#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 3.54 0.10 1.61 1.01 -1.26 -2.07 120.40 123.32 1o7c s VAL 2 Ca 0.00 -0.53 -0.09 0.00 0.00 0.00 0.00 61.98 61.35 1o7c s VAL 2 Cb 0.00 -2.45 0.00 0.00 0.00 0.00 0.00 36.38 33.93 1o7c s VAL 2 CO 0.00 0.58 0.22 -0.72 0.00 0.00 0.00 175.10 175.18 1o7c s TYR 3 N -0.57 0.12 0.23 5.22 1.13 0.15 -5.00 117.35 118.63 1o7c s TYR 3 Ca 0.08 -0.54 0.07 0.00 -1.41 0.00 0.00 57.07 55.27 1o7c s TYR 3 Cb -0.12 -0.02 -0.04 0.00 -1.10 0.00 0.00 41.96 40.68 1o7c s TYR 3 CO 0.02 -0.57 0.17 -1.58 -2.51 0.00 0.00 175.55 171.08 1o7c s HIS 4 N -3.86 3.10 0.14 -3.49 5.65 -1.26 0.81 115.29 116.39 1o7c s HIS 4 Ca 0.05 -0.09 -0.25 0.00 0.25 0.00 0.00 55.06 55.03 1o7c s HIS 4 Cb 0.04 -1.42 0.06 0.00 -1.18 0.00 0.00 32.58 30.09 1o7c s HIS 4 CO -0.11 0.52 0.83 1.03 -0.65 0.00 0.00 174.74 176.37 1o7c s ARG 5 N -3.63 1.25 0.00 2.88 1.81 -0.26 -4.78 118.95 116.23 1o7c s ARG 5 Ca 0.32 -0.62 0.00 0.00 -1.72 0.00 0.00 55.73 53.72 1o7c s ARG 5 Cb -0.08 0.47 0.00 0.00 -0.45 0.00 0.00 34.95 34.89 1o7c s ARG 5 CO 0.24 -0.56 0.00 -1.91 -0.68 0.00 0.00 175.30 172.39 1o7c n GLU 6 N -0.40 2.11 -0.03 3.54 4.07 -1.26 -1.86 120.64 126.81 1o7c n GLU 6 Ca -0.08 0.00 -0.02 0.00 -0.06 0.00 0.00 57.16 57.00 1o7c n GLU 6 Cb 0.61 0.00 0.02 0.00 -0.06 0.00 0.00 31.44 32.01 1o7c n GLU 6 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1o7c n ALA 7 N -3.00 -0.34 -0.45 4.31 0.00 -0.68 -4.76 120.51 115.59 1o7c n ALA 7 Ca 0.00 -0.11 0.37 0.00 0.00 0.00 0.00 53.44 53.70 1o7c n ALA 7 Cb 0.00 -0.01 0.67 0.00 0.00 0.00 0.00 19.45 20.11 1o7c n ALA 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o7c h ARG 8 N 0.00 0.11 0.00 0.00 2.47 -2.01 -3.33 114.38 111.61 1o7c h ARG 8 Ca -0.03 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1o7c h ARG 8 Cb 0.09 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.39 1o7c h ARG 8 CO 0.02 0.07 0.00 0.45 0.56 0.00 0.00 179.97 181.07 1o7c n SER 9 N -4.48 0.00 -4.28 7.04 2.88 -1.26 -5.16 113.62 108.35 1o7c n SER 9 Ca 0.34 -0.14 -0.16 0.00 -1.33 0.00 0.00 58.87 57.59 1o7c n SER 9 Cb 1.40 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 64.76 1o7c n SER 9 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1o7c s GLY 10 N 0.00 1.22 0.24 0.46 0.00 -1.25 -5.15 107.32 102.84 1o7c s GLY 10 Ca 0.00 -1.57 0.03 0.00 0.00 0.00 0.00 44.72 43.18 1o7c s GLY 10 CO 0.00 -1.64 0.39 1.25 0.00 0.00 0.00 173.10 173.10 1o7c s LYS 11 N -3.74 3.46 -1.19 2.90 2.20 -1.26 -1.69 119.74 120.42 1o7c s LYS 11 Ca 0.20 -0.59 -0.32 0.00 -0.36 0.00 0.00 55.97 54.90 1o7c s LYS 11 Cb 0.02 -2.85 0.03 0.00 -1.51 0.00 0.00 37.83 33.53 1o7c s LYS 11 CO 0.03 0.38 0.71 0.66 -0.36 0.00 0.00 175.35 176.77 1o7c n TYR 12 N -1.25 -1.51 -1.49 4.03 4.01 -1.03 -4.83 117.16 115.09 1o7c n TYR 12 Ca -0.07 0.16 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 1o7c n TYR 12 Cb 0.56 -2.92 0.00 0.00 -0.31 0.00 0.00 39.34 36.67 1o7c n TYR 12 