#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 4.97 0.25 1.61 0.11 -1.26 -2.78 120.40 123.29 1o7c s VAL 2 Ca 0.00 0.82 0.01 0.00 -2.93 0.00 0.00 61.98 59.88 1o7c s VAL 2 Cb 0.00 -3.73 -0.00 0.00 -1.53 0.00 0.00 36.38 31.12 1o7c s VAL 2 CO 0.00 0.46 0.30 0.00 -3.33 0.00 0.00 175.10 172.53 1o7c n TYR 3 N 1.44 -0.96 -4.28 1.54 4.11 -0.07 -4.99 117.16 113.95 1o7c n TYR 3 Ca -0.11 -1.80 -0.26 0.00 -0.00 0.00 0.00 57.90 55.74 1o7c n TYR 3 Cb 0.52 0.33 -0.09 0.00 -0.00 0.00 0.00 39.34 40.10 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 -3.31 2.68 0.19 -3.48 5.65 -1.26 -0.99 115.29 114.77 1o7c s HIS 4 Ca 0.23 -0.21 -0.17 0.00 0.25 0.00 0.00 55.06 55.17 1o7c s HIS 4 Cb 0.00 -1.29 0.03 0.00 -1.18 0.00 0.00 32.58 30.14 1o7c s HIS 4 CO 0.17 0.53 0.50 0.50 -0.65 0.00 0.00 174.74 175.79 1o7c s ARG 5 N -2.97 1.35 0.00 2.88 6.06 -0.12 -4.86 118.95 121.28 1o7c s ARG 5 Ca 0.26 -0.88 0.00 0.00 -2.50 0.00 0.00 55.73 52.62 1o7c s ARG 5 Cb -0.09 0.51 -0.00 0.00 0.06 0.00 0.00 34.95 35.43 1o7c s ARG 5 CO 0.16 -0.56 0.00 -0.85 -2.50 0.00 0.00 175.30 171.55 1o7c n GLU 6 N -0.33 1.72 -3.41 5.12 0.00 -1.26 -1.65 120.64 120.84 1o7c n GLU 6 Ca -0.10 -0.00 -0.32 0.00 0.00 0.00 0.00 57.16 56.73 1o7c n GLU 6 Cb 0.63 0.00 -0.05 0.00 0.00 0.00 0.00 31.44 32.01 1o7c n GLU 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1o7c s ALA 7 N -2.00 3.56 0.08 -1.84 0.00 -1.20 -4.87 121.76 115.49 1o7c s ALA 7 Ca 0.00 -0.25 0.29 0.00 0.00 0.00 0.00 51.96 52.00 1o7c s ALA 7 Cb 0.00 -2.45 1.58 0.00 0.00 0.00 0.00 23.12 22.25 1o7c s ALA 7 CO 0.00 0.50 1.89 0.00 0.00 0.00 0.00 175.76 178.15 1o7c h ARG 8 N 2.63 0.00 0.00 0.00 2.47 -2.01 -0.40 114.38 117.07 1o7c h ARG 8 Ca -0.47 0.00 -0.19 0.00 -1.26 0.00 0.00 59.98 58.06 1o7c h ARG 8 Cb 1.17 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.46 1o7c h ARG 8 CO 0.69 0.00 -2.11 0.43 0.56 0.00 0.00 179.97 179.54 1o7c n SER 9 N -2.52 0.11 0.00 7.04 7.64 -1.26 -5.08 113.62 119.54 1o7c n SER 9 Ca -0.02 0.05 0.00 0.00 1.01 0.00 0.00 58.87 59.91 1o7c n SER 9 Cb 0.05 1.30 0.00 0.00 -1.01 0.00 0.00 64.21 64.55 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 1.50 2.96 3.72 0.23 0.00 -0.16 -5.10 105.19 108.35 1o7c n GLY 10 Ca -0.18 -1.39 -0.34 0.00 0.00 0.00 0.00 46.02 44.11 1o7c n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1o7c s LYS 11 N -2.13 2.17 -1.22 1.61 2.20 -1.26 -3.20 119.74 117.91 1o7c s LYS 11 Ca 0.00 1.78 -0.02 0.00 -0.36 0.00 0.00 55.97 57.37 1o7c s LYS 11 Cb 0.00 -1.84 -0.01 0.00 -1.51 0.00 0.00 37.83 34.47 1o7c s LYS 11 CO 0.00 -1.81 0.86 0.66 -0.36 0.00 0.00 175.35 174.70 1o7c n TYR 12 N -2.66 -2.10 -1.13 4.03 4.02 -1.25 -4.88 117.16 113.18 1o7c n TYR 12 Ca 0.14 0.86 0.00 0.00 -0.01 0.00 0.00 57.90 58.89 1o7c n TYR 12 Cb 0.50 -4.59 0.00 0.00 -0.02 0.00 0.00 39.34 35.23 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 -4.06 0.00 -4.08 -0.72 5.02 -1.19 -4.23 118.16 108.90 1o7c n LYS 13 Ca -0.25 -0.05 -0.32 0.00 -2.02 