#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o7c s VAL 2 N 0.00 4.76 0.28 1.61 0.11 -1.26 -2.79 120.40 123.11 1o7c s VAL 2 Ca 0.00 1.27 0.03 0.00 -2.93 0.00 0.00 61.98 60.35 1o7c s VAL 2 Cb 0.00 -3.93 -0.01 0.00 -1.53 0.00 0.00 36.38 30.91 1o7c s VAL 2 CO 0.00 0.51 0.31 0.00 -3.33 0.00 0.00 175.10 172.59 1o7c n TYR 3 N 2.04 -0.95 -3.88 1.54 4.11 -0.24 -4.98 117.16 114.81 1o7c n TYR 3 Ca -0.09 -2.14 -0.21 0.00 -0.00 0.00 0.00 57.90 55.47 1o7c n TYR 3 Cb 0.51 0.34 -0.02 0.00 -0.00 0.00 0.00 39.34 40.17 1o7c n TYR 3 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.86 175.28 1o7c s HIS 4 N -3.19 3.26 -0.10 -3.48 5.65 -1.26 -0.24 115.29 115.94 1o7c s HIS 4 Ca 0.29 -0.11 -0.18 0.00 0.25 0.00 0.00 55.06 55.31 1o7c s HIS 4 Cb 0.00 -1.65 0.04 0.00 -1.18 0.00 0.00 32.58 29.80 1o7c s HIS 4 CO 0.20 0.34 0.44 1.03 -0.65 0.00 0.00 174.74 176.11 1o7c s ARG 5 N -4.00 0.66 0.46 2.88 1.81 0.10 -4.76 118.95 116.10 1o7c s ARG 5 Ca 0.37 0.31 0.06 0.00 -1.72 0.00 0.00 55.73 54.74 1o7c s ARG 5 Cb -0.09 0.31 -0.03 0.00 -0.45 0.00 0.00 34.95 34.69 1o7c s ARG 5 CO 0.28 -0.14 0.15 -2.00 -0.68 0.00 0.00 175.30 172.91 1o7c s GLU 6 N -0.49 2.18 0.43 3.54 2.12 -1.26 -2.00 118.70 123.21 1o7c s GLU 6 Ca -0.06 -2.04 -0.08 0.00 0.36 0.00 0.00 54.97 53.15 1o7c s GLU 6 Cb -0.03 -1.84 -0.05 0.00 0.26 0.00 0.00 34.13 32.46 1o7c s GLU 6 CO 0.03 -0.24 0.76 0.00 -0.54 0.00 0.00 175.26 175.27 1o7c s ALA 7 N -2.71 3.40 0.35 6.30 0.00 -1.25 -4.97 121.76 122.89 1o7c s ALA 7 Ca 0.31 -0.38 0.35 0.00 0.00 0.00 0.00 51.96 52.24 1o7c s ALA 7 Cb 0.03 -2.61 1.68 0.00 0.00 0.00 0.00 23.12 22.22 1o7c s ALA 7 CO 0.17 -0.15 2.11 0.00 0.00 0.00 0.00 175.76 177.90 1o7c h ARG 8 N 0.81 0.00 0.00 0.00 -0.00 -2.00 -2.09 114.38 111.10 1o7c h ARG 8 Ca -0.47 0.00 -0.11 0.00 -0.50 0.00 0.00 59.98 58.90 1o7c h ARG 8 Cb 1.20 0.00 -0.02 0.00 0.00 0.00 0.00 29.97 31.15 1o7c h ARG 8 CO 0.63 0.04 -1.39 0.43 0.00 0.00 0.00 179.97 179.69 1o7c n SER 9 N -3.25 0.75 0.00 7.04 7.64 -1.26 -5.07 113.62 119.47 1o7c n SER 9 Ca -0.01 0.31 0.00 0.00 1.01 0.00 0.00 58.87 60.18 1o7c n SER 9 Cb 0.23 0.44 0.00 0.00 -1.01 0.00 0.00 64.21 63.87 1o7c n SER 9 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1o7c n GLY 10 N 1.34 3.44 3.64 0.23 0.00 -0.79 -5.10 105.19 107.94 1o7c n GLY 10 Ca -0.07 -1.70 -0.32 0.00 0.00 0.00 0.00 46.02 43.92 1o7c n GLY 10 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1o7c n LYS 11 N -1.94 -0.16 -3.44 1.61 4.81 -1.26 -3.72 118.16 114.05 1o7c n LYS 11 Ca 0.00 0.02 -0.19 0.00 -0.87 0.00 0.00 58.31 57.27 1o7c n LYS 11 Cb 0.00 -2.31 0.06 0.00 0.02 0.00 0.00 35.03 32.80 1o7c n LYS 11 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1o7c n TYR 12 N -3.73 -2.21 -1.66 5.64 4.02 -0.37 -4.89 117.16 113.96 1o7c n TYR 12 Ca 0.12 0.80 0.00 0.00 -0.01 0.00 0.00 57.90 58.81 1o7c n TYR 12 Cb 0.51 -4.27 0.00 0.00 -0.02 0.00 0.00 39.34 35.56 1o7c n TYR 12 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1o7c n LYS 13 N -3.78 0.00 -4.05 -0.72 5.02 -0.59 -4.31 118.16 109.72 1o7c n LYS 13 Ca -0.16 -0.03 -0.36 0.00 -2.02 0.00 0.00 