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1o7c n LYS 13 N -4.84 0.00 -3.99 -0.72 4.76 -0.78 -4.28 118.16 108.31 1o7c n LYS 13 Ca -0.11 -0.26 -0.35 0.00 -2.87 0.00 0.00 58.31 54.72 1o7c n LYS 13 Cb 0.57 -0.26 -0.12 0.00 -1.84 0.00 0.00 35.03 33.39 1o7c n LYS 13 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1o7c s LEU 14 N 0.00 3.49 -0.01 -0.35 1.43 -1.01 -4.79 118.68 117.43 1o7c s LEU 14 Ca 0.00 -0.11 -0.04 0.00 -1.03 0.00 0.00 54.13 52.95 1o7c s LEU 14 Cb 0.00 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 1o7c s LEU 14 CO 0.00 0.07 0.19 0.42 0.23 0.00 0.00 176.35 177.27 1o7c s THR 15 N 0.95 5.42 0.24 5.49 -4.23 -1.25 -1.88 115.64 120.39 1o7c s THR 15 Ca 0.03 -0.08 0.12 0.00 -1.18 0.00 0.00 61.69 60.58 1o7c s THR 15 Cb -0.14 -3.53 0.25 0.00 1.34 0.00 0.00 72.50 70.41 1o7c s THR 15 CO 0.02 0.35 1.07 0.00 -0.54 0.00 0.00 174.62 175.53 1o7c n TYR 16 N 1.05 0.72 -0.07 3.99 9.36 -1.11 0.24 117.16 131.35 1o7c n TYR 16 Ca -0.12 0.80 -0.12 0.00 3.32 0.00 0.00 57.90 61.78 1o7c n TYR 16 Cb 0.53 -1.19 -0.06 0.00 -0.63 0.00 0.00 39.34 37.99 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 1.36 0.27 0.08 2.98 0.00 -1.94 -2.14 119.26 119.86 1o7c h ALA 17 Ca 0.54 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1o7c h ALA 17 Cb 1.39 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1o7c h ALA 17 CO -0.54 0.10 -0.04 0.93 0.00 0.00 0.00 179.25 179.70 1o7c h GLU 18 N 0.09 -0.10 -0.72 0.00 5.08 0.28 -1.99 114.58 117.21 1o7c h GLU 18 Ca 0.04 0.01 0.15 0.00 -1.00 0.00 0.00 59.36 58.56 1o7c h GLU 18 Cb 0.59 0.02 -0.13 0.00 0.50 0.00 0.00 28.75 29.73 1o7c h GLU 18 CO 0.03 0.44 -0.15 0.00 -1.00 0.00 0.00 179.01 178.33 1o7c h ALA 19 N 0.03 0.53 0.51 3.43 0.00 0.82 -1.00 119.26 123.57 1o7c h ALA 19 Ca -0.01 0.27 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1o7c h ALA 19 Cb 0.59 0.52 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1o7c h ALA 19 CO 0.02 -0.42 -0.24 -0.22 0.00 0.00 0.00 179.25 178.39 1o7c h LYS 20 N 0.02 -0.66 -0.99 0.00 3.64 -1.45 -2.58 116.57 114.55 1o7c h LYS 20 Ca 0.36 0.04 0.35 0.00 -1.27 0.00 0.00 60.65 60.13 1o7c h LYS 20 Cb 0.56 0.15 -0.18 0.00 -0.41 0.00 0.00 32.23 32.35 1o7c h LYS 20 CO -0.72 -0.35 0.35 0.00 -2.27 0.00 0.00 179.45 176.45 1o7c h ALA 21 N -0.67 1.74 0.02 5.00 0.00 -0.60 0.83 119.26 125.58 1o7c h ALA 21 Ca -0.07 0.28 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1o7c h ALA 21 Cb 0.61 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1o7c h ALA 21 CO 0.11 -0.75 -0.01 0.28 0.00 0.00 0.00 179.25 178.88 1o7c h VAL 22 N 0.05 1.28 -0.14 0.00 2.07 -1.15 0.30 116.25 118.66 1o7c h VAL 22 Ca 0.73 -0.95 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 1o7c h VAL 22 Cb 1.76 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 33.44 1o7c h VAL 22 CO -0.80 0.24 0.05 0.00 0.02 0.00 0.00 177.57 177.08 1o7c n GLU 24 N -4.86 0.01 0.02 0.00 2.13 0.25 -2.27 120.64 115.92 1o7c n GLU 24 Ca -0.05 0.13 -0.10 