0.00 0.00 58.31 55.67 1o7c n LYS 13 Cb 0.66 -0.43 -0.07 0.00 -0.02 0.00 0.00 35.03 35.17 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 3.91 0.16 -0.35 1.43 -0.51 -4.82 118.68 118.50 1o7c s LEU 14 Ca 0.00 0.12 0.09 0.00 -1.03 0.00 0.00 54.13 53.31 1o7c s LEU 14 Cb 0.00 -2.37 -0.04 0.00 0.03 0.00 0.00 46.19 43.81 1o7c s LEU 14 CO 0.00 0.24 -0.10 0.42 0.23 0.00 0.00 176.35 177.14 1o7c s THR 15 N -1.26 3.18 0.32 5.49 -4.23 -1.26 -1.38 115.64 116.51 1o7c s THR 15 Ca 0.25 -1.58 0.18 0.00 -1.18 0.00 0.00 61.69 59.35 1o7c s THR 15 Cb -0.12 -2.55 0.32 0.00 1.34 0.00 0.00 72.50 71.48 1o7c s THR 15 CO 0.17 -0.06 1.40 0.00 -0.54 0.00 0.00 174.62 175.59 1o7c n TYR 16 N 0.21 1.01 0.01 3.99 9.36 -1.23 0.20 117.16 130.72 1o7c n TYR 16 Ca -0.12 1.05 -0.17 0.00 3.32 0.00 0.00 57.90 61.98 1o7c n TYR 16 Cb 0.55 -1.44 -0.07 0.00 -0.63 0.00 0.00 39.34 37.75 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 1.78 0.29 -0.19 2.98 0.00 -1.95 -2.08 119.26 120.10 1o7c h ALA 17 Ca 0.74 -0.64 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1o7c h ALA 17 Cb 1.94 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.73 1o7c h ALA 17 CO -0.69 0.71 -0.23 0.93 0.00 0.00 0.00 179.25 179.97 1o7c h GLU 18 N 0.44 0.48 -0.44 0.00 5.08 0.20 -1.29 114.58 119.05 1o7c h GLU 18 Ca -0.08 -0.27 0.03 0.00 -1.00 0.00 0.00 59.36 58.04 1o7c h GLU 18 Cb 1.51 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.74 1o7c h GLU 18 CO 0.17 0.85 0.23 0.00 -1.00 0.00 0.00 179.01 179.27 1o7c h ALA 19 N 0.62 0.56 0.00 3.43 0.00 0.68 -0.88 119.26 123.67 1o7c h ALA 19 Ca 0.02 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1o7c h ALA 19 Cb 0.78 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1o7c h ALA 19 CO 0.05 -0.11 -0.25 -0.22 0.00 0.00 0.00 179.25 178.73 1o7c h LYS 20 N 0.47 0.00 -0.37 0.00 3.64 -1.35 -2.76 116.57 116.19 1o7c h LYS 20 Ca 0.19 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.43 1o7c h LYS 20 Cb 0.07 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1o7c h LYS 20 CO -0.12 0.25 -0.31 0.00 -2.27 0.00 0.00 179.45 177.00 1o7c h ALA 21 N 1.75 0.54 0.03 5.00 0.00 0.03 0.17 119.26 126.79 1o7c h ALA 21 Ca -0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 1o7c h ALA 21 Cb 0.58 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1o7c h ALA 21 CO 0.03 0.59 -0.02 0.28 0.00 0.00 0.00 179.25 180.13 1o7c h VAL 22 N 0.67 1.15 0.16 0.00 2.07 -1.04 0.70 116.25 119.96 1o7c h VAL 22 Ca 0.07 -0.56 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 1o7c h VAL 22 Cb 0.89 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 1o7c h VAL 22 CO 0.08 0.14 -0.08 0.00 0.02 0.00 0.00 177.57 177.74 1o7c n GLU 24 N -5.05 0.40 -0.11 0.00 2.13 0.60 0.04 120.64 118.66 1o7c n GLU 24 Ca -0.09 0.06 -0.11 0.00 0.66 0.00 0.00 57.16 57.69 1o7c n GLU 24 Cb 0.21 -1.50 -0.03 0.00 0.27 0.00 0.00 31.44 30.40 1o7c n GLU 24 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 1o7c h PHE 25 N 0.00 0.58 -2.26 4.31 3.57 0.95 -3.31 116.94 120.78 1o7c h PHE 25 Ca 0.00 -0.09 -0.59 0.00 3.53 0.00 0.00 57.97 60.82 1o7c h PHE 25 Cb 0.09 -0.16 -0.42 0.00 2.79 0.00 0.00 35.95 38.25 1o7c h PHE 25 CO 0.00 0.64 -0.63 0.39 -2.23 0.00 0.00 178.31 176.49 1o7c n GLU 26 N -4.58 3.28 -3.63 1.11 1.02 -1.16 -4.91 120.64 111.77 1o7c n GLU 26 Ca -0.02 -4.85 -0.25 0.00 -0.02 0.00 0.00 57.16 52.02 1o7c n GLU 26 Cb 0.24 -2.24 0.04 0.00 -0.02 0.00 0.00 31.44 29.46 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 -0.26 -0.73 3.19 0.62 0.00 -1.24 -5.00 105.19 101.77 1o7c n GLY 27 Ca 0.31 0.34 -0.11 0.00 0.00 0.00 0.00 46.02 46.57 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 -3.83 1.21 -0.02 -0.02 0.00 0.11 -4.96 107.32 99.81 1o7c s GLY 28 Ca 0.28 -1.58 0.04 0.00 0.00 0.00 0.00 44.72 43.45 1o7c s GLY 28 CO 0.82 -1.41 -0.13 -2.38 0.00 0.00 0.00 173.10 170.00 1o7c s HIS 29 N -4.01 1.24 -0.05 1.90 -3.43 -0.73 -1.53 115.29 108.68 1o7c s HIS 29 Ca 0.30 -0.26 -0.30 0.00 -0.80 0.00 0.00 55.06 54.00 1o7c s HIS 29 Cb 0.07 -0.81 -0.04 0.00 -1.43 0.00 0.00 32.58 30.38 1o7c s HIS 29 CO 0.06 -0.04 1.26 -0.48 -2.00 0.00 0.00 174.74 173.53 1o7c s LEU 30 N -0.23 4.28 0.69 5.38 0.05 -1.26 0.13 118.68 127.72 1o7c s LEU 30 Ca 0.03 1.88 -0.17 0.00 0.05 0.00 0.00 54.13 55.92 1o7c s LEU 30 Cb -0.06 -3.56 -0.06 0.00 -2.05 0.00 0.00 46.19 40.46 1o7c s LEU 30 CO -0.00 -0.64 0.43 0.00 -0.55 0.00 0.00 176.35 175.60 1o7c n ALA 31 N 5.40 -1.71 -2.71 1.48 0.00 0.42 -4.73 120.51 118.65 1o7c n ALA 31 Ca 0.12 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1o7c n ALA 31 Cb 0.45 -1.79 0.00 0.00 0.00 0.00 0.00 19.45 18.11 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 -2.22 0.00 0.00 0.00 -2.24 -1.26 -4.11 114.28 104.45 1o7c n THR 32 Ca 0.10 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.88 1o7c n THR 32 Cb 0.50 -0.69 -0.00 0.00 -2.10 0.00 0.00 70.33 68.03 1o7c n THR 32 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1o7c h TYR 33 N 0.12 -0.01 -0.91 4.78 3.20 -1.92 -1.70 116.97 120.53 1o7c h TYR 33 Ca 0.00 -0.00 0.24 0.00 3.14 0.00 0.00 58.73 62.11 1o7c h TYR 33 Cb 0.00 0.00 -0.13 0.00 1.54 0.00 0.00 36.73 38.14 1o7c h TYR 33 CO 0.00 -0.00 0.38 0.87 -1.64 0.00 0.00 178.16 177.77 1o7c h LYS 34 N -0.02 0.32 -0.28 1.82 1.57 -1.99 0.24 116.57 118.23 1o7c h LYS 34 Ca -0.00 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1o7c h LYS 34 Cb 0.00 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1o7c h LYS 34 CO 0.00 0.21 0.08 1.96 -0.57 0.00 0.00 179.45 181.14 1o7c h GLN 35 N 0.33 0.44 -0.87 3.15 4.20 -1.97 -2.42 115.11 117.97 1o7c h GLN 35 Ca 0.59 -0.10 0.08 0.00 0.06 0.00 0.00 58.65 59.28 1o7c h GLN 35 Cb 1.19 -0.06 -0.06 0.00 0.30 0.00 0.00 27.48 28.85 1o7c h GLN 35 CO -0.58 0.51 0.57 1.25 -0.67 0.00 0.00 178.83 179.90 1o7c h LEU 36 N 0.29 0.82 0.67 1.46 7.12 0.34 -1.85 115.31 124.16 1o7c h LEU 36 Ca 0.09 0.01 -0.03 0.00 0.13 0.00 0.00 57.88 58.09 1o7c h LEU 36 Cb 0.25 -0.16 -0.01 0.00 -0.53 0.00 0.00 40.66 40.22 1o7c h LEU 36 CO -0.00 0.50 -0.47 -0.08 -0.13 0.00 0.00 178.44 178.26 1o7c h GLU 37 N 0.92 -1.05 -0.09 1.25 4.81 -0.49 1.09 114.58 121.02 1o7c h GLU 37 Ca 0.39 0.07 0.03 0.00 -0.13 0.00 0.00 59.36 59.72 1o7c h GLU 37 Cb 0.31 0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.93 1o7c h GLU 37 CO -0.15 -0.70 0.30 0.00 -0.73 0.00 0.00 179.01 177.72 1o7c h ALA 38 N -1.14 1.47 0.00 2.92 0.00 -1.00 0.59 119.26 122.10 1o7c h ALA 38 Ca -0.09 -0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.56 1o7c h ALA 38 Cb 0.89 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 1o7c h ALA 38 CO 0.05 -0.34 -1.68 0.00 0.00 0.00 0.00 179.25 177.28 1o7c n ALA 39 N -2.04 1.62 0.05 0.00 0.00 -0.57 -3.71 120.51 115.87 1o7c n ALA 39 Ca -0.00 -0.74 -0.07 0.00 0.00 0.00 0.00 53.44 52.62 1o7c n ALA 39 Cb 0.37 -0.83 0.10 0.00 0.00 0.00 0.00 19.45 19.09 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 0.37 0.00 0.00 2.43 0.64 -0.66 114.38 117.16 1o7c h ARG 40 Ca -0.27 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 1o7c h ARG 40 Cb 1.91 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 31.50 1o7c h ARG 40 CO 0.07 0.84 0.00 0.87 -1.51 0.00 0.00 179.97 180.24 1o7c h LYS 41 N 0.28 0.00 -0.00 0.20 1.57 -0.90 -2.57 116.57 115.15 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 1.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.41 1o7c h LYS 41 CO 0.10 0.00 -0.30 0.44 -0.57 0.00 0.00 179.45 179.12 1o7c n ILE 42 N -2.78 0.00 0.00 1.86 -5.35 -1.05 -4.87 119.36 107.16 1o7c n ILE 42 Ca 0.02 -0.05 0.00 0.00 -0.27 0.00 0.00 62.75 62.46 1o7c n ILE 42 Cb 0.35 0.14 0.00 0.00 -1.74 0.00 0.00 39.64 38.38 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 1.41 1.01 3.71 3.28 0.00 -0.97 -5.11 105.19 108.52 1o7c n GLY 43 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.71 3.61 -0.19 1.61 5.36 -0.28 -4.99 117.98 121.40 1o7c s PHE 44 Ca 0.00 1.59 -0.11 0.00 -0.96 0.00 0.00 56.93 57.45 1o7c s PHE 44 Cb 0.00 -3.21 0.06 0.00 -0.34 0.00 0.00 43.02 39.54 1o7c s PHE 44 CO 0.00 -0.37 0.46 -1.58 -1.46 0.00 0.00 175.22 172.27 1o7c s HIS 45 N 0.88 -0.68 -0.29 10.12 5.65 -1.26 -4.26 115.29 125.46 1o7c s HIS 45 Ca 0.53 1.43 0.02 0.00 0.25 0.00 0.00 55.06 57.29 1o7c s HIS 45 Cb -0.24 0.32 0.16 0.00 -1.18 0.00 0.00 32.58 31.65 1o7c s HIS 45 CO 0.29 -0.37 0.42 0.08 -0.65 0.00 0.00 174.74 174.51 1o7c s VAL 46 N 1.35 -0.64 -1.14 0.89 1.01 -1.21 -5.02 120.40 115.64 1o7c s VAL 46 Ca -0.09 -0.30 -0.23 0.00 0.00 0.00 0.00 61.98 61.36 1o7c s VAL 46 Cb -0.07 -0.98 -0.09 0.00 0.00 0.00 0.00 36.38 35.23 1o7c s VAL 46 CO -0.13 -0.28 1.96 0.00 0.00 0.00 0.00 175.10 176.65 1o7c n ALA 48 N 14.82 0.00 -1.30 0.00 0.00 -1.26 -4.99 120.51 127.77 1o7c n ALA 48 Ca 0.44 0.00 -0.59 0.00 0.00 0.00 0.00 53.44 53.29 1o7c n ALA 48 Cb 0.47 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.80 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 0.24 -3.30 0.00 0.00 -1.25 -4.68 