58.31 55.74 1o7c n LYS 13 Cb 0.64 -0.17 -0.08 0.00 -0.02 0.00 0.00 35.03 35.40 1o7c n LYS 13 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1o7c s LEU 14 N 0.00 3.99 0.14 -0.35 1.43 -1.04 -4.79 118.68 118.05 1o7c s LEU 14 Ca 0.00 0.26 0.05 0.00 -1.03 0.00 0.00 54.13 53.41 1o7c s LEU 14 Cb 0.00 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 1o7c s LEU 14 CO 0.00 0.33 0.06 0.42 0.23 0.00 0.00 176.35 177.39 1o7c s THR 15 N -0.54 4.18 0.28 5.49 -4.23 -1.26 -1.94 115.64 117.63 1o7c s THR 15 Ca 0.11 -1.10 0.09 0.00 -1.18 0.00 0.00 61.69 59.61 1o7c s THR 15 Cb -0.12 -3.07 0.32 0.00 1.34 0.00 0.00 72.50 70.97 1o7c s THR 15 CO 0.02 -0.02 1.31 0.00 -0.54 0.00 0.00 174.62 175.39 1o7c n TYR 16 N 0.05 0.74 -0.06 3.99 9.36 -1.22 0.21 117.16 130.24 1o7c n TYR 16 Ca -0.09 0.99 -0.16 0.00 3.32 0.00 0.00 57.90 61.97 1o7c n TYR 16 Cb 0.54 -1.26 -0.05 0.00 -0.63 0.00 0.00 39.34 37.94 1o7c n TYR 16 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1o7c h ALA 17 N 1.67 0.42 -0.08 2.98 0.00 -1.95 -1.41 119.26 120.89 1o7c h ALA 17 Ca 0.60 -0.55 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1o7c h ALA 17 Cb 1.44 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 1o7c h ALA 17 CO -0.72 0.68 -0.11 0.93 0.00 0.00 0.00 179.25 180.04 1o7c h GLU 18 N 0.63 0.21 -0.49 0.00 5.08 0.21 -1.36 114.58 118.86 1o7c h GLU 18 Ca -0.01 -0.12 0.06 0.00 -1.00 0.00 0.00 59.36 58.29 1o7c h GLU 18 Cb 1.24 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.45 1o7c h GLU 18 CO 0.14 0.68 0.19 0.00 -1.00 0.00 0.00 179.01 179.02 1o7c h ALA 19 N 0.53 0.60 0.00 3.43 0.00 0.14 -0.52 119.26 123.45 1o7c h ALA 19 Ca 0.01 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1o7c h ALA 19 Cb 0.65 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1o7c h ALA 19 CO 0.03 -0.19 -0.30 -0.22 0.00 0.00 0.00 179.25 178.56 1o7c h LYS 20 N 0.38 0.00 -0.62 0.00 3.11 -1.25 -2.69 116.57 115.50 1o7c h LYS 20 Ca 0.23 0.00 -0.09 0.00 -2.81 0.00 0.00 60.65 57.98 1o7c h LYS 20 Cb 0.22 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.42 1o7c h LYS 20 CO -0.22 0.30 0.04 0.00 -2.81 0.00 0.00 179.45 176.77 1o7c h ALA 21 N 1.70 0.90 0.14 5.00 0.00 0.07 0.28 119.26 127.35 1o7c h ALA 21 Ca -0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1o7c h ALA 21 Cb 0.55 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1o7c h ALA 21 CO 0.04 0.66 -0.07 0.28 0.00 0.00 0.00 179.25 180.16 1o7c h VAL 22 N 0.98 1.01 -0.08 0.00 2.07 -1.06 0.39 116.25 119.56 1o7c h VAL 22 Ca 0.18 -0.80 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 1o7c h VAL 22 Cb 0.50 1.50 -0.00 0.00 -1.52 0.00 0.00 31.29 31.77 1o7c h VAL 22 CO 0.02 0.18 0.02 0.00 0.02 0.00 0.00 177.57 177.82 1o7c h GLU 24 N -0.07 0.00 -0.37 0.00 4.81 0.02 0.79 114.58 119.76 1o7c h GLU 24 Ca 0.02 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.32 1o7c h GLU 24 Cb 0.22 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.54 1o7c h GLU 24 CO -0.00 0.00 -0.01 0.35 -0.73 0.00 0.00 179.01 178.62 1o7c h PHE 25 N 0.00 -0.04 -1.97 0.92 3.57 0.38 -2.49 116.94 117.31 1o7c h PHE 25 Ca 0.00 