0.00 0.66 0.00 0.00 57.16 57.80 1o7c n GLU 24 Cb 0.13 -1.51 -0.04 0.00 0.27 0.00 0.00 31.44 30.29 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 -0.34 -1.80 4.31 3.57 0.23 -2.91 116.94 120.00 1o7c h PHE 25 Ca 0.00 0.02 -0.76 0.00 3.53 0.00 0.00 57.97 60.75 1o7c h PHE 25 Cb 0.38 0.16 -0.22 0.00 2.79 0.00 0.00 35.95 39.07 1o7c h PHE 25 CO 0.00 -0.20 1.43 0.39 -2.23 0.00 0.00 178.31 177.70 1o7c n GLU 26 N -5.27 4.69 -2.17 1.11 1.02 -1.23 -4.75 120.64 114.03 1o7c n GLU 26 Ca -0.04 -4.01 -0.10 0.00 -0.02 0.00 0.00 57.16 52.99 1o7c n GLU 26 Cb 0.19 -2.48 -0.01 0.00 -0.02 0.00 0.00 31.44 29.12 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 0.51 -0.14 0.00 0.62 0.00 -1.10 -4.92 105.19 100.17 1o7c n GLY 27 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.55 1o7c n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o7c n GLY 28 N -0.62 2.84 3.42 -0.02 0.00 -0.96 -4.81 105.19 105.04 1o7c n GLY 28 Ca -0.12 -2.16 -0.11 0.00 0.00 0.00 0.00 46.02 43.64 1o7c n GLY 28 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1o7c s HIS 29 N 0.22 -0.72 0.05 1.61 0.09 0.13 -3.35 115.29 113.32 1o7c s HIS 29 Ca 0.00 1.56 -0.30 0.00 -0.00 0.00 0.00 55.06 56.31 1o7c s HIS 29 Cb 0.00 0.34 -0.08 0.00 -0.00 0.00 0.00 32.58 32.84 1o7c s HIS 29 CO 0.00 -0.37 1.72 -0.48 -0.00 0.00 0.00 174.74 175.60 1o7c s LEU 30 N 1.09 4.37 1.00 0.89 0.05 -1.25 -0.25 118.68 124.58 1o7c s LEU 30 Ca -0.07 2.50 -0.15 0.00 0.05 0.00 0.00 54.13 56.46 1o7c s LEU 30 Cb -0.06 -3.55 0.03 0.00 -2.05 0.00 0.00 46.19 40.56 1o7c s LEU 30 CO -0.10 -0.93 0.15 0.00 -0.55 0.00 0.00 176.35 174.92 1o7c n ALA 31 N 6.13 -3.33 -2.84 1.48 0.00 0.62 -4.73 120.51 117.84 1o7c n ALA 31 Ca 0.17 -0.81 0.00 0.00 0.00 0.00 0.00 53.44 52.79 1o7c n ALA 31 Cb 0.41 -1.64 0.00 0.00 0.00 0.00 0.00 19.45 18.21 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 -3.72 0.00 0.00 0.00 -2.24 -1.26 -3.82 114.28 103.24 1o7c n THR 32 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1o7c n THR 32 Cb 0.57 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 68.22 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 -0.24 0.00 -0.34 4.78 9.36 -1.26 -1.56 117.16 127.90 1o7c n TYR 33 Ca 0.00 0.00 0.22 0.00 3.32 0.00 0.00 57.90 61.44 1o7c n TYR 33 Cb 0.00 -0.35 0.48 0.00 -0.63 0.00 0.00 39.34 38.84 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 0.41 0.34 2.98 1.57 -1.98 0.23 116.57 120.12 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 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.22 1o7c h LYS 34 CO 0.00 0.27 -0.16 1.96 -0.57 0.00 0.00 179.45 180.95 1o7c h GLN 35 N 0.42 -0.43 -0.05 3.15 4.20 -1.97 -1.71 115.11 118.71 1o7c h GLN 35 Ca 0.64 0.03 0.02 0.00 0.06 0.00 0.00 58.65 59.39 1o7c h GLN 35 Cb 1.51 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 29.39 1o7c h GLN 35 CO -0.38 -0.12 0.11 1.25 -0.67 0.00 0.00 178.83 179.02 1o7c h LEU 36 N -0.81 0.00 0.42 1.46 7.12 -0.12 -1.26 115.31 122.12 