120.51 111.52 1o7c n ALA 49 Ca 0.00 0.18 -0.36 0.00 0.00 0.00 0.00 53.44 53.25 1o7c n ALA 49 Cb 0.00 -2.13 -0.13 0.00 0.00 0.00 0.00 19.45 17.19 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 5.98 1.74 0.81 0.00 0.00 0.50 -0.12 107.32 116.23 1o7c s GLY 50 Ca 1.18 -1.39 -0.16 0.00 0.00 0.00 0.00 44.72 44.35 1o7c s GLY 50 CO 0.65 0.59 0.18 0.79 0.00 0.00 0.00 173.10 175.30 1o7c n TRP 51 N 4.83 -2.03 -3.91 1.90 7.02 -1.06 -3.47 117.44 120.72 1o7c n TRP 51 Ca -0.15 0.26 0.04 0.00 -1.02 0.00 0.00 57.50 56.62 1o7c n TRP 51 Cb 0.48 -1.77 0.01 0.00 -2.42 0.00 0.00 31.31 27.62 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 -2.65 0.19 1.33 -0.99 0.23 0.95 -3.95 119.30 114.40 1o7c s MET 52 Ca 0.58 -0.12 0.00 0.00 -1.03 0.00 0.00 55.69 55.12 1o7c s MET 52 Cb -0.30 0.05 0.00 0.00 -1.53 0.00 0.00 34.83 33.06 1o7c s MET 52 CO 0.66 -0.09 0.00 0.00 -2.03 0.00 0.00 175.02 173.56 1o7c n ALA 53 N -0.84 0.00 0.14 3.16 0.00 -1.26 -0.11 120.51 121.60 1o7c n ALA 53 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.55 1o7c n ALA 53 Cb 0.60 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.52 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 -0.66 0.11 0.00 0.00 5.02 -1.26 -4.32 118.16 117.06 1o7c n LYS 54 Ca 0.00 0.61 0.00 0.00 -2.02 0.00 0.00 58.31 56.90 1o7c n LYS 54 Cb 0.00 -1.90 0.00 0.00 -0.02 0.00 0.00 35.03 33.11 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 -1.33 0.00 3.82 0.72 0.00 -1.05 -5.11 105.19 102.24 1o7c n GLY 55 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 1o7c n GLY 55 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1o7c s ARG 56 N 0.00 3.72 -0.13 1.61 1.70 0.84 -4.50 118.95 122.20 1o7c s ARG 56 Ca 0.00 -0.14 -0.00 0.00 -0.47 0.00 0.00 55.73 55.12 1o7c s ARG 56 Cb 0.00 -3.27 0.03 0.00 -0.57 0.00 0.00 34.95 31.13 1o7c s ARG 56 CO 0.00 0.60 -0.09 0.54 -1.08 0.00 0.00 175.30 175.27 1o7c s VAL 57 N -0.53 1.21 0.20 4.99 0.11 -1.26 -0.04 120.40 125.08 1o7c s VAL 57 Ca 0.13 -0.43 0.00 0.00 -2.93 0.00 0.00 61.98 58.75 1o7c s VAL 57 Cb -0.12 -1.20 0.00 0.00 -1.53 0.00 0.00 36.38 33.53 1o7c s VAL 57 CO 0.02 0.38 0.02 0.61 -3.33 0.00 0.00 175.10 172.80 1o7c n GLY 58 N 4.88 3.82 2.90 6.54 0.00 -1.23 -4.44 105.19 117.66 1o7c n GLY 58 Ca -0.14 -2.27 -0.28 0.00 0.00 0.00 0.00 46.02 43.33 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 -1.61 3.42 0.05 1.61 2.02 -0.83 -0.37 117.35 121.64 1o7c s TYR 59 Ca 0.02 -3.28 -0.30 0.00 -0.37 0.00 0.00 57.07 53.13 1o7c s TYR 59 Cb -0.00 -2.68 -0.09 0.00 -0.40 0.00 0.00 41.96 38.78 1o7c s TYR 59 CO 0.01 -0.59 1.96 -2.30 -1.57 0.00 0.00 175.55 173.05 1o7c n PRO 60 N 2.23 2.88 -3.58 -1.71 -0.02 -1.26 -2.36 135.00 131.19 1o7c n PRO 60 Ca 0.17 1.05 -0.29 0.00 -2.02 0.00 0.00 63.50 62.41 1o7c n PRO 60 Cb 0.35 -3.00 -0.15 0.00 -0.02 0.00 0.00 33.50 30.67 1o7c n PRO 60 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1o7c s ILE 61 N 4.18 0.08 0.09 4.25 -1.09 -1.23 -3.32 121.20 124.17 1o7c s ILE 61 