#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 -1.51 -3.97 4.28 3.72 -1.26 -4.59 117.46 114.12 1v1c n PHE 2 Ca 0.00 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.07 1v1c n PHE 2 Cb 0.00 0.23 -0.14 0.00 -0.94 0.00 0.00 39.48 38.62 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 -4.00 4.81 0.02 4.37 1.11 -1.26 -4.96 116.67 116.76 1v1c s ASP 3 Ca 0.00 -1.90 -0.25 0.00 0.18 0.00 0.00 52.55 50.58 1v1c s ASP 3 Cb 0.00 -1.66 -0.05 0.00 1.07 0.00 0.00 42.92 42.28 1v1c s ASP 3 CO 0.00 -0.36 0.78 -0.63 1.18 0.00 0.00 175.17 176.14 1v1c s ILE 4 N 1.02 4.81 0.20 0.77 1.01 -1.25 -1.38 121.20 126.38 1v1c s ILE 4 Ca 0.05 1.65 0.08 0.00 0.00 0.00 0.00 60.65 62.43 1v1c s ILE 4 Cb -0.20 -4.13 -0.04 0.00 0.01 0.00 0.00 42.46 38.10 1v1c s ILE 4 CO -0.06 0.32 0.00 -0.31 0.00 0.00 0.00 174.94 174.89 1v1c s TYR 5 N 0.25 2.80 -0.12 3.97 1.51 -0.57 -2.84 117.35 122.36 1v1c s TYR 5 Ca 0.40 -0.17 0.03 0.00 -1.01 0.00 0.00 57.07 56.32 1v1c s TYR 5 Cb -0.20 -1.32 0.00 0.00 -0.11 0.00 0.00 41.96 40.33 1v1c s TYR 5 CO 0.23 0.54 -0.22 0.54 -1.11 0.00 0.00 175.55 175.53 1v1c s VAL 6 N -1.91 2.14 -0.39 0.71 0.11 -1.13 -2.26 120.40 117.68 1v1c s VAL 6 Ca 0.28 -0.97 -0.29 0.00 -2.93 0.00 0.00 61.98 58.07 1v1c s VAL 6 Cb -0.08 -1.84 0.02 0.00 -1.53 0.00 0.00 36.38 32.95 1v1c s VAL 6 CO 0.19 0.55 1.09 -0.69 -3.33 0.00 0.00 175.10 172.92 1v1c s VAL 7 N 0.52 4.39 -0.17 2.04 1.01 -1.08 -3.02 120.40 124.09 1v1c s VAL 7 Ca -0.14 1.49 0.16 0.00 0.00 0.00 0.00 61.98 63.50 1v1c s VAL 7 Cb -0.17 -4.49 0.44 0.00 0.00 0.00 0.00 36.38 32.16 1v1c s VAL 7 CO 0.05 -0.71 1.19 0.35 0.00 0.00 0.00 175.10 175.98 1v1c n THR 8 N 6.29 1.50 -1.48 3.92 -2.24 -1.26 -0.08 114.28 120.93 1v1c n THR 8 Ca 0.12 -2.70 0.00 0.00 -2.27 0.00 0.00 64.05 59.20 1v1c n THR 8 Cb 0.48 0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 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 -0.51 0.39 -2.21 6.98 0.00 -1.26 -5.08 120.51 118.81 1v1c n ALA 9 Ca 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1v1c n ALA 9 Cb 0.88 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.33 1v1c n ALA 9 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1v1c n ASP 10 N 0.00 -9.04 -3.85 0.00 8.00 -1.26 -5.01 116.55 105.39 1v1c n ASP 10 Ca 0.00 1.67 -0.30 0.00 0.71 0.00 0.00 54.79 56.87 1v1c n ASP 10 Cb 0.35 -4.95 -0.15 0.00 -0.02 0.00 0.00 41.12 36.35 1v1c n ASP 10 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1v1c s TYR 11 N -0.55 2.30 -0.18 1.24 5.04 -1.26 -4.97 117.35 118.97 1v1c s TYR 11 Ca 0.00 -1.98 -0.00 0.00 -2.44 0.00 0.00 57.07 52.65 1v1c s TYR 11 Cb 0.00 -1.92 0.01 0.00 0.35 0.00 0.00 41.96 40.39 1v1c s TYR 11 CO 0.00 -0.85 -0.16 -1.17 -1.34 0.00 0.00 175.55 172.03 1v1c s LEU 12 N 1.41 2.39 0.35 6.97 2.96 -1.26 -3.83 118.68 127.67 1v1c s LEU 12 Ca 0.06 -0.54 -0.29 0.00 -0.22 0.00 0.00 54.13 53.14 1v1c s LEU 12 Cb -0.18 -1.55 -0.11 0.00 0.50 0.00 0.00 46.19 44.84 1v1c s LEU 12 CO -0.16 0.03 1.50 -2.65 -1.32 0.00 0.00 176.35 173.76 1v1c n PRO 13 N 4.42 2.64 -3.54 0.98 -0.02 -1.26 -4.97 135.00 133.24 1v1c n PRO 13 Ca -0.20 0.93 -0.41 0.00 -2.02 0.00 0.00 63.50 61.80 1v1c n PRO 13 Cb 0.51 -2.66 -0.08 0.00 -0.02 0.00 0.00 33.50 31.25 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 -1.53 5.80 0.00 2.45 1.43 -1.26 -4.96 118.68 120.61 1v1c s LEU 14 Ca 0.56 -2.22 0.00 0.00 -1.03 0.00 0.00 54.13 51.45 1v1c s LEU 14 Cb -0.49 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 43.71 1v1c s LEU 14 CO 0.59 -0.62 0.00 0.61 0.23 0.00 0.00 176.35 177.17 1v1c n GLY 15 N 4.50 0.15 3.02 -3.19 0.00 -1.26 -4.95 105.19 103.46 1v1c n GLY 15 Ca -0.02 -1.79 -0.31 0.00 0.00 0.00 0.00 46.02 43.90 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 2.37 -0.27 4.61 0.00 -1.26 -5.09 121.76 120.12 1v1c s ALA 16 Ca 0.00 -1.66 -0.04 0.00 0.00 0.00 0.00 51.96 50.26 1v1c s ALA 16 Cb 0.00 -1.55 0.02 0.00 0.00 0.00 0.00 23.12 21.59 1v1c s ALA 16 CO 0.00 -1.22 -0.00 -1.21 0.00 0.00 0.00 175.76 173.33 1v1c s GLU 17 N 1.20 2.97 0.44 0.00 0.41 -1.26 -5.10 118.70 117.35 1v1c s GLU 17 Ca -0.07 -0.91 -0.22 0.00 -0.41 0.00 0.00 54.97 53.36 1v1c s GLU 17 Cb -0.20 -3.14 -0.09 0.00 -1.78 0.00 0.00 34.13 28.92 1v1c s GLU 17 CO -0.06 -0.41 1.02 -0.65 -0.49 0.00 0.00 175.26 174.68 1v1c s GLN 18 N 1.40 4.04 -1.99 1.61 1.11 -1.26 -3.30 119.66 121.27 1v1c s GLN 18 Ca 0.01 1.37 0.00 0.00 0.01 0.00 0.00 55.36 56.75 1v1c s GLN 18 Cb -0.17 -2.30 0.00 0.00 -1.01 0.00 0.00 33.01 29.54 1v1c s GLN 18 CO -0.02 -0.23 0.00 -0.25 0.01 0.00 0.00 175.29 174.81 1v1c n ASP 19 N -0.53 -4.96 -4.90 5.90 8.00 -1.26 -4.86 116.55 113.93 1v1c n ASP 19 Ca 0.07 0.46 -0.20 0.00 0.71 0.00 0.00 54.79 55.83 1v1c n ASP 19 Cb 0.52 -4.43 -0.02 0.00 -0.02 0.00 0.00 41.12 37.17 1v1c n ASP 19 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1v1c s ALA 20 N -2.60 4.17 -0.01 2.24 0.00 -1.21 -1.66 121.76 122.70 1v1c s ALA 20 Ca 0.00 -1.84 0.01 0.00 0.00 0.00 0.00 51.96 50.13 1v1c s ALA 20 Cb 0.00 -1.12 0.01 0.00 0.00 0.00 0.00 23.12 22.01 1v1c s ALA 20 CO 0.00 -0.26 -0.02 -1.50 0.00 0.00 0.00 175.76 173.97 