1o7c h LEU 36 Ca -0.05 0.00 -0.02 0.00 0.13 0.00 0.00 57.88 57.94 1o7c h LEU 36 Cb 0.52 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.65 1o7c h LEU 36 CO 0.08 0.00 -0.20 -0.08 -0.13 0.00 0.00 178.44 178.11 1o7c h GLU 37 N 0.00 -0.54 0.00 1.25 4.81 -0.25 0.21 114.58 120.07 1o7c h GLU 37 Ca 0.03 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1o7c h GLU 37 Cb 0.24 0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.74 1o7c h GLU 37 CO -0.00 -0.36 0.01 0.00 -0.73 0.00 0.00 179.01 177.93 1o7c n ALA 38 N -2.61 1.02 -0.03 2.92 0.00 -0.67 -0.07 120.51 121.06 1o7c n ALA 38 Ca -0.07 0.15 -0.06 0.00 0.00 0.00 0.00 53.44 53.46 1o7c n ALA 38 Cb 0.22 -1.21 -0.14 0.00 0.00 0.00 0.00 19.45 18.32 1o7c n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o7c n ALA 39 N -1.70 1.67 0.09 0.00 0.00 -0.52 -4.03 120.51 116.01 1o7c n ALA 39 Ca -0.01 -0.89 -0.03 0.00 0.00 0.00 0.00 53.44 52.51 1o7c n ALA 39 Cb 0.04 -0.66 0.19 0.00 0.00 0.00 0.00 19.45 19.02 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 0.26 0.00 0.00 1.12 0.29 -1.96 114.38 114.08 1o7c h ARG 40 Ca -0.33 -0.13 0.00 0.00 -1.11 0.00 0.00 59.98 58.41 1o7c h ARG 40 Cb 1.94 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.90 1o7c h ARG 40 CO 0.05 0.67 0.00 0.87 -3.11 0.00 0.00 179.97 178.45 1o7c h LYS 41 N 0.21 0.00 0.00 0.20 1.57 -1.49 -2.07 116.57 114.99 1o7c h LYS 41 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1o7c h LYS 41 Cb 0.89 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.20 1o7c h LYS 41 CO 0.07 0.00 -1.16 0.44 -0.57 0.00 0.00 179.45 178.23 1o7c n ILE 42 N -2.33 0.30 0.00 1.86 -5.35 -0.94 -4.91 119.36 107.99 1o7c n ILE 42 Ca 0.01 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.11 1o7c n ILE 42 Cb 0.21 -0.02 0.00 0.00 -1.74 0.00 0.00 39.64 38.09 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 1.29 -0.27 3.55 3.28 0.00 -0.79 -5.10 105.19 107.15 1o7c n GLY 43 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.43 2.29 -0.05 1.61 2.19 -0.78 -4.98 117.98 117.83 1o7c s PHE 44 Ca 0.00 0.04 0.02 0.00 0.33 0.00 0.00 56.93 57.33 1o7c s PHE 44 Cb 0.00 -4.59 0.01 0.00 -1.31 0.00 0.00 43.02 37.13 1o7c s PHE 44 CO 0.00 -2.04 -0.11 -1.58 1.83 0.00 0.00 175.22 173.32 1o7c s HIS 45 N 5.81 1.32 -0.31 10.12 2.46 -1.26 -4.21 115.29 129.22 1o7c s HIS 45 Ca 0.38 -0.45 0.02 0.00 0.47 0.00 0.00 55.06 55.48 1o7c s HIS 45 Cb -0.08 -0.97 0.16 0.00 -0.13 0.00 0.00 32.58 31.56 1o7c s HIS 45 CO 0.17 -0.23 0.41 0.08 -2.47 0.00 0.00 174.74 172.70 1o7c s VAL 46 N 0.57 -0.60 -1.10 0.89 1.01 -1.26 -5.03 120.40 114.87 1o7c s VAL 46 Ca -0.12 -0.38 -0.25 0.00 0.00 0.00 0.00 61.98 61.23 1o7c s VAL 46 Cb -0.14 -0.89 -0.16 0.00 0.00 0.00 0.00 36.38 35.19 1o7c s VAL 46 CO 0.03 -0.32 2.05 0.00 0.00 0.00 0.00 175.10 176.86 1o7c n ALA 48 N 17.26 0.00 -1.52 0.00 0.00 -1.26 -5.10 120.51 129.89 1o7c n ALA 48 Ca 0.43 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.44 1o7c n ALA 48 Cb 