Ca 0.88 -0.83 -0.14 0.00 -2.23 0.00 0.00 60.65 58.32 1o7c s ILE 61 Cb -0.44 -1.07 -0.12 0.00 -1.58 0.00 0.00 42.46 39.25 1o7c s ILE 61 CO 0.41 -0.70 1.36 1.62 -1.23 0.00 0.00 174.94 176.40 1o7c h VAL 62 N 6.42 1.31 -3.50 2.92 3.04 -1.90 -2.46 116.25 122.09 1o7c h VAL 62 Ca -0.19 -1.68 -0.69 0.00 -1.01 0.00 0.00 66.70 63.13 1o7c h VAL 62 Cb 1.02 1.79 -0.35 0.00 -2.01 0.00 0.00 31.29 31.74 1o7c h VAL 62 CO 0.44 0.53 -0.50 -0.75 -1.01 0.00 0.00 177.57 176.28 1o7c s LYS 63 N -4.06 2.15 0.43 4.17 2.36 -1.26 -4.82 119.74 118.71 1o7c s LYS 63 Ca -0.12 -2.06 -0.24 0.00 -2.55 0.00 0.00 55.97 51.00 1o7c s LYS 63 Cb 0.08 -3.61 -0.10 0.00 -1.05 0.00 0.00 37.83 33.15 1o7c s LYS 63 CO 0.85 -1.10 1.01 -0.35 1.55 0.00 0.00 175.35 177.32 1o7c n PRO 64 N 4.21 1.35 -0.94 4.03 -0.04 -1.26 -4.82 135.00 137.52 1o7c n PRO 64 Ca 0.01 0.48 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 1o7c n PRO 64 Cb 0.40 -2.06 0.00 0.00 -0.04 0.00 0.00 33.50 31.80 1o7c n PRO 64 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1o7c n GLY 65 N 1.18 2.99 0.00 0.55 0.00 -1.25 -4.85 105.19 103.80 1o7c n GLY 65 Ca 0.09 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.96 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 -0.46 135.00 134.86 1o7c n PRO 66 Ca 0.00 0.15 0.11 0.00 -0.04 0.00 0.00 63.50 63.71 1o7c n PRO 66 Cb 0.00 -0.94 -0.05 0.00 -0.04 0.00 0.00 33.50 32.47 1o7c n PRO 66 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1o7c n ASN 67 N -0.94 0.70 -2.75 3.54 5.15 -1.26 -2.30 115.26 117.39 1o7c n ASN 67 Ca 0.00 -0.57 -0.37 0.00 -0.60 0.00 0.00 54.58 53.04 1o7c n ASN 67 Cb 0.00 1.02 0.04 0.00 -0.53 0.00 0.00 39.78 40.31 1o7c n ASN 67 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1o7c n GLY 69 N -0.60 1.03 2.59 0.00 0.00 -1.26 -3.78 105.19 103.17 1o7c n GLY 69 Ca 0.54 -0.04 -0.19 0.00 0.00 0.00 0.00 46.02 46.33 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 0.00 -1.28 -1.23 1.61 3.72 -0.30 -1.39 117.46 118.59 1o7c n PHE 70 Ca 0.00 0.22 -0.08 0.00 -0.05 0.00 0.00 57.45 57.54 1o7c n PHE 70 Cb 0.00 -3.82 -0.03 0.00 -0.94 0.00 0.00 39.48 34.68 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 -1.22 0.94 3.89 1.37 0.00 0.39 -4.94 105.19 105.63 1o7c n GLY 71 Ca -0.16 -0.33 -0.32 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.38 3.64 -0.11 1.61 1.02 -0.49 -4.93 119.74 118.10 1o7c s LYS 72 Ca 0.00 -0.05 0.04 0.00 0.02 0.00 0.00 55.97 55.97 1o7c s LYS 72 Cb 0.00 -2.83 0.00 0.00 -0.52 0.00 0.00 37.83 34.48 1o7c s LYS 72 CO 0.00 0.46 -0.23 0.95 -0.92 0.00 0.00 175.35 175.60 1o7c s THR 73 N -1.67 2.05 0.00 2.17 -4.23 -1.26 -4.15 115.64 108.55 1o7c s THR 73 Ca 0.41 -1.