1v1c s ILE 21 N -2.47 0.24 0.46 0.00 2.07 -1.26 -4.63 121.20 115.62 1v1c s ILE 21 Ca 0.49 -0.09 -0.22 0.00 -1.41 0.00 0.00 60.65 59.42 1v1c s ILE 21 Cb -0.04 -0.24 -0.08 0.00 0.13 0.00 0.00 42.46 42.23 1v1c s ILE 21 CO 0.29 0.09 1.12 0.28 -1.91 0.00 0.00 174.94 174.81 1v1c s THR 22 N 0.20 3.33 0.11 4.00 -1.32 -1.26 -4.92 115.64 115.79 1v1c s THR 22 Ca -0.02 0.96 0.04 0.00 -1.21 0.00 0.00 61.69 61.46 1v1c s THR 22 Cb -0.05 -3.47 -0.04 0.00 -1.51 0.00 0.00 72.50 67.44 1v1c s THR 22 CO -0.00 -0.05 -0.11 -0.76 -2.21 0.00 0.00 174.62 171.49 1v1c s LEU 23 N -3.09 2.43 -0.00 9.08 1.43 -1.25 -5.13 118.68 122.15 1v1c s LEU 23 Ca 0.64 -0.85 0.01 0.00 -1.03 0.00 0.00 54.13 52.90 1v1c s LEU 23 Cb -0.25 -0.36 -0.00 0.00 0.03 0.00 0.00 46.19 45.60 1v1c s LEU 23 CO 0.30 -0.25 -0.03 -0.13 0.23 0.00 0.00 176.35 176.47 1v1c s ARG 24 N -2.96 0.28 -0.40 1.70 1.81 -1.26 -4.48 118.95 113.63 1v1c s ARG 24 Ca 0.08 -0.12 -0.27 0.00 -1.72 0.00 0.00 55.73 53.70 1v1c s ARG 24 Cb -0.02 -0.27 -0.07 0.00 -0.45 0.00 0.00 34.95 34.14 1v1c s ARG 24 CO 0.01 0.07 2.35 -1.91 -0.68 0.00 0.00 175.30 175.14 1v1c n GLU 25 N 3.00 1.34 0.00 3.54 2.13 -1.26 -1.74 120.64 127.65 1v1c n GLU 25 Ca -0.13 0.20 0.00 0.00 0.66 0.00 0.00 57.16 57.89 1v1c n GLU 25 Cb 0.59 -3.29 0.00 0.00 0.27 0.00 0.00 31.44 29.01 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 5.97 0.42 3.91 8.31 0.00 0.89 -4.95 105.19 119.73 1v1c n GLY 26 Ca 0.36 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.12 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 0.00 3.30 -0.02 1.61 -0.21 -0.71 -4.90 119.66 118.74 1v1c s GLN 27 Ca 0.00 -0.69 0.07 0.00 0.02 0.00 0.00 55.36 54.76 1v1c s GLN 27 Cb 0.00 -2.87 -0.02 0.00 1.00 0.00 0.00 33.01 31.11 1v1c s GLN 27 CO 0.00 0.50 -0.23 0.71 -2.12 0.00 0.00 175.29 174.15 1v1c s TYR 28 N -1.78 2.43 -0.28 0.91 2.02 -1.26 -2.65 117.35 116.74 1v1c s TYR 28 Ca 0.34 -0.36 -0.12 0.00 -0.37 0.00 0.00 57.07 56.56 1v1c s TYR 28 Cb -0.11 -1.52 0.11 0.00 -0.40 0.00 0.00 41.96 40.04 1v1c s TYR 28 CO 0.27 0.04 0.64 0.54 -1.57 0.00 0.00 175.55 175.47 1v1c s VAL 29 N -0.67 -0.59 0.55 0.71 0.11 -0.96 -4.30 120.40 115.26 1v1c s VAL 29 Ca 0.11 0.02 -0.17 0.00 -2.93 0.00 0.00 61.98 59.00 1v1c s VAL 29 Cb -0.10 -0.96 -0.05 0.00 -1.53 0.00 0.00 36.38 33.74 1v1c s VAL 29 CO -0.00 0.01 1.05 -1.83 -3.33 0.00 0.00 175.10 170.99 1v1c s GLU 30 N 2.38 3.52 0.06 1.54 -1.05 -1.25 -1.51 118.70 122.38 1v1c s GLU 30 Ca -0.07 1.23 -0.09 0.00 -0.15 0.00 0.00 54.97 55.89 1v1c s GLU 30 Cb -0.09 -2.06 -0.06 0.00 -0.44 0.00 0.00 34.13 31.48 1v1c s GLU 30 CO -0.19 -0.65 0.37 0.54 0.95 0.00 0.00 175.26 176.28 1v1c s VAL 31 N -2.32 5.14 0.00 1.83 0.11 -0.48 -2.35 120.40 122.33 1v1c s VAL 31 Ca 0.64 0.41 0.00 0.00 -2.93 0.00 0.00 61.98 60.10 1v1c s VAL 31 Cb -0.16 -3.63 0.00 0.00 -1.53 0.00 0.00 36.38 31.06 1v1c s VAL 31 CO 0.31 0.33 0.00 0.18 -3.33 0.00 0.00 175.10 172.59 1v1c n LEU 32 N 1.02 0.00 0.00 2.54 4.77 -0.50 -4.39 117.00 120.44 1v1c n LEU 32 Ca -0.09 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 1v1c n LEU 32 Cb 0.52 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1v1c n LEU 32 CO 0.42 -0.43 0.29 -0.67 -1.33 0.00 0.00 177.39 175.67 1v1c n ASP 33 N -2.34 0.00 -2.60 -1.43 2.03 -1.03 -5.00 116.55 106.18 1v1c n ASP 33 Ca 0.00 0.58 -0.02 0.00 0.52 0.00 0.00 54.79 55.87 1v1c n ASP 33 Cb 0.00 -0.10 0.00 0.00 -0.72 0.00 0.00 41.12 40.30 1v1c n ASP 33 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1v1c n ALA 34 N -0.80 -3.33 -0.39 -1.67 0.00 -1.26 -4.97 120.51 108.09 1v1c n ALA 34 Ca 0.00 0.60 0.00 0.00 0.00 0.00 0.00 53.44 54.04 1v1c n ALA 34 Cb 0.00 -1.53 0.00 0.00 0.00 0.00 0.00 19.45 17.92 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 0.37 2.22 -2.68 0.00 0.00 -1.26 -5.09 120.51 114.06 1v1c n ALA 35 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.06 1v1c n ALA 35 Cb 0.11 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.52 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 -0.61 3.46 0.63 0.00 3.76 -1.26 -4.93 115.29 116.34 1v1c s HIS 36 Ca 0.00 1.30 0.28 0.00 -0.15 0.00 0.00 55.06 56.48 1v1c s HIS 36 Cb 0.00 -3.00 1.45 0.00 1.11 0.00 0.00 32.58 32.14 1v1c s HIS 36 CO 0.00 -0.18 1.84 -1.35 -0.85 0.00 0.00 174.74 174.20 1v1c h PRO 37 N 7.21 0.00 0.25 8.40 0.11 -2.02 -2.75 132.00 143.20 1v1c h PRO 37 Ca -0.32 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.78 1v1c h PRO 37 Cb 1.15 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1v1c h PRO 37 CO 0.82 0.00 -0.17 -0.07 -0.21 0.00 0.00 178.00 178.37 1v1c h LEU 38 N 0.00 -0.44 -7.62 2.35 -0.00 -1.96 -3.43 115.31 104.21 1v1c h LEU 38 Ca 0.12 0.03 -0.16 0.00 -0.00 0.00 0.00 57.88 57.86 1v1c h LEU 38 Cb 1.05 0.13 -0.24 0.00 -0.00 0.00 0.00 40.66 41.60 1v1c h LEU 38 CO -0.00 -0.25 -0.49 0.00 -0.00 0.00 0.00 178.44 177.70 1v1c s ARG 39 N -3.99 0.34 0.18 1.13 1.70 -1.04 -4.56 118.95 112.71 1v1c s ARG 39 Ca -0.06 -0.01 0.10 0.00 -0.47 0.00 0.00 55.73 55.29 1v1c s ARG 39 Cb 0.01 0.15 -0.04 0.00 -0.57 0.00 0.00 34.95 34.50 1v1c s ARG 39 CO 0.20 -0.07 -0.22 -1.58 -1.08 0.00 