0.47 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.86 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 -0.22 1.04 -2.78 0.00 0.00 -1.26 -4.76 120.51 112.53 1o7c n ALA 49 Ca 0.00 -0.43 -0.39 0.00 0.00 0.00 0.00 53.44 52.62 1o7c n ALA 49 Cb 0.00 -2.83 -0.11 0.00 0.00 0.00 0.00 19.45 16.51 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 9.47 1.88 0.78 0.00 0.00 -0.53 -0.95 107.32 117.98 1o7c s GLY 50 Ca 1.07 -1.31 -0.16 0.00 0.00 0.00 0.00 44.72 44.32 1o7c s GLY 50 CO 0.38 0.69 0.21 0.79 0.00 0.00 0.00 173.10 175.16 1o7c n TRP 51 N 5.01 -1.91 -3.93 1.90 7.02 -1.06 -3.50 117.44 120.98 1o7c n TRP 51 Ca -0.14 0.28 -0.01 0.00 -1.02 0.00 0.00 57.50 56.61 1o7c n TRP 51 Cb 0.50 -1.78 0.02 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 n MET 52 N -0.11 0.45 0.00 -0.99 0.00 0.19 -3.99 117.12 112.68 1o7c n MET 52 Ca 0.07 -1.17 0.00 0.00 0.00 0.00 0.00 57.70 56.60 1o7c n MET 52 Cb 0.51 1.68 0.00 0.00 0.00 0.00 0.00 33.22 35.41 1o7c n MET 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1o7c n ALA 53 N -0.90 0.00 0.85 3.17 0.00 -1.25 -0.20 120.51 122.19 1o7c n ALA 53 Ca -0.12 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.38 1o7c n ALA 53 Cb 0.57 0.00 0.39 0.00 0.00 0.00 0.00 19.45 20.41 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 -0.55 0.43 0.00 0.00 5.02 -1.26 -4.31 118.16 117.49 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 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 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 -0.15 -0.12 3.79 0.72 0.00 -1.02 -5.14 105.19 103.27 1o7c n GLY 55 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 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 4.07 -0.05 1.61 0.52 0.73 -4.38 118.95 121.45 1o7c s ARG 56 Ca 0.00 0.37 0.04 0.00 -0.52 0.00 0.00 55.73 55.63 1o7c s ARG 56 Cb 0.00 -3.31 -0.00 0.00 0.52 0.00 0.00 34.95 32.16 1o7c s ARG 56 CO 0.00 0.49 -0.19 0.54 0.02 0.00 0.00 175.30 176.16 1o7c s VAL 57 N -0.41 1.60 0.16 3.52 0.11 -1.26 0.57 120.40 124.69 1o7c s VAL 57 Ca 0.23 -0.80 0.01 0.00 -2.93 0.00 0.00 61.98 58.49 1o7c s VAL 57 Cb -0.16 -1.38 -0.00 0.00 -1.53 0.00 0.00 36.38 33.31 1o7c s VAL 57 CO 0.11 0.46 0.19 0.61 -3.33 0.00 0.00 175.10 173.14 1o7c n GLY 58 N 3.21 2.99 2.77 6.54 0.00 -1.23 -3.84 105.19 115.63 1o7c n GLY 58 Ca -0.19 -1.60 -0.30 0.00 0.00 0.00 0.00 46.02 43.93 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 -3.46 1.78 0.00 1.61 2.02 -0.81 -1.45 117.35 117.05 1o7c s TYR 59 Ca 0.16 -1.68 0.00 0.00 -0.37 0.00 0.00 57.07 55.18 1o7c s TYR 59 Cb 0.00 -1.67 0.00 0.00 -0.40 0.00 0.00 41.96 39.89 1o7c s TYR 59 CO 0.11 -0.83 0.00 -0.35 -1.57 0.00 0.00 175.55 172.91 1o7c n PRO 60 N 4.83 0.00 -1.60 -1.71 -0.04 -1.26 -0.44 135.00 134.78 1o7c n PRO 60 Ca -0.04 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.42 1o7c n PRO 60 Cb 0.43 -0.45 -0.01 0.00 -0.04 0.00 0.00 33.50 33.44 1o7c n PRO 60 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1o7c