0.03 -0.74 0.00 3.53 0.00 0.00 57.97 60.79 1o7c h PHE 25 Cb 0.41 0.07 -0.30 0.00 2.79 0.00 0.00 35.95 38.92 1o7c h PHE 25 CO 0.00 -0.08 0.73 0.39 -2.23 0.00 0.00 178.31 177.12 1o7c n GLU 26 N -5.20 3.22 -3.90 1.11 1.02 -1.18 -4.84 120.64 110.88 1o7c n GLU 26 Ca 0.02 -3.86 -0.31 0.00 -0.02 0.00 0.00 57.16 52.98 1o7c n GLU 26 Cb 0.19 -2.29 0.00 0.00 -0.02 0.00 0.00 31.44 29.32 1o7c n GLU 26 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1o7c n GLY 27 N -0.46 -0.48 3.70 0.62 0.00 -0.94 -4.95 105.19 102.68 1o7c n GLY 27 Ca 0.50 0.15 -0.29 0.00 0.00 0.00 0.00 46.02 46.39 1o7c n GLY 27 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1o7c s GLY 28 N -3.16 2.60 -0.02 -0.02 0.00 0.26 -4.97 107.32 102.02 1o7c s GLY 28 Ca 0.64 -1.67 0.06 0.00 0.00 0.00 0.00 44.72 43.74 1o7c s GLY 28 CO 0.79 -2.08 -0.20 -2.38 0.00 0.00 0.00 173.10 169.23 1o7c s HIS 29 N -2.74 1.78 -0.03 1.90 -3.43 -0.63 -2.24 115.29 109.90 1o7c s HIS 29 Ca 0.28 -0.36 -0.30 0.00 -0.80 0.00 0.00 55.06 53.89 1o7c s HIS 29 Cb 0.06 -1.15 -0.04 0.00 -1.43 0.00 0.00 32.58 30.01 1o7c s HIS 29 CO 0.15 -0.05 1.22 -0.48 -2.00 0.00 0.00 174.74 173.59 1o7c s LEU 30 N -0.41 4.30 0.80 5.38 0.05 -1.26 0.17 118.68 127.71 1o7c s LEU 30 Ca 0.06 1.89 -0.16 0.00 0.05 0.00 0.00 54.13 55.98 1o7c s LEU 30 Cb -0.08 -3.56 -0.04 0.00 -2.05 0.00 0.00 46.19 40.45 1o7c s LEU 30 CO -0.00 -0.58 0.29 0.00 -0.55 0.00 0.00 176.35 175.51 1o7c n ALA 31 N 4.98 -2.38 -2.93 1.48 0.00 0.30 -4.69 120.51 117.28 1o7c n ALA 31 Ca 0.11 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1o7c n ALA 31 Cb 0.46 -1.72 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1o7c n ALA 31 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1o7c n THR 32 N -2.63 0.00 0.00 0.00 -2.24 -1.26 -3.77 114.28 104.37 1o7c n THR 32 Ca 0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1o7c n THR 32 Cb 0.51 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 1o7c n THR 32 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1o7c n TYR 33 N -0.20 0.00 -0.32 4.78 9.36 -1.26 -1.71 117.16 127.81 1o7c n TYR 33 Ca 0.00 0.00 0.16 0.00 3.32 0.00 0.00 57.90 61.38 1o7c n TYR 33 Cb 0.00 -0.36 0.35 0.00 -0.63 0.00 0.00 39.34 38.70 1o7c n TYR 33 CO 0.00 0.00 0.00 0.87 0.22 0.00 0.00 176.86 177.95 1o7c h LYS 34 N 0.00 0.42 -0.17 2.98 1.79 -1.99 0.12 116.57 119.71 1o7c h LYS 34 Ca 0.00 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.43 1o7c h LYS 34 Cb 0.00 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 30.55 1o7c h LYS 34 CO 0.00 0.28 0.07 1.96 -1.08 0.00 0.00 179.45 180.68 1o7c h GLN 35 N 0.44 0.26 -0.95 3.15 4.20 -1.98 -2.41 115.11 117.82 1o7c h GLN 35 Ca 0.61 -0.05 0.11 0.00 0.06 0.00 0.00 58.65 59.38 1o7c h GLN 35 Cb 1.20 -0.04 -0.08 0.00 0.30 0.00 0.00 27.48 28.85 1o7c h GLN 35 CO -0.53 0.35 0.59 1.25 -0.67 0.00 0.00 178.83 179.82 1o7c h LEU 36 N 0.12 0.86 0.41 1.46 7.12 0.05 -1.47 115.31 123.86 1o7c h LEU 36 Ca 0.06 0.05 -0.01 0.00 0.13 0.00 0.00 57.88 58.11 1o7c h LEU 36 Cb 0.19 -0.12 -0.03 0.00 -0.53 0.00 0.00 40.66 40.17 1o7c h LEU 36 CO -0.00 0.47 -0.48 -0.08 -0.13 