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.92 1o7c s THR 73 Cb -0.12 -1.78 0.00 0.00 1.34 0.00 0.00 72.50 71.94 1o7c s THR 73 CO 0.24 0.55 0.00 0.61 -0.54 0.00 0.00 174.62 175.49 1o7c n GLY 74 N 3.68 -0.84 3.55 3.99 0.00 -0.92 -4.75 105.19 109.90 1o7c n GLY 74 Ca -0.19 -1.66 -0.32 0.00 0.00 0.00 0.00 46.02 43.85 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 -2.16 3.14 -1.19 -0.61 1.09 -1.26 -3.55 121.20 116.66 1o7c s ILE 75 Ca 0.00 0.02 -0.22 0.00 -1.10 0.00 0.00 60.65 59.34 1o7c s ILE 75 Cb 0.00 -3.34 -0.07 0.00 -1.06 0.00 0.00 42.46 37.99 1o7c s ILE 75 CO 0.00 -0.33 1.91 -0.63 -0.10 0.00 0.00 174.94 175.80 1o7c s ILE 76 N 11.71 3.60 -0.23 2.92 -1.09 -0.99 -4.64 121.20 132.48 1o7c s ILE 76 Ca 0.86 -1.01 -0.07 0.00 -2.23 0.00 0.00 60.65 58.20 1o7c s ILE 76 Cb -0.14 -4.63 -0.03 0.00 -1.58 0.00 0.00 42.46 36.08 1o7c s ILE 76 CO 0.19 -1.09 0.07 -0.62 -1.23 0.00 0.00 174.94 172.26 1o7c s ASP 77 N 6.29 5.32 0.00 3.58 2.15 -1.26 -1.97 116.67 130.78 1o7c s ASP 77 Ca 0.67 -0.11 0.29 0.00 0.43 0.00 0.00 52.55 53.82 1o7c s ASP 77 Cb -0.00 -1.94 1.18 0.00 -0.30 0.00 0.00 42.92 41.85 1o7c s ASP 77 CO 0.12 0.03 1.82 -1.22 -0.17 0.00 0.00 175.17 175.76 1o7c n TYR 78 N 4.50 0.00 0.00 -5.34 4.02 -1.26 -4.99 117.16 114.09 1o7c n TYR 78 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.73 1o7c n TYR 78 Cb 0.52 -0.11 0.00 0.00 -0.02 0.00 0.00 39.34 39.73 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 1.23 0.12 3.71 2.72 0.00 -1.26 -4.91 105.19 106.80 1o7c n GLY 79 Ca 0.16 -1.81 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 1o7c n GLY 79 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o7c s ILE 80 N -2.03 2.30 -0.77 -0.61 1.01 -1.26 -4.60 121.20 115.23 1o7c s ILE 80 Ca 0.00 0.07 0.17 0.00 0.00 0.00 0.00 60.65 60.88 1o7c s ILE 80 Cb 0.00 -3.04 0.77 0.00 0.01 0.00 0.00 42.46 40.20 1o7c s ILE 80 CO 0.00 0.00 1.69 0.54 0.00 0.00 0.00 174.94 177.17 1o7c n ARG 81 N 4.75 4.26 -3.78 2.79 5.12 -1.26 -4.93 116.66 123.61 1o7c n ARG 81 Ca 0.17 -3.01 -0.25 0.00 -1.93 0.00 0.00 57.85 52.82 1o7c n ARG 81 Cb 0.37 -2.07 0.03 0.00 -1.16 0.00 0.00 32.46 29.63 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 0.94 -2.91 -2.74 0.55 -0.00 -1.26 -4.93 117.00 106.65 1o7c n LEU 82 Ca 0.27 -0.79 -0.05 0.00 -0.00 0.00 0.00 56.01 55.44 1o7c n LEU 82 Cb 1.03 -2.64 0.02 0.00 -0.00 0.00 0.00 43.42 41.83 1o7c n LEU 82 CO 0.28 0.44 0.23 -3.20 -0.00 0.00 0.00 177.39 175.14 1o7c n ASN 83 N -2.97 -2.89 0.00 1.96 5.15 -1.26 -4.98 115.26 110.27 1o7c n ASN 83 Ca -0.16 -2.56 0.07 0.00 -0.60 0.00 0.00 54.58 51.34 1o7c n ASN 83 Cb 0.61 1.53 0.39 0.00 -0.53 0.00 0.00 39.78 41.78 1o7c n ASN 83 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1o7c n ARG 84 N 2.58 0.25 0.00 1.20 3.00 -1.26 -2.95 116.66 119.48 1o7c n ARG 84 Ca 0.14 0.12 0.00 0.00 -0.01 0.00 0.00 57.85 58.11 1o7c n ARG 84 Cb 0.60 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.56 1o7c n ARG 84 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1o7c n SER 85 N -1.25 0.58 -2.35 0.55 2.88 -1.26 -3.55 113.62 109.22 1o7c n SER 85 Ca 0.08 -1.60 -0.05 0.00 -1.33 0.00 0.00 58.87 55.96 1o7c n SER 85 Cb 0.11 -0.29 0.04 0.00 -0.75 0.00 0.00 64.21 63.32 1o7c n SER 85 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1o7c