0.00 175.30 172.56 1v1c s TRP 40 N -0.52 2.09 -0.58 5.89 0.51 -0.65 -4.46 118.94 121.22 1v1c s TRP 40 Ca -0.06 -0.40 -0.20 0.00 -2.12 0.00 0.00 56.10 53.31 1v1c s TRP 40 Cb -0.04 -1.04 0.08 0.00 -0.81 0.00 0.00 33.47 31.66 1v1c s TRP 40 CO 0.01 0.42 0.77 -1.17 -0.51 0.00 0.00 176.95 176.47 1v1c s LEU 41 N -2.63 4.89 0.11 2.99 2.96 -1.26 -1.57 118.68 124.18 1v1c s LEU 41 Ca 0.18 -1.07 0.05 0.00 -0.22 0.00 0.00 54.13 53.07 1v1c s LEU 41 Cb -0.07 -2.42 -0.04 0.00 0.50 0.00 0.00 46.19 44.15 1v1c s LEU 41 CO 0.08 -1.15 0.05 0.68 -1.32 0.00 0.00 176.35 174.69 1v1c s VAL 42 N 3.15 4.23 -0.17 1.68 -7.23 -1.08 -1.41 120.40 119.56 1v1c s VAL 42 Ca 0.17 -0.99 -0.00 0.00 -1.81 0.00 0.00 61.98 59.34 1v1c s VAL 42 Cb -0.20 -3.06 0.04 0.00 0.56 0.00 0.00 36.38 33.72 1v1c s VAL 42 CO 0.10 0.05 -0.05 -0.60 -0.31 0.00 0.00 175.10 174.29 1v1c s ARG 43 N -2.56 1.42 0.10 4.82 3.52 -0.99 -1.49 118.95 123.76 1v1c s ARG 43 Ca 0.28 -0.55 -0.34 0.00 -0.13 0.00 0.00 55.73 54.99 1v1c s ARG 43 Cb -0.11 -2.06 -0.14 0.00 -1.56 0.00 0.00 34.95 31.09 1v1c s ARG 43 CO 0.20 -0.45 1.63 0.25 -0.81 0.00 0.00 175.30 176.13 1v1c n THR 44 N 4.87 0.13 -2.40 4.11 -2.24 -0.98 -3.90 114.28 113.87 1v1c n THR 44 Ca -0.12 -0.02 -0.43 0.00 -2.27 0.00 0.00 64.05 61.21 1v1c n THR 44 Cb 0.47 -1.57 -0.02 0.00 -2.10 0.00 0.00 70.33 67.11 1v1c n THR 44 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1v1c s LYS 45 N 1.61 4.27 0.42 -0.78 -2.85 -1.26 -4.36 119.74 116.79 1v1c s LYS 45 Ca 0.82 1.71 -0.07 0.00 -1.00 0.00 0.00 55.97 57.44 1v1c s LYS 45 Cb -0.70 -3.70 0.10 0.00 -2.06 0.00 0.00 37.83 31.47 1v1c s LYS 45 CO 0.42 -0.62 0.57 -0.35 0.10 0.00 0.00 175.35 175.47 1v1c n PRO 46 N 6.10 -0.49 0.00 1.78 -0.04 -1.26 -5.01 135.00 136.07 1v1c n PRO 46 Ca 0.13 -0.93 0.00 0.00 -0.04 0.00 0.00 63.50 62.66 1v1c n PRO 46 Cb 0.45 -0.58 0.00 0.00 -0.04 0.00 0.00 33.50 33.34 1v1c n PRO 46 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1v1c n THR 47 N -2.74 0.00 0.00 0.52 5.66 -1.26 -4.98 114.28 111.48 1v1c n THR 47 Ca 0.07 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.07 1v1c n THR 47 Cb 0.26 -0.38 0.00 0.00 -1.55 0.00 0.00 70.33 68.65 1v1c n THR 47 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1v1c n LYS 48 N -2.21 0.00 0.00 1.09 4.81 -1.26 -4.96 118.16 115.63 1v1c n LYS 48 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1v1c n LYS 48 Cb 0.02 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.07 1v1c n LYS 48 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1v1c n SER 49 N 