n ILE 61 N 0.00 -5.71 0.05 0.52 2.08 -1.26 -4.07 119.36 110.97 1o7c n ILE 61 Ca 0.00 0.91 -0.07 0.00 0.56 0.00 0.00 62.75 64.15 1o7c n ILE 61 Cb 0.00 -4.16 -0.12 0.00 -0.75 0.00 0.00 39.64 34.61 1o7c n ILE 61 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 1o7c h VAL 62 N 1.26 1.54 -3.31 1.39 2.07 -1.90 -3.39 116.25 113.92 1o7c h VAL 62 Ca -0.08 -3.26 -0.66 0.00 0.82 0.00 0.00 66.70 63.53 1o7c h VAL 62 Cb 0.18 2.76 -0.39 0.00 -1.52 0.00 0.00 31.29 32.31 1o7c h VAL 62 CO 0.00 0.88 -0.47 -0.54 0.02 0.00 0.00 177.57 177.46 1o7c s LYS 63 N -2.70 2.48 0.77 1.57 1.02 -1.26 -5.01 119.74 116.60 1o7c s LYS 63 Ca 0.00 -2.96 -0.15 0.00 0.02 0.00 0.00 55.97 52.88 1o7c s LYS 63 Cb 0.10 -3.54 0.03 0.00 -0.52 0.00 0.00 37.83 33.90 1o7c s LYS 63 CO 0.82 -1.21 0.99 -2.30 -0.92 0.00 0.00 175.35 172.73 1o7c n PRO 64 N 2.66 0.33 0.00 -1.68 -0.02 -1.26 -4.98 135.00 130.05 1o7c n PRO 64 Ca 0.13 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 1o7c n PRO 64 Cb 0.35 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 1o7c n PRO 64 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1o7c n GLY 65 N 0.95 4.65 0.00 -1.23 0.00 -1.26 -4.91 105.19 103.40 1o7c n GLY 65 Ca 0.13 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.00 1.61 -0.04 -1.26 -1.39 135.00 133.92 1o7c n PRO 66 Ca 0.00 0.29 0.08 0.00 -0.04 0.00 0.00 63.50 63.84 1o7c n PRO 66 Cb 0.00 -0.80 -0.10 0.00 -0.04 0.00 0.00 33.50 32.56 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 -1.38 0.83 -1.86 3.54 0.23 -1.26 -2.72 115.26 112.65 1o7c n ASN 67 Ca 0.00 -0.75 -0.12 0.00 -0.53 0.00 0.00 54.58 53.19 1o7c n ASN 67 Cb 0.00 1.14 -0.02 0.00 -2.08 0.00 0.00 39.78 38.83 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 1.11 0.38 2.41 0.00 0.00 -1.26 -4.14 105.19 103.70 1o7c n GLY 69 Ca 0.24 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.06 1o7c n GLY 69 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1o7c n PHE 70 N 0.00 -0.84 -1.19 1.61 7.35 -1.10 -0.99 117.46 122.29 1o7c n PHE 70 Ca 0.00 0.00 -0.07 0.00 -0.76 0.00 0.00 57.45 56.62 1o7c n PHE 70 Cb 0.00 -3.84 -0.03 0.00 0.35 0.00 0.00 39.48 35.96 1o7c n PHE 70 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1o7c n GLY 71 N -0.95 0.82 3.87 7.13 0.00 -0.49 -4.98 105.19 110.60 1o7c n GLY 71 Ca -0.24 -0.29 -0.30 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.16 3.68 -0.08 1.61 1.02 -0.17 -4.92 119.74 118.73 1o7c s LYS 72 Ca 0.00 0.61 0.05 0.00 0.02 0.00 0.00 55.97 56.64 1o7c s LYS 72 Cb 0.00 -2.22 -0.00 0.00 -0.52 0.00 0.00 37.83 35.09 1o7c s LYS 72 CO 0.00 -0.33 -0.22 0.95 -0.92 0.00 0.00 175.35 174.82 1o7c s THR 73 N -2.83 1.89 0.00 2.17 -4.23 -1.26 -4.56 115.64 106.81 1o7c s THR 73 Ca 0.53 -0.94 0.00 0.00 -1.18 0.00 0.00 61.69 60.10 1o7c s THR 73 Cb -0.10 -1.62 0.00 0.00 1.34 0.00 0.00 72.50 72.11 1o7c s THR 73 CO 0.44 0.52 0.00 0.61 -0.54 0.00 0.00 174.62 175.65 1o7c n GLY 74 N 3.32 -0.61 3.57 3.99 0.00 -1.26 -4.79 105.19 109.42 1o7c n GLY 74 Ca -0.19 -1.72 -0.40 0.00 0.00 0.00 0.00 46.02 43.71 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 -1.74 3.35 -1.16 -0.61 1.01 -1.26 -4.46 121.20 116.34 1o7c s ILE 75 Ca 0.00 0.29 -0.20 0.00 0.00 0.00 0.00 60.65 60.74 1o7c s ILE 75 Cb 0.00 -3.65 0.06 0.00 0.01 0.00 0.00 42.46 38.88 1o7c s ILE 75 CO 0.00 -0.53 1.59 -0.63 0.00 0.00 0.00 174.94 175.36 1o7c s ILE 76 N 8.47 4.03 -0.15 2.92 -1.09 0.42 -4.72 121.20 131.08 1o7c s ILE 76 Ca 0.78 -1.34 -0.04 0.00 -2.23 0.00 0.00 60.65 57.82 1o7c s ILE 76 Cb -0.18 -5.12 -0.03 0.00 -1.58 0.00 0.00 42.46 35.54 1o7c s ILE 76 CO 0.28 -1.98 -0.00 -0.62 -1.23 0.00 0.00 174.94 171.39 1o7c s ASP 77 N 4.59 5.11 0.00 3.58 2.15 -1.26 -1.92 116.67 128.91 1o7c s ASP 77 Ca 0.50 -0.01 0.23 0.00 0.43 0.00 0.00 52.55 53.69 1o7c s ASP 77 Cb 0.02 -1.75 0.47 0.00 -0.30 0.00 0.00 42.92 41.35 1o7c s ASP 77 CO -0.01 0.22 1.42 -1.22 -0.17 0.00 0.00 175.17 175.41 1o7c n TYR 78 N 3.20 0.41 0.00 -5.34 4.02 -1.25 -5.00 117.16 113.21 1o7c n TYR 78 Ca -0.17 -0.21 0.00 0.00 -0.01 0.00 0.00 57.90 57.51 1o7c n TYR 78 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.85 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 1.43 -1.56 3.63 2.72 0.00 -1.26 -4.79 105.19 105.36 1o7c n GLY 79 Ca 0.18 -1.54 -0.43 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.80 0.58 0.22 -0.61 5.41 -1.26 -4.55 119.36 117.35 1o7c n ILE 80 Ca 0.00 -0.27 0.01 0.00 1.00 0.00 0.00 62.75 63.49 1o7c n ILE 80 Cb 0.00 -2.37 0.15 0.00 -0.71 0.00 0.00 39.64 36.71 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 7.99 2.43 -3.44 0.38 5.12 -1.26 -4.86 116.66 123.03 1o7c n ARG 81 Ca 0.25 -1.26 -0.25 0.00 -1.93 0.00 0.00 57.85 54.66 1o7c n ARG 81 Cb 0.41 -1.77 0.02 0.00 -1.16 0.00 0.00 32.46 29.96 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 0.20 -2.22 -3.02 0.55 -0.00 -1.26 -4.90 117.00 106.35 1o7c n LEU 82 Ca 0.13 -0.48 -0.17 0.00 -0.00 0.00 0.00 56.01 55.49 1o7c n LEU 82 Cb 0.68 -2.52 -0.02 0.00 -0.00 0.00 0.00 43.42 41.56 1o7c n LEU 82 CO 0.15 0.29 -0.09 -3.20 -0.00 0.00 0.00 177.39 174.54 1o7c n ASN 83 N -2.54 -0.88 0.00 1.96 4.05 -1.26 -4.94 115.26 111.65 1o7c n ASN 83 Ca -0.02 -3.00 0.04 0.00 0.45 0.00 0.00 54.58 52.04 1o7c n ASN 83 Cb 0.56 0.32 0.22 0.00 1.23 0.00 0.00 39.78 42.11 1o7c n ASN 83 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 1o7c n ARG 84 N 1.24 0.15 -0.30 1.20 3.00 -1.26 -1.61 116.66 119.07 1o7c n ARG 84 Ca 0.17 0.17 0.06 0.00 -0.01 0.00 0.00 57.85 58.24 1o7c n ARG 84 Cb 0.59 -1.50 0.20 0.00 0.00 0.00 0.00 32.46 31.75 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 -1.23 2.71 -3.09 0.55 2.88 -1.26 -2.74 113.62 111.45 1o7c n SER 85 Ca 0.04 -2.15 -0.16 0.00 -1.33 0.00 0.00 58.87 55.27 1o7c n SER 85 Cb 0.06 -0.38 0.14 0.00 -0.75 0.00 0.00 64.21 63.28 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 0.65 -2.37 -3.74 -1.46 -0.58 -0.63 -4.91 120.64 107.59 1o7c n GLU 