0.00 0.00 178.44 178.21 1o7c h GLU 37 N 0.94 -0.88 0.00 1.25 4.57 -0.69 0.96 114.58 120.73 1o7c h GLU 37 Ca 0.47 0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.71 1o7c h GLU 37 Cb 0.45 0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.24 1o7c h GLU 37 CO -0.26 -0.59 0.19 0.00 -1.18 0.00 0.00 179.01 177.18 1o7c h ALA 38 N -0.89 1.18 0.00 2.92 0.00 -0.94 0.46 119.26 121.99 1o7c h ALA 38 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.57 1o7c h ALA 38 Cb 0.81 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 1o7c h ALA 38 CO -0.10 -0.18 -1.77 0.00 0.00 0.00 0.00 179.25 177.21 1o7c n ALA 39 N -1.87 1.52 0.06 0.00 0.00 0.01 -3.97 120.51 116.27 1o7c n ALA 39 Ca -0.02 -0.82 -0.06 0.00 0.00 0.00 0.00 53.44 52.55 1o7c n ALA 39 Cb 0.24 -0.79 0.12 0.00 0.00 0.00 0.00 19.45 19.03 1o7c n ALA 39 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1o7c h ARG 40 N 0.00 0.32 0.00 0.00 1.12 0.55 -2.00 114.38 114.37 1o7c h ARG 40 Ca -0.31 -0.20 0.00 0.00 -1.11 0.00 0.00 59.98 58.36 1o7c h ARG 40 Cb 2.01 0.02 0.00 0.00 -0.01 0.00 0.00 29.97 32.00 1o7c h ARG 40 CO 0.07 0.79 0.00 0.87 -3.11 0.00 0.00 179.97 178.59 1o7c h LYS 41 N 0.25 0.00 0.00 0.20 1.57 -1.18 -1.98 116.57 115.43 1o7c h LYS 41 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1o7c h LYS 41 Cb 1.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.36 1o7c h LYS 41 CO 0.09 0.00 -0.59 0.44 -0.57 0.00 0.00 179.45 178.82 1o7c n ILE 42 N -2.62 0.15 0.00 1.86 -5.35 -1.04 -4.89 119.36 107.47 1o7c n ILE 42 Ca 0.01 -0.13 0.00 0.00 -0.27 0.00 0.00 62.75 62.36 1o7c n ILE 42 Cb 0.25 0.08 0.00 0.00 -1.74 0.00 0.00 39.64 38.23 1o7c n ILE 42 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1o7c n GLY 43 N 1.42 1.27 3.68 3.28 0.00 -0.76 -5.11 105.19 108.97 1o7c n GLY 43 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1o7c n GLY 43 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1o7c s PHE 44 N -1.58 3.46 -0.12 1.61 5.36 -0.78 -4.99 117.98 120.95 1o7c s PHE 44 Ca 0.00 1.37 -0.05 0.00 -0.96 0.00 0.00 56.93 57.29 1o7c s PHE 44 Cb 0.00 -3.06 0.05 0.00 -0.34 0.00 0.00 43.02 39.67 1o7c s PHE 44 CO 0.00 -0.22 0.27 -1.58 -1.46 0.00 0.00 175.22 172.23 1o7c s HIS 45 N 2.03 -0.39 -0.33 10.12 5.65 -1.26 -4.18 115.29 126.94 1o7c s HIS 45 Ca 0.42 0.89 -0.00 0.00 0.25 0.00 0.00 55.06 56.62 1o7c s HIS 45 Cb -0.17 0.05 0.13 0.00 -1.18 0.00 0.00 32.58 31.41 1o7c s HIS 45 CO 0.14 -0.28 0.26 0.08 -0.65 0.00 0.00 174.74 174.29 1o7c s VAL 46 N 1.60 -0.15 -1.02 0.89 1.01 -1.26 -4.95 120.40 116.51 1o7c s VAL 46 Ca -0.06 -1.04 -0.26 0.00 0.00 0.00 0.00 61.98 60.61 1o7c s VAL 46 Cb -0.11 -0.94 -0.19 0.00 0.00 0.00 0.00 36.38 35.15 1o7c s VAL 46 CO -0.09 -0.71 2.16 0.00 0.00 0.00 0.00 175.10 176.46 1o7c n ALA 48 N 18.76 0.00 -1.48 0.00 0.00 -1.26 -5.11 120.51 131.43 1o7c n ALA 48 Ca 0.43 0.00 -0.56 0.00 0.00 0.00 0.00 53.44 53.31 1o7c n ALA 48 Cb 0.46 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.82 1o7c n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o7c n ALA 49 N 0.00 0.35 -3.33 0.00 0.00 -1.26 -4.75 120.51 111.52 1o7c n