0.00 0.00 -4.60 3.14 3.41 -1.26 -5.08 113.62 109.23 1v1c n SER 49 Ca 0.00 -0.13 -0.43 0.00 -0.26 0.00 0.00 58.87 58.05 1v1c n SER 49 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1v1c n SER 49 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1v1c s SER 50 N 0.00 6.67 -0.07 4.04 0.15 -1.26 -4.98 113.70 118.25 1v1c s SER 50 Ca 0.00 0.53 -0.29 0.00 0.70 0.00 0.00 55.95 56.89 1v1c s SER 50 Cb 0.00 -2.50 -0.07 0.00 -1.71 0.00 0.00 66.02 61.73 1v1c s SER 50 CO 0.00 -1.03 2.08 -0.81 1.20 0.00 0.00 173.24 174.68 1v1c n PRO 51 N 7.23 2.50 -2.84 5.44 -0.04 -1.26 -4.43 135.00 141.60 1v1c n PRO 51 Ca 0.09 0.84 -0.42 0.00 -0.04 0.00 0.00 63.50 63.97 1v1c n PRO 51 Cb 0.48 -3.11 -0.04 0.00 -0.04 0.00 0.00 33.50 30.79 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 6.08 6.80 0.11 3.54 1.04 -1.26 -4.95 113.70 125.05 1v1c s SER 52 Ca 0.94 0.90 0.08 0.00 0.48 0.00 0.00 55.95 58.34 1v1c s SER 52 Cb -0.39 -2.45 -0.04 0.00 0.10 0.00 0.00 66.02 63.24 1v1c s SER 52 CO 0.39 -0.65 -0.19 -0.13 0.98 0.00 0.00 173.24 173.64 1v1c s ARG 53 N 3.09 1.08 -0.11 4.02 1.81 -1.26 -4.95 118.95 122.63 1v1c s ARG 53 Ca 0.37 -1.17 0.01 0.00 -1.72 0.00 0.00 55.73 53.22 1v1c s ARG 53 Cb -0.14 -1.25 -0.01 0.00 -0.45 0.00 0.00 34.95 33.10 1v1c s ARG 53 CO 0.11 0.28 -0.16 -0.65 -0.68 0.00 0.00 175.30 174.20 1v1c s GLN 54 N -2.06 3.20 -0.01 3.54 1.11 -1.26 -2.33 119.66 121.86 1v1c s GLN 54 Ca 0.06 -0.74 -0.17 0.00 0.01 0.00 0.00 55.36 54.53 1v1c s GLN 54 Cb -0.09 -2.52 0.03 0.00 -1.01 0.00 0.00 33.01 29.42 1v1c s GLN 54 CO 0.04 0.25 0.36 0.20 0.01 0.00 0.00 175.29 176.15 1v1c s GLY 55 N 0.23 -0.20 -0.14 3.09 0.00 -0.56 -4.67 107.32 105.07 1v1c s GLY 55 Ca -0.10 0.39 -0.29 0.00 0.00 0.00 0.00 44.72 44.71 1v1c s GLY 55 CO 0.06 0.16 1.18 -0.98 0.00 0.00 0.00 173.10 173.52 1v1c s TRP 56 N -1.55 3.09 0.32 1.90 0.52 -0.66 -2.63 118.94 119.92 1v1c s TRP 56 Ca -0.12 1.20 0.03 0.00 0.02 0.00 0.00 56.10 57.23 1v1c s TRP 56 Cb -0.04 -3.41 -0.05 0.00 -1.15 0.00 0.00 33.47 28.82 1v1c s TRP 56 CO 0.03 -1.24 0.09 0.14 0.02 0.00 0.00 176.95 176.00 1v1c s VAL 57 N 2.97 0.79 -0.30 4.03 -7.23 -0.61 -4.41 120.40 115.65 1v1c s VAL 57 Ca 0.52 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.54 1v1c s VAL 57 Cb -0.21 -2.64 -0.03 0.00 0.56 0.00 0.00 36.38 34.07 1v1c s VAL 57 CO 0.15 0.00 0.39 -0.94 -0.31 0.00 0.00 175.10 174.39 1v1c s SER 58 N -3.44 6.24 0.00 4.85 1.04 -1.26 -1.63 113.70 119.50 1v1c s SER 58 Ca 0.35 0.12 0.20 0.00 0.48 0.00 0.00 55.95 57.10 1v1c s SER 58 Cb 0.07 -2.21 0.97 0.00 