86 Ca 0.15 -0.94 -0.25 0.00 -0.42 0.00 0.00 57.16 55.70 1o7c n GLU 86 Cb 0.49 -0.92 -0.17 0.00 -0.57 0.00 0.00 31.44 30.27 1o7c n GLU 86 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1o7c s ARG 87 N -4.34 0.59 0.00 3.49 0.52 -1.26 -3.75 118.95 114.20 1o7c s ARG 87 Ca 0.39 -0.13 0.00 0.00 -0.52 0.00 0.00 55.73 55.47 1o7c s ARG 87 Cb -0.04 -1.52 0.00 0.00 0.52 0.00 0.00 34.95 33.91 1o7c s ARG 87 CO 0.30 -0.47 0.00 0.91 0.02 0.00 0.00 175.30 176.06 1o7c n TRP 88 N 5.12 0.00 -4.22 -0.53 7.02 -0.79 -4.44 117.44 119.60 1o7c n TRP 88 Ca -0.08 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.31 1o7c n TRP 88 Cb 0.49 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.36 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 2.29 -3.77 -0.99 8.00 -0.13 -1.87 116.55 120.08 1o7c n ASP 89 Ca 0.00 -1.67 -0.13 0.00 0.71 0.00 0.00 54.79 53.71 1o7c n ASP 89 Cb 0.00 0.13 -0.13 0.00 -0.02 0.00 0.00 41.12 41.10 1o7c n ASP 89 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1o7c s ALA 90 N -2.27 -0.46 -0.45 2.24 0.00 -0.78 -2.55 121.76 117.49 1o7c s ALA 90 Ca 0.01 0.70 -0.17 0.00 0.00 0.00 0.00 51.96 52.50 1o7c s ALA 90 Cb 0.00 -0.43 0.05 0.00 0.00 0.00 0.00 23.12 22.73 1o7c s ALA 90 CO 0.00 -0.13 0.44 0.71 0.00 0.00 0.00 175.76 176.78 1o7c s TYR 91 N 0.65 3.18 0.06 0.00 2.02 -1.26 -1.10 117.35 120.91 1o7c s TYR 91 Ca -0.05 -0.63 -0.22 0.00 -0.37 0.00 0.00 57.07 55.81 1o7c s TYR 91 Cb -0.06 -3.06 -0.06 0.00 -0.40 0.00 0.00 41.96 38.38 1o7c s TYR 91 CO -0.04 -0.78 0.65 0.00 -1.57 0.00 0.00 175.55 173.82 1o7c s TYR 93 N -0.60 -0.03 0.09 0.00 6.14 0.65 0.32 117.35 123.92 1o7c s TYR 93 Ca 0.33 0.15 0.04 0.00 0.64 0.00 0.00 57.07 58.22 1o7c s TYR 93 Cb -0.20 -0.08 -0.03 0.00 0.42 0.00 0.00 41.96 42.06 1o7c s TYR 93 CO 0.20 -0.06 -0.11 -0.80 0.64 0.00 0.00 175.55 175.43 1o7c s ASN 94 N 0.51 1.45 0.49 4.32 -0.87 -0.88 0.21 114.94 120.16 1o7c s ASN 94 Ca -0.04 -0.73 0.31 0.00 -1.57 0.00 0.00 52.86 50.83 1o7c s ASN 94 Cb -0.06 -0.00 1.41 0.00 -0.02 0.00 0.00 41.25 42.58 1o7c s ASN 94 CO -0.02 -0.21 1.75 -0.65 -2.57 0.00 0.00 177.10 175.41 1o7c h PRO 95 N 3.84 0.13 0.00 -0.60 0.11 -1.87 0.42 132.00 134.04 1o7c h PRO 95 Ca -0.38 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1o7c h PRO 95 Cb 1.19 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1o7c h PRO 95 CO 0.48 0.09 -0.93 0.72 -0.21 0.00 0.00 178.00 178.15 1o7c n HIS 96 N -4.37 0.00 -3.78 0.65 8.25 -1.26 -4.00 115.22 110.71 1o7c n HIS 96 Ca 0.29 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.49 1o7c n HIS 96 Cb 1.22 0.00 0.01 0.00 1.12 0.00 0.00 29.99 32.34 1o7c n HIS 96 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1o7c n ALA 97 N -2.01 -2.00 0.51 -1.41 0.00 -1.07 -3.33 120.51 111.20 1o7c n ALA 97 Ca 0.00 -0.31 0.06 0.00 0.00 0.00 0.00 53.44 53.19 1o7c n ALA 97 Cb 0.47 -1.25 0.05 0.00 0.00 0.00 0.00 19.45 18.72 1o7c n ALA 97 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67