ALA 49 Ca 0.00 0.16 -0.35 0.00 0.00 0.00 0.00 53.44 53.25 1o7c n ALA 49 Cb 0.00 -2.29 -0.13 0.00 0.00 0.00 0.00 19.45 17.03 1o7c n ALA 49 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1o7c s GLY 50 N 5.70 1.65 0.67 0.00 0.00 -0.36 0.19 107.32 115.16 1o7c s GLY 50 Ca 1.10 -1.11 -0.17 0.00 0.00 0.00 0.00 44.72 44.53 1o7c s GLY 50 CO 0.60 0.38 0.46 0.79 0.00 0.00 0.00 173.10 175.34 1o7c n TRP 51 N 4.65 -0.97 -3.88 1.90 7.02 -1.06 -3.51 117.44 121.59 1o7c n TRP 51 Ca -0.18 0.38 -0.02 0.00 -1.02 0.00 0.00 57.50 56.66 1o7c n TRP 51 Cb 0.51 -1.91 0.01 0.00 -2.42 0.00 0.00 31.31 27.51 1o7c n TRP 51 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1o7c s MET 52 N -2.43 1.05 1.46 -0.99 0.23 0.12 -3.73 119.30 115.02 1o7c s MET 52 Ca 0.66 -0.67 0.00 0.00 -1.03 0.00 0.00 55.69 54.65 1o7c s MET 52 Cb -0.38 0.30 0.00 0.00 -1.53 0.00 0.00 34.83 33.22 1o7c s MET 52 CO 0.58 -0.49 0.00 0.00 -2.03 0.00 0.00 175.02 173.08 1o7c n ALA 53 N -0.71 0.00 0.87 3.16 0.00 -1.25 -0.24 120.51 122.34 1o7c n ALA 53 Ca -0.02 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.47 1o7c n ALA 53 Cb 0.60 0.00 0.30 0.00 0.00 0.00 0.00 19.45 20.34 1o7c n ALA 53 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1o7c n LYS 54 N -0.67 0.44 0.00 0.00 5.02 -1.26 -4.32 118.16 117.36 1o7c n LYS 54 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1o7c n LYS 54 Cb 0.00 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 1o7c n LYS 54 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1o7c n GLY 55 N -0.11 -0.22 3.70 0.72 0.00 -1.03 -5.13 105.19 103.12 1o7c n GLY 55 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 1o7c n GLY 55 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1o7c s ARG 56 N 0.00 4.22 -0.11 1.61 0.52 0.66 -4.38 118.95 121.48 1o7c s ARG 56 Ca 0.00 0.19 0.02 0.00 -0.52 0.00 0.00 55.73 55.42 1o7c s ARG 56 Cb 0.00 -3.49 -0.01 0.00 0.52 0.00 0.00 34.95 31.97 1o7c s ARG 56 CO 0.00 0.08 -0.17 0.54 0.02 0.00 0.00 175.30 175.77 1o7c s VAL 57 N 0.94 2.74 0.29 3.52 0.11 -1.26 -0.70 120.40 126.03 1o7c s VAL 57 Ca 0.19 -0.78 0.05 0.00 -2.93 0.00 0.00 61.98 58.51 1o7c s VAL 57 Cb -0.14 -2.11 -0.02 0.00 -1.53 0.00 0.00 36.38 32.58 1o7c s VAL 57 CO 0.07 0.54 0.27 0.61 -3.33 0.00 0.00 175.10 173.26 1o7c n GLY 58 N 3.36 2.94 2.91 6.54 0.00 -1.23 -4.18 105.19 115.54 1o7c n GLY 58 Ca -0.18 -1.81 -0.30 0.00 0.00 0.00 0.00 46.02 43.72 1o7c n GLY 58 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1o7c s TYR 59 N -3.16 3.02 0.00 1.61 2.02 -0.92 -1.23 117.35 118.69 1o7c s TYR 59 Ca 0.33 -2.64 0.00 0.00 -0.37 0.00 0.00 57.07 54.39 1o7c s TYR 59 Cb 0.01 -2.51 0.00 0.00 -0.40 0.00 0.00 41.96 39.06 1o7c s TYR 59 CO 0.23 -0.90 0.28 -2.30 -1.57 0.00 0.00 175.55 171.29 1o7c n PRO 60 N 4.25 0.00 -1.77 -1.71 -0.02 -1.26 -0.62 135.00 133.87 1o7c n PRO 60 Ca 0.03 0.06 -0.02 0.00 -2.02 0.00 0.00 63.50 61.56 1o7c n PRO 60 Cb 0.40 -0.78 -0.01 0.00 -0.02 0.00 0.00 33.50 33.09 1o7c n PRO 60 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1o7c n ILE 61 N -0.34 -6.15 0.03 4.25 2.08 -1.26 -3.67 119.36 114.31 1o7c n ILE 