.04 -1.35 -0.85 0.00 0.00 174.74 173.67 1v1c h PRO 37 N 8.76 0.00 0.00 8.40 0.11 -2.04 -3.09 132.00 144.14 1v1c h PRO 37 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1v1c h PRO 37 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1v1c h PRO 37 CO 0.97 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 180.04 1v1c n LEU 38 N -3.68 0.25 -3.93 2.35 4.77 -1.26 -4.95 117.00 110.55 1v1c n LEU 38 Ca 0.03 0.70 -0.10 0.00 -0.03 0.00 0.00 56.01 56.61 1v1c n LEU 38 Cb 0.42 -0.39 -0.11 0.00 -2.33 0.00 0.00 43.42 41.01 1v1c n LEU 38 CO 0.26 -0.39 -0.29 0.00 -1.33 0.00 0.00 177.39 175.64 1v1c s ARG 39 N -1.87 0.35 0.06 3.23 1.70 -1.17 -4.65 118.95 116.60 1v1c s ARG 39 Ca 0.00 -0.47 0.07 0.00 -0.47 0.00 0.00 55.73 54.86 1v1c s ARG 39 Cb 0.00 0.13 -0.03 0.00 -0.57 0.00 0.00 34.95 34.48 1v1c s ARG 39 CO 0.00 -0.07 -0.17 -1.58 -1.08 0.00 0.00 175.30 172.40 1v1c s TRP 40 N -1.29 2.58 -0.30 5.89 0.51 -1.19 -4.50 118.94 120.65 1v1c s TRP 40 Ca -0.14 -0.24 -0.25 0.00 -2.12 0.00 0.00 56.10 53.35 1v1c s TRP 40 Cb -0.08 -1.44 0.01 0.00 -0.81 0.00 0.00 33.47 31.14 1v1c s TRP 40 CO 0.00 0.30 0.89 -1.17 -0.51 0.00 0.00 176.95 176.46 1v1c s LEU 41 N -1.64 4.05 0.13 2.99 2.96 -1.26 -2.84 118.68 123.06 1v1c s LEU 41 Ca 0.16 0.83 0.09 0.00 -0.22 0.00 0.00 54.13 54.98 1v1c s LEU 41 Cb -0.11 -3.24 -0.04 0.00 0.50 0.00 0.00 46.19 43.31 1v1c s LEU 41 CO 0.07 -0.69 -0.21 0.68 -1.32 0.00 0.00 176.35 174.89 1v1c s VAL 42 N 3.16 1.81 -0.06 1.68 -7.23 -1.13 -0.95 120.40 117.70 1v1c s VAL 42 Ca 0.37 -1.70 0.01 0.00 -1.81 0.00 0.00 61.98 58.84 1v1c s VAL 42 Cb -0.14 -1.71 0.02 0.00 0.56 0.00 0.00 36.38 35.12 1v1c s VAL 42 CO 0.13 -0.14 -0.06 0.00 -0.31 0.00 0.00 175.10 174.72 1v1c s ARG 43 N -2.25 1.07 0.61 4.82 1.70 -1.20 -1.44 118.95 122.26 1v1c s ARG 43 Ca 0.11 -0.17 -0.16 0.00 -0.47 0.00 0.00 55.73 55.04 1v1c s ARG 43 Cb -0.08 -1.05 -0.03 0.00 -0.57 0.00 0.00 34.95 33.22 1v1c s ARG 43 CO 0.05 -0.10 1.07 0.95 -1.08 0.00 0.00 175.30 176.20 1v1c s THR 44 N 1.04 3.62 0.30 4.99 -4.23 -0.99 -4.02 115.64 116.35 1v1c s THR 44 Ca -0.09 0.78 -0.29 0.00 -1.18 0.00 0.00 61.69 60.91 1v1c s THR 44 Cb -0.14 -3.30 -0.10 0.00 1.34 0.00 0.00 72.50 70.30 1v1c s THR 44 CO -0.00 -0.44 1.17 -0.54 -0.54 0.00 0.00 174.62 174.27 1v1c s LYS 45 N -4.02 4.54 -0.10 3.99 1.02 -1.26 -4.37 119.74 119.54 1v1c s LYS 45 Ca 0.65 1.94 -0.27 0.00 0.02 0.00 0.00 55.97 58.31 1v1c s LYS 45 Cb -0.18 -3.15 -0.02 0.00 -0.52 0.00 0.00 37.83 33.97 1v1c s LYS 45 CO 0.37 0.08 0.90 -1.25 -0.92 0.00 0.00 175.35 174.53 1v1c s PRO 46 N -1.57 4.41 -0.02 -1.68 0.04 -1.26 -4.96 135.00 129.96 1v1c s PRO 46 Ca 0.46 1.20 0.05 0.00 0.04 0.00 0.00 61.00 62.75 1v1c s PRO 46 Cb -0.35 -3.52 -0.01 0.00 0.04 0.00 0.00 34.50 30.66 1v1c s PRO 46 CO 0.45 -0.22 -0.16 -0.08 0.04 0.00 0.00 177.00 177.04 1v1c s THR 47 N 1.71 1.24 -1.04 1.26 -1.32 -1.26 -4.78 115.64 111.45 1v1c s THR 47 Ca 0.44 -0.66 -0.03 0.00 -1.21 0.00 0.00 61.69 60.22 1v1c s THR 47 Cb -0.18 -1.04 0.00 0.00 -1.51 0.00 0.00 72.50 69.77 1v1c s THR 47 CO 0.18 0.35 0.89 1.17 -2.21 0.00 0.00 174.62 175.00 1v1c n LYS 48 N 2.78 -5.94 -2.22 7.08 3.00 -1.26 -2.31 118.16 119.28 1v1c n LYS 48 Ca -0.15 0.69 -0.18 0.00 -0.00 0.00 0.00 58.31 58.67 1v1c n LYS 48 Cb 0.54 -5.26 -0.02 0.00 0.00 0.00 0.00 35.03 30.29 1v1c n LYS 48 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1v1c n SER 49 N -2.48 -5.12 -4.74 3.14 2.88 -1.26 -4.95 113.62 101.08 1v1c n SER 49 Ca -0.12 0.14 -0.40 0.00 -1.33 0.00 0.00 58.87 57.16 1v1c n SER 49 Cb 0.60 -4.35 -0.05 0.00 -0.75 0.00 0.00 64.21 59.66 1v1c n SER 49 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1v1c s SER 50 N -2.15 7.11 0.07 -3.46 0.15 -0.98 -5.01 113.70 109.44 1v1c s SER 50 Ca 0.00 1.33 -0.33 0.00 0.70 0.00 0.00 55.95 57.65 1v1c s SER 50 Cb 0.00 -2.43 -0.12 0.00 -1.71 0.00 0.00 66.02 61.76 1v1c s SER 50 CO 0.00 0.01 1.75 -0.81 1.20 0.00 0.00 173.24 175.40 1v1c n PRO 51 N 2.96 2.36 -2.06 5.44 -0.04 -1.26 -4.21 135.00 138.18 1v1c n PRO 51 Ca -0.03 0.86 -0.43 0.00 -0.04 0.00 0.00 63.50 63.85 1v1c n PRO 51 Cb 0.51 -2.69 -0.03 0.00 -0.04 0.00 0.00 33.50 31.25 1v1c n PRO 51 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1v1c s SER 52 N 2.45 6.24 0.41 3.54 1.04 -1.26 -4.92 113.70 121.20 1v1c s SER 52 Ca 0.84 1.59 -0.01 0.00 0.48 0.00 0.00 55.95 58.85 1v1c s SER 52 Cb -0.62 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 62.94 1v1c s SER 52 CO 0.42 -1.38 0.65 -0.13 0.98 0.00 0.00 173.24 173.78 1v1c s ARG 53 N 4.95 3.43 -0.14 4.02 0.52 -1.26 -4.97 118.95 125.49 1v1c s ARG 53 Ca 0.75 -0.18 -0.08 0.00 -0.52 0.00 0.00 55.73 55.69 1v1c s ARG 53 Cb -0.25 -2.55 0.05 0.00 0.52 0.00 0.00 34.95 32.72 1v1c s ARG 53 CO 0.31 -0.04 0.35 1.14 0.02 0.00 0.00 175.30 177.08 1v1c s GLN 54 N -4.49 0.34 0.12 3.54 -2.07 -1.26 -2.34 119.66 113.49 1v1c s GLN 54 Ca 0.44 0.66 -0.13 0.00 -1.82 0.00 0.00 55.36 54.51 1v1c s GLN 54 Cb -0.10 -0.02 0.02 0.00 -1.09 0.00 0.00 33.01 31.82 1v1c s GLN 54 CO 0.39 -0.14 0.32 0.20 -1.32 0.00 0.00 175.29 174.74 1v1c s GLY 55 N 1.17 -0.04 0.13 2.60 0.00 -0.52 -4.76 107.32 105.90 1v1c s GLY 55 Ca -0.08 -0.37 -0.30 0.00 0.00 0.00 0.00 44.72 43.97 1v1c s GLY 55 CO -0.09 -0.55 1.03 -0.98 0.00 0.00 0.00 173.10 172.51 1v1c s TRP 56 N -3.85 3.69 0.22 1.90 0.52 -1.11 -2.82 118.94 117.51 1v1c s TRP 56 Ca 0.06 1.68 0.03 0.00 0.02 0.00 0.00 56.10 57.89 1v1c s TRP 56 Cb 0.03 -3.17 -0.05 0.00 -1.15 0.00 0.00 33.47 29.13 1v1c s TRP 56 CO -0.10 -0.23 0.02 0.14 0.02 0.00 0.00 176.95 176.80 1v1c s VAL 57 N -0.01 0.85 -0.37 4.03 -7.23 -1.13 -4.21 120.40 112.34 1v1c s VAL 57 Ca 0.49 -2.01 -0.14 0.00 -1.81 0.00 0.00 61.98 58.50 1v1c s VAL 57 Cb -0.26 -2.35 -0.00 