n GLU 86 N -0.06 -0.22 -3.68 -1.46 -0.58 -1.15 -5.04 120.64 108.44 1o7c n GLU 86 Ca 0.00 -0.38 -0.26 0.00 -0.42 0.00 0.00 57.16 56.10 1o7c n GLU 86 Cb 0.15 -0.25 -0.17 0.00 -0.57 0.00 0.00 31.44 30.60 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 -3.52 0.32 0.08 3.49 1.04 -1.26 -4.29 118.95 114.81 1o7c s ARG 87 Ca 0.14 -0.16 -0.02 0.00 -1.04 0.00 0.00 55.73 54.66 1o7c s ARG 87 Cb -0.00 -1.75 0.01 0.00 -2.04 0.00 0.00 34.95 31.16 1o7c s ARG 87 CO 0.10 -0.60 0.14 0.91 -0.04 0.00 0.00 175.30 175.80 1o7c n TRP 88 N 5.18 -0.94 -1.30 5.89 7.02 -0.48 -4.43 117.44 128.38 1o7c n TRP 88 Ca -0.07 -0.46 -0.02 0.00 -1.02 0.00 0.00 57.50 55.92 1o7c n TRP 88 Cb 0.48 0.16 0.01 0.00 -2.42 0.00 0.00 31.31 29.54 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 -1.62 0.02 -3.80 -0.99 9.92 0.83 -1.43 116.55 119.48 1o7c n ASP 89 Ca -0.01 -1.04 -0.13 0.00 -0.53 0.00 0.00 54.79 53.09 1o7c n ASP 89 Cb 0.13 -0.06 -0.13 0.00 -0.64 0.00 0.00 41.12 40.42 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 -3.75 -0.37 -0.25 2.24 0.00 -0.66 -2.57 121.76 116.39 1o7c s ALA 90 Ca 0.05 0.51 -0.09 0.00 0.00 0.00 0.00 51.96 52.43 1o7c s ALA 90 Cb -0.00 -0.31 -0.04 0.00 0.00 0.00 0.00 23.12 22.77 1o7c s ALA 90 CO 0.03 -0.09 0.12 0.71 0.00 0.00 0.00 175.76 176.52 1o7c s TYR 91 N 0.33 3.16 0.21 0.00 2.02 -1.25 -0.95 117.35 120.86 1o7c s TYR 91 Ca -0.02 -0.15 -0.02 0.00 -0.37 0.00 0.00 57.07 56.51 1o7c s TYR 91 Cb -0.03 -2.28 -0.04 0.00 -0.40 0.00 0.00 41.96 39.21 1o7c s TYR 91 CO -0.01 -0.22 0.41 0.00 -1.57 0.00 0.00 175.55 174.15 1o7c s TYR 93 N -1.88 -0.18 -0.14 0.00 6.14 0.34 -0.89 117.35 120.74 1o7c s TYR 93 Ca 0.39 0.55 -0.09 0.00 0.64 0.00 0.00 57.07 58.56 1o7c s TYR 93 Cb -0.11 -0.14 0.05 0.00 0.42 0.00 0.00 41.96 42.18 1o7c s TYR 93 CO 0.29 -0.21 0.35 -0.80 0.64 0.00 0.00 175.55 175.81 1o7c s ASN 94 N 1.60 -0.39 0.48 4.32 0.01 -1.12 -1.77 114.94 118.07 1o7c s ASN 94 Ca -0.05 0.73 0.27 0.00 -0.71 0.00 0.00 52.86 53.10 1o7c s ASN 94 Cb -0.12 0.66 1.33 0.00 0.41 0.00 0.00 41.25 43.53 1o7c s ASN 94 CO -0.06 -0.16 1.84 -0.65 -1.51 0.00 0.00 177.10 176.56 1o7c h PRO 95 N 6.53 0.17 0.00 -0.60 0.11 -1.94 -2.28 132.00 133.97 1o7c h PRO 95 Ca -0.34 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.69 1o7c h PRO 95 Cb 1.18 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1o7c h PRO 95 CO 0.31 0.11 -1.26 1.58 -0.21 0.00 0.00 178.00 178.53 1o7c n HIS 96 N -4.38 0.00 -3.05 0.65 -0.00 -1.26 -4.23 115.22 102.96 1o7c n HIS 96 Ca 0.21 0.00 -0.14 0.00 -0.00 0.00 0.00 57.72 57.80 1o7c n HIS 96 Cb 0.94 -0.18 0.00 0.00 -0.00 0.00 0.00 29.99 30.75 1o7c n HIS 96 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1o7c n ALA 97 N -2.38 -1.89 0.25 1.57 0.00 -1.12 -3.77 120.51 113.19 1o7c n ALA 97 Ca -0.07 -0.10 0.02 0.00 0.00 0.00 0.00 53.44 53.29 1o7c n ALA 97 Cb 0.61 -0.45 0.12 0.00 0.00 0.00 0.00 19.45 19.73 1o7c n ALA 97 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67