61 Ca 0.00 0.94 -0.20 0.00 0.56 0.00 0.00 62.75 64.06 1o7c n ILE 61 Cb 0.00 -4.40 -0.11 0.00 -0.75 0.00 0.00 39.64 34.38 1o7c n ILE 61 CO 0.00 0.00 0.00 1.62 0.56 0.00 0.00 176.55 178.73 1o7c h VAL 62 N 1.34 1.33 -3.36 1.39 3.04 -1.90 -3.39 116.25 114.69 1o7c h VAL 62 Ca -0.15 -2.21 -0.63 0.00 -1.01 0.00 0.00 66.70 62.70 1o7c h VAL 62 Cb 0.34 2.48 -0.40 0.00 -2.01 0.00 0.00 31.29 31.69 1o7c h VAL 62 CO 0.00 0.67 -0.71 -1.59 -1.01 0.00 0.00 177.57 174.94 1o7c s LYS 63 N -3.25 1.41 0.35 4.17 -2.85 -1.26 -4.97 119.74 113.33 1o7c s LYS 63 Ca -0.11 -1.92 -0.27 0.00 -1.00 0.00 0.00 55.97 52.67 1o7c s LYS 63 Cb 0.06 -2.81 -0.09 0.00 -2.06 0.00 0.00 37.83 32.93 1o7c s LYS 63 CO 0.89 -1.04 1.18 -1.25 0.10 0.00 0.00 175.35 175.24 1o7c s PRO 64 N 0.64 4.29 0.00 1.78 0.04 -1.26 -4.84 135.00 135.65 1o7c s PRO 64 Ca 0.14 1.92 0.00 0.00 0.04 0.00 0.00 61.00 63.09 1o7c s PRO 64 Cb -0.21 -2.91 0.00 0.00 0.04 0.00 0.00 34.50 31.41 1o7c s PRO 64 CO -0.08 -0.14 0.00 0.41 0.04 0.00 0.00 177.00 177.24 1o7c n GLY 65 N 0.82 2.83 0.00 0.56 0.00 -1.26 -4.88 105.19 103.26 1o7c n GLY 65 Ca 0.02 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1o7c n GLY 65 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1o7c n PRO 66 N 0.00 0.00 -0.01 1.61 -0.04 -1.26 -3.56 135.00 131.74 1o7c n PRO 66 Ca 0.00 0.02 0.09 0.00 -0.04 0.00 0.00 63.50 63.57 1o7c n PRO 66 Cb 0.00 -0.43 -0.13 0.00 -0.04 0.00 0.00 33.50 32.90 1o7c n PRO 66 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1o7c n ASN 67 N -0.77 1.06 -0.01 3.54 0.23 -1.26 -2.49 115.26 115.56 1o7c n ASN 67 Ca 0.00 -0.02 0.04 0.00 -0.53 0.00 0.00 54.58 54.08 1o7c n ASN 67 Cb 0.00 1.77 0.42 0.00 -2.08 0.00 0.00 39.78 39.89 1o7c n ASN 67 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1o7c n GLY 69 N -1.47 0.60 2.41 0.00 0.00 -1.26 -4.86 105.19 100.61 1o7c n GLY 69 Ca 0.04 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 1o7c n GLY 69 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1o7c n PHE 70 N -0.76 -0.98 -1.27 1.61 3.72 -1.04 -0.80 117.46 117.94 1o7c n PHE 70 Ca 0.00 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.31 1o7c n PHE 70 Cb 0.00 -3.89 -0.04 0.00 -0.94 0.00 0.00 39.48 34.61 1o7c n PHE 70 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1o7c n GLY 71 N -0.97 1.05 3.87 1.37 0.00 -1.23 -4.99 105.19 104.28 1o7c n GLY 71 Ca -0.24 -0.39 -0.31 0.00 0.00 0.00 0.00 46.02 45.08 1o7c n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o7c s LYS 72 N -2.58 3.82 -0.10 1.61 1.02 0.02 -5.07 119.74 118.46 1o7c s LYS 72 Ca 0.00 0.33 0.03 0.00 0.02 0.00 0.00 55.97 56.36 1o7c s LYS 72 Cb 0.00 -2.58 0.00 0.00 -0.52 0.00 0.00 37.83 34.73 1o7c s LYS 72 CO 0.00 0.24 -0.22 0.95 -0.92 0.00 0.00 175.35 175.40 1o7c s THR 73 N -1.93 1.91 0.00 2.17 -4.23 -1.26 -4.59 115.64 107.71 1o7c s THR 73 Ca 0.49 -0.93 0.00 0.00 -1.18 0.00 0.00 61.69 60.07 1o7c s THR 73 Cb -0.11 -1.67 0.00 0.00 1.34 0.00 0.00 72.50 72.06 1o7c s THR 73 CO 0.22 0.53 0.00 0.61 -0.54 0.00 0.00 174.62 175.44 1o7c n GLY 74 N 3.65 -0.83 3.59 3.99 0.00 -1.26 -4.78 105.19 109.55 1o7c n