0.00 0.56 0.00 0.00 36.38 34.32 1v1c s VAL 57 CO 0.32 -0.30 0.31 -0.44 -0.31 0.00 0.00 175.10 174.68 1v1c s SER 58 N -3.28 6.12 0.00 4.85 0.01 -1.26 -3.18 113.70 116.96 1v1c s SER 58 Ca 0.29 -0.52 0.06 0.00 1.31 0.00 0.00 55.95 57.10 1v1c s SER 58 Cb 0.06 -2.17 0.29 0.00 0.21 0.00 0.00 66.02 64.42 1v1c s SER 58 CO 0.09 -0.35 1.09 -0.81 0.41 0.00 0.00 173.24 173.66 1v1c n PRO 59 N 5.24 0.06 0.15 12.44 -0.04 -1.26 -2.27 135.00 149.32 1v1c n PRO 59 Ca -0.11 0.28 0.12 0.00 -0.04 0.00 0.00 63.50 63.75 1v1c n PRO 59 Cb 0.49 -1.50 0.55 0.00 -0.04 0.00 0.00 33.50 32.99 1v1c n PRO 59 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1v1c h ALA 60 N 2.27 1.00 0.00 0.55 0.00 -1.92 -2.26 119.26 118.90 1v1c h ALA 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1v1c h ALA 60 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1v1c h ALA 60 CO 0.00 0.00 -0.05 0.66 0.00 0.00 0.00 179.25 179.86 1v1c n TYR 61 N -2.31 0.00 -4.68 0.00 4.01 -0.96 -5.04 117.16 108.19 1v1c n TYR 61 Ca 0.01 -0.56 -0.32 0.00 -0.16 0.00 0.00 57.90 56.87 1v1c n TYR 61 Cb 0.17 -0.08 -0.12 0.00 -0.31 0.00 0.00 39.34 39.00 1v1c n TYR 61 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1v1c s LEU 62 N -1.43 2.84 -0.16 7.72 1.02 -0.85 -4.17 118.68 123.65 1v1c s LEU 62 Ca 0.11 -0.25 0.00 0.00 0.02 0.00 0.00 54.13 54.01 1v1c s LEU 62 Cb 0.10 -1.63 0.03 0.00 0.02 0.00 0.00 46.19 44.70 1v1c s LEU 62 CO 0.01 0.30 -0.14 -0.62 0.02 0.00 0.00 176.35 175.92 1v1c s ASP 63 N -1.18 2.84 0.36 2.29 2.15 -1.22 -4.94 116.67 116.98 1v1c s ASP 63 Ca 0.14 -0.57 -0.28 0.00 0.43 0.00 0.00 52.55 52.27 1v1c s ASP 63 Cb -0.11 -1.21 -0.11 0.00 -0.30 0.00 0.00 42.92 41.19 1v1c s ASP 63 CO 0.04 -0.07 1.43 0.00 -0.17 0.00 0.00 175.17 176.41 1v1c s ARG 64 N 1.46 4.19 -0.07 4.34 1.70 -1.26 -1.42 118.95 127.88 1v1c s ARG 64 Ca 0.04 2.46 -0.04 0.00 -0.47 0.00 0.00 55.73 57.72 1v1c s ARG 64 Cb -0.13 -3.00 0.03 0.00 -0.57 0.00 0.00 34.95 31.28 1v1c s ARG 64 CO -0.10 -0.43 0.16 0.50 -1.08 0.00 0.00 175.30 174.34 1v1c s ARG 65 N -1.95 0.13 -0.63 3.89 6.06 -0.76 -4.91 118.95 120.79 1v1c s ARG 65 Ca 0.52 0.34 -0.11 0.00 -2.50 0.00 0.00 55.73 53.98 1v1c s ARG 65 Cb -0.44 -0.10 0.16 0.00 0.06 0.00 0.00 34.95 34.63 1v1c s ARG 65 CO 0.59 -0.12 0.53 -0.51 -2.50 0.00 0.00 175.30 173.29 1v1c s LEU 66 N 0.86 6.10 -0.06 -0.88 1.02 -1.26 -4.02 118.68 120.44 1v1c s LEU 66 Ca -0.06 -2.27 -0.00 0.00 0.02 0.00 0.00 54.13 51.81 1v1c s LEU 66 Cb -0.08 -2.10 0.02 0.00 0.02 0.00 0.00 46.19 44.05 1v1c s LEU 66 CO -0.04 -0.65 -0.02 -0.75 0.02 0.00 0.00 176.35 174.90 1v1c s LYS 67 N 0.82 0.73 0.00 1.70 2.36 -1.26 -5.18 119.74 118.92 1v1c s LYS 67 Ca 0.11 -0.01 0.00 0.00 -2.55 0.00 0.00 55.97 53.51 1v1c s LYS 67 Cb -0.21 -0.90 0.00 0.00 -1.05 0.00 0.00 37.83 35.67 1v1c s LYS 67 CO -0.03 -0.18 0.00 1.47 1.55 0.00 0.00 175.35 178.16