0.10 0.00 0.00 66.02 64.94 1v1c s SER 58 CO 0.15 -0.26 1.62 -0.81 0.98 0.00 0.00 173.24 174.93 1v1c n PRO 59 N 5.40 0.22 0.07 4.02 -0.04 -1.26 -3.10 135.00 140.31 1v1c n PRO 59 Ca -0.08 0.11 -0.00 0.00 -0.04 0.00 0.00 63.50 63.49 1v1c n PRO 59 Cb 0.50 -1.50 0.30 0.00 -0.04 0.00 0.00 33.50 32.76 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 2.88 1.32 -0.51 0.55 0.00 -1.90 -2.06 119.26 119.53 1v1c h ALA 60 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1v1c h ALA 60 Cb 0.22 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1v1c h ALA 60 CO 0.00 0.46 0.00 0.66 0.00 0.00 0.00 179.25 180.37 1v1c n TYR 61 N -4.19 0.68 -4.36 0.00 4.01 -1.18 -4.89 117.16 107.23 1v1c n TYR 61 Ca -0.00 -0.34 -0.30 0.00 -0.16 0.00 0.00 57.90 57.09 1v1c n TYR 61 Cb 0.34 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.26 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 -1.02 2.94 -0.12 7.72 1.02 -0.78 -4.28 118.68 124.18 1v1c s LEU 62 Ca 0.34 -0.37 -0.01 0.00 0.02 0.00 0.00 54.13 54.11 1v1c s LEU 62 Cb 0.18 -1.74 -0.02 0.00 0.02 0.00 0.00 46.19 44.62 1v1c s LEU 62 CO 0.24 0.21 -0.08 -0.62 0.02 0.00 0.00 176.35 176.12 1v1c s ASP 63 N -1.92 4.48 0.22 2.29 2.15 -1.17 -4.96 116.67 117.77 1v1c s ASP 63 Ca 0.19 -0.16 -0.32 0.00 0.43 0.00 0.00 52.55 52.70 1v1c s ASP 63 Cb -0.11 -1.49 -0.12 0.00 -0.30 0.00 0.00 42.92 40.90 1v1c s ASP 63 CO 0.11 0.24 1.71 -0.13 -0.17 0.00 0.00 175.17 176.92 1v1c s ARG 64 N -0.06 4.12 -0.22 4.34 0.52 -1.26 -2.84 118.95 123.54 1v1c s ARG 64 Ca -0.00 2.61 -0.03 0.00 -0.52 0.00 0.00 55.73 57.79 1v1c s ARG 64 Cb -0.13 -3.06 0.07 0.00 0.52 0.00 0.00 34.95 32.34 1v1c s ARG 64 CO 0.03 -0.74 0.08 0.50 0.02 0.00 0.00 175.30 175.18 1v1c s ARG 65 N 0.92 0.40 -0.07 3.54 6.06 -1.13 -4.94 118.95 123.73 1v1c s ARG 65 Ca 0.73 -0.41 0.05 0.00 -2.50 0.00 0.00 55.73 53.60 1v1c s ARG 65 Cb -0.50 -1.85 -0.00 0.00 0.06 0.00 0.00 34.95 32.66 1v1c s ARG 65 CO 0.35 -0.76 -0.23 -0.51 -2.50 0.00 0.00 175.30 171.65 1v1c s LEU 66 N 1.96 2.03 0.00 -0.88 1.43 -1.26 -3.96 118.68 117.99 1v1c s LEU 66 Ca 0.03 -0.49 0.00 0.00 -1.03 0.00 0.00 54.13 52.64 1v1c s LEU 66 Cb -0.17 -1.29 0.00 0.00 0.03 0.00 0.00 46.19 44.77 1v1c s LEU 66 CO -0.15 0.19 0.00 2.29 0.23 0.00 0.00 176.35 178.91 1v1c n LYS 67 N 3.21 0.00 -0.44 1.70 2.85 -1.26 -5.17 118.16 119.05 1v1c n LYS 67 Ca -0.18 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.08 1v1c n LYS 67 Cb 0.52 -0.01 0.00 0.00 -0.65 0.00 0.00 35.03 34.89 1v1c n LYS 67 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63