GLY 74 Ca -0.20 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 1o7c n GLY 74 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o7c s ILE 75 N -1.46 3.46 -1.19 -0.61 1.01 -1.24 -4.59 121.20 116.57 1o7c s ILE 75 Ca 0.00 0.43 -0.19 0.00 0.00 0.00 0.00 60.65 60.89 1o7c s ILE 75 Cb 0.00 -3.72 0.08 0.00 0.01 0.00 0.00 42.46 38.83 1o7c s ILE 75 CO 0.00 -0.53 1.60 -0.63 0.00 0.00 0.00 174.94 175.38 1o7c s ILE 76 N 7.45 4.18 -0.14 2.92 -1.09 0.21 -4.76 121.20 129.98 1o7c s ILE 76 Ca 0.77 -1.65 -0.03 0.00 -2.23 0.00 0.00 60.65 57.51 1o7c s ILE 76 Cb -0.20 -5.11 -0.03 0.00 -1.58 0.00 0.00 42.46 35.54 1o7c s ILE 76 CO 0.31 -1.94 -0.05 -0.62 -1.23 0.00 0.00 174.94 171.41 1o7c s ASP 77 N 4.28 4.75 -0.26 3.58 2.15 -1.26 -2.18 116.67 127.72 1o7c s ASP 77 Ca 0.50 -0.11 0.12 0.00 0.43 0.00 0.00 52.55 53.49 1o7c s ASP 77 Cb 0.02 -1.66 0.67 0.00 -0.30 0.00 0.00 42.92 41.64 1o7c s ASP 77 CO 0.01 0.21 1.64 -1.22 -0.17 0.00 0.00 175.17 175.65 1o7c n TYR 78 N 3.24 1.78 -0.74 -5.34 4.02 -1.26 -5.02 117.16 113.85 1o7c n TYR 78 Ca -0.18 -1.09 0.09 0.00 -0.01 0.00 0.00 57.90 56.72 1o7c n TYR 78 Cb 0.53 -0.53 -0.03 0.00 -0.02 0.00 0.00 39.34 39.28 1o7c n TYR 78 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1o7c n GLY 79 N -0.28 -2.24 3.49 2.72 0.00 -1.26 -4.85 105.19 102.78 1o7c n GLY 79 Ca 0.32 -1.30 -0.37 0.00 0.00 0.00 0.00 46.02 44.67 1o7c n GLY 79 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1o7c n ILE 80 N -3.35 2.19 -0.90 -0.61 5.41 -1.26 -4.57 119.36 116.28 1o7c n ILE 80 Ca -0.02 -0.43 0.08 0.00 1.00 0.00 0.00 62.75 63.38 1o7c n ILE 80 Cb 0.34 -0.79 0.22 0.00 -0.71 0.00 0.00 39.64 38.70 1o7c n ILE 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1o7c n ARG 81 N -0.65 2.60 -2.66 0.38 5.12 -1.26 -4.95 116.66 115.24 1o7c n ARG 81 Ca 0.11 -2.67 -0.18 0.00 -1.93 0.00 0.00 57.85 53.18 1o7c n ARG 81 Cb 0.49 -1.69 0.00 0.00 -1.16 0.00 0.00 32.46 30.10 1o7c n ARG 81 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 1o7c n LEU 82 N -0.59 -1.66 -3.08 0.55 -0.00 -1.26 -4.90 117.00 106.06 1o7c n LEU 82 Ca 0.19 -0.02 -0.17 0.00 -0.00 0.00 0.00 56.01 56.00 1o7c n LEU 82 Cb 0.78 -2.48 -0.04 0.00 -0.00 0.00 0.00 43.42 41.67 1o7c n LEU 82 CO 0.11 -0.05 -0.11 0.59 -0.00 0.00 0.00 177.39 177.93 1o7c n ASN 83 N -2.05 -1.67 0.00 1.96 4.13 -1.26 -4.96 115.26 111.42 1o7c n ASN 83 Ca -0.15 -2.71 0.03 0.00 1.68 0.00 0.00 54.58 53.44 1o7c n ASN 83 Cb 0.62 0.48 0.19 0.00 -1.54 0.00 0.00 39.78 39.53 1o7c n ASN 83 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1o7c n ARG 84 N 2.53 0.29 -0.47 3.52 1.74 -1.26 -1.47 116.66 121.55 1o7c n ARG 84 Ca 0.22 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.40 1o7c n ARG 84 Cb 0.53 -1.35 0.32 0.00 -1.02 0.00 0.00 32.46 30.94 1o7c n ARG 84 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1o7c n SER 85 N -0.85 4.22 -3.28 0.55 7.64 -1.26 -3.39 113.62 117.25 1o7c n SER 85 Ca 0.05 -2.26 -0.25 0.00 1.01 0.00 0.00 58.87 57.42 1o7c n SER 85 Cb 0.02 -0.50 0.22 0.00 -1.01 0.00 0.00 64.21 62.94 1o7c n SER 85 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1o7c n GLU 86 N 1.18 -3.55 -3.81 1.43 -0.58 -0.54 -4.92 120.64 109.85 1o7c n GLU 86 Ca 0.24 -1.33 -0.27 0.00 -0.42 0.00 0.00 57.16 55.38 1o7c n GLU 86 Cb 0.74 -1.45 -0.17 0.00 -0.57 0.00 0.00 31.44 29.99 1o7c n GLU 86 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 1o7c s ARG 87 N -4.88 0.98 0.00 3.49 1.70 -1.26 -3.97 118.95 115.00 1o7c s ARG 87 Ca 0.57 -0.36 0.00 0.00 -0.47 0.00 0.00 55.73 55.47 1o7c s ARG 87 Cb -0.08 -1.84 0.00 0.00 -0.57 0.00 0.00 34.95 32.47 1o7c s ARG 87 CO 0.45 -0.48 0.00 0.91 -1.08 0.00 0.00 175.30 175.10 1o7c n TRP 88 N 4.99 0.00 -3.53 5.89 7.02 -0.82 -4.44 117.44 126.56 1o7c n TRP 88 Ca -0.10 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.38 1o7c n TRP 88 Cb 0.48 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.37 1o7c n TRP 88 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1o7c n ASP 89 N 0.00 1.54 -3.74 -0.99 9.92 0.13 -1.24 116.55 122.17 1o7c n ASP 89 Ca 0.00 -0.76 -0.12 0.00 -0.53 0.00 0.00 54.79 53.38 1o7c n ASP 89 Cb 0.00 0.00 -0.12 0.00 -0.64 0.00 0.00 41.12 40.36 1o7c n ASP 89 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1o7c s ALA 90 N -2.00 -0.67 -0.20 2.24 0.00 -0.85 -2.56 121.76 117.73 1o7c s ALA 90 Ca 0.00 1.03 -0.07 0.00 0.00 0.00 0.00 51.96 52.92 1o7c s ALA 90 Cb 0.00 -0.64 -0.04 0.00 0.00 0.00 0.00 23.12 22.45 1o7c s ALA 90 CO 0.00 -0.19 0.05 0.71 0.00 0.00 0.00 175.76 176.33 1o7c s TYR 91 N 1.00 3.17 0.24 0.00 2.02 -1.24 0.03 117.35 122.56 1o7c s TYR 91 Ca -0.07 -0.11 0.05 0.00 -0.37 0.00 0.00 57.07 56.57 1o7c s TYR 91 Cb -0.08 -2.10 -0.03 0.00 -0.40 0.00 0.00 41.96 39.35 1o7c s TYR 91 CO -0.07 -0.01 0.33 0.00 -1.57 0.00 0.00 175.55 174.23 1o7c s TYR 93 N -1.98 -0.70 -0.02 0.00 6.14 0.46 -1.07 117.35 120.18 1o7c s TYR 93 Ca 0.34 1.32 0.00 0.00 0.64 0.00 0.00 57.07 59.37 1o7c s TYR 93 Cb -0.09 0.19 0.02 0.00 0.42 0.00 0.00 41.96 42.50 1o7c s TYR 93 CO 0.28 -0.47 0.01 -0.80 0.64 0.00 0.00 175.55 175.21 1o7c s ASN 94 N 2.56 0.19 0.46 4.32 -0.87 -1.12 -1.61 114.94 118.87 1o7c s ASN 94 Ca 0.00 -0.00 0.26 0.00 -1.57 0.00 0.00 52.86 51.55 1o7c s ASN 94 Cb -0.12 -0.09 1.29 0.00 -0.02 0.00 0.00 41.25 42.30 1o7c s ASN 94 CO -0.12 -0.07 1.80 -0.65 -2.57 0.00 0.00 177.10 175.50 1o7c h PRO 95 N 6.84 0.22 0.00 -0.60 0.11 -1.96 -2.80 132.00 133.81 1o7c h PRO 95 Ca -0.37 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.64 1o7c h PRO 95 Cb 1.16 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1o7c h PRO 95 CO 0.49 0.14 -1.33 -2.39 -0.21 0.00 0.00 178.00 174.70 1o7c n HIS 96 N -4.44 0.00 -2.36 0.65 1.44 -1.26 -4.56 115.22 104.69 1o7c n HIS 96 Ca 0.24 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.86 1o7c n HIS 96 Cb 0.98 -0.24 0.01 0.00 0.12 0.00 0.00 29.99 30.86 1o7c n HIS 96 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1o7c n ALA 97 N -2.27 -1.45 0.54 1.59 0.00 -1.06 -3.88 120.51 113.98 1o7c n ALA 97 Ca -0.08 -0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.42 1o7c n ALA 97 Cb 0.65 -0.40 0.05 0.00 0.00 0.00 0.00 19.45 19.76 1o7c n ALA 97 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67