#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d9n n ALA 2 N 0.00 -1.34 -0.05 3.04 0.00 -1.26 -4.88 120.51 116.02 1d9n n ALA 2 Ca 0.00 0.12 -0.02 0.00 0.00 0.00 0.00 53.44 53.54 1d9n n ALA 2 Cb 0.00 -4.05 -0.02 0.00 0.00 0.00 0.00 19.45 15.38 1d9n n ALA 2 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1d9n h GLU 3 N -1.95 -0.01 0.00 0.00 4.81 -2.04 -3.44 114.58 111.95 1d9n h GLU 3 Ca -0.59 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 58.55 1d9n h GLU 3 Cb 1.38 0.00 -0.13 0.00 0.63 0.00 0.00 28.75 30.63 1d9n h GLU 3 CO 0.69 0.11 -0.38 -0.25 -0.73 0.00 0.00 179.01 178.45 1d9n n ASP 4 N -4.77 -0.25 -4.56 1.04 8.00 -1.26 -5.03 116.55 109.72 1d9n n ASP 4 Ca -0.01 -1.75 -0.24 0.00 0.71 0.00 0.00 54.79 53.49 1d9n n ASP 4 Cb 0.06 0.05 -0.05 0.00 -0.02 0.00 0.00 41.12 41.16 1d9n n ASP 4 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1d9n s TRP 5 N 0.00 1.49 0.15 1.24 0.52 -1.26 -4.06 118.94 117.01 1d9n s TRP 5 Ca 0.07 1.21 0.06 0.00 0.02 0.00 0.00 56.10 57.46 1d9n s TRP 5 Cb 0.07 -3.80 -0.04 0.00 -1.15 0.00 0.00 33.47 28.56 1d9n s TRP 5 CO -0.03 -1.83 0.01 -0.51 0.02 0.00 0.00 176.95 174.61 1d9n s LEU 6 N 11.79 3.40 0.26 2.99 1.43 -1.04 -4.87 118.68 132.65 1d9n s LEU 6 Ca 0.80 -0.30 -0.28 0.00 -1.03 0.00 0.00 54.13 53.32 1d9n s LEU 6 Cb -0.11 -2.08 -0.15 0.00 0.03 0.00 0.00 46.19 43.89 1d9n s LEU 6 CO 0.07 0.11 0.78 -0.67 0.23 0.00 0.00 176.35 176.87 1d9n n ASP 7 N 0.07 0.10 -4.40 2.29 -0.08 -1.26 -0.83 116.55 112.45 1d9n n ASP 7 Ca -0.10 1.14 -0.42 0.00 -1.51 0.00 0.00 54.79 53.90 1d9n n ASP 7 Cb 0.54 -1.14 -0.10 0.00 2.34 0.00 0.00 41.12 42.76 1d9n n ASP 7 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1d9n h PRO 9 N 8.56 0.18 -0.95 0.00 0.13 -1.90 0.19 132.00 138.22 1d9n h PRO 9 Ca -0.26 -0.22 0.27 0.00 -0.87 0.00 0.00 66.00 64.92 1d9n h PRO 9 Cb 1.11 0.07 -0.04 0.00 0.13 0.00 0.00 31.00 32.27 1d9n h PRO 9 CO 0.73 0.99 0.68 0.00 -0.23 0.00 0.00 178.00 180.18 1d9n h ALA 10 N 0.92 2.88 0.00 -0.56 0.00 -1.92 -3.31 119.26 117.27 1d9n h ALA 10 Ca -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1d9n h ALA 10 Cb 1.59 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.45 1d9n h ALA 10 CO 0.14 -1.15 -0.06 1.28 0.00 0.00 0.00 179.25 179.46 1d9n n LEU 11 N -4.26 0.55 0.00 0.00 4.77 -1.19 -4.90 117.00 111.97 1d9n n LEU 11 Ca 0.20 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1d9n n LEU 11 Cb 1.01 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.88 1d9n n LEU 11 CO 0.39 -0.59 0.00 0.61 -1.33 0.00 0.00 177.39 176.47 1d9n n GLY 12 N 3.22 -0.66 3.86 -0.72 0.00 0.67 -5.03 105.19 106.55 1d9n n GLY 12 Ca -0.01 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 1d9n n GLY 12 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1d9n s PRO 13 N -1.16 0.73 0.00 1.61 0.04 -1.26 -3.52 135.00 131.44 1d9n s PRO 13 Ca 0.00 -0.18 0.00 0.00 0.04 0.00 0.00 61.00 60.86 1d9n s PRO 13 Cb 0.00 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.71 1d9n s PRO 13 CO 0.00 -2.39 0.00 0.41 0.04 0.00 0.00 177.00 175.06 1d9n n GLY 14 N -3.13 0.30 3.72 0.56 0.00 -1.26 -4.83 105.19 100.55 1d9n n GLY 14 Ca 0.12 -0.00 -0.63 0.00 0.00 0.00 0.00 46.02 45.51 1d9n n GLY 14 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1d9n n TRP 15 N 0.00 1.87 -3.57 1.61 -0.00 -1.26 -4.68 117.44 111.41 1d9n n TRP 15 Ca 0.00 0.87 -0.40 0.00 -0.00 0.00 0.00 57.50 57.97 1d9n n TRP 15 Cb 0.00 -2.33 -0.11 0.00 -0.00 0.00 0.00 31.31 28.87 1d9n n TRP 15 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 1d9n s LYS 16 N 3.37 3.38 -0.41 5.87 -0.14 -1.02 -1.60 119.74 129.18 1d9n s LYS 16 Ca 1.03 -0.71 -0.20 0.00 -1.36 0.00 0.00 55.97 54.73 1d9n s LYS 16 Cb -1.31 -3.73 0.02 0.00 -1.68 0.00 0.00 37.83 31.13 1d9n s LYS 16 CO 0.74 -0.46 0.58 0.50 -0.76 0.00 0.00 175.35 175.95 1d9n s ARG 17 N 1.67 3.33 0.03 1.68 3.52 -0.01 -2.13 118.95 127.06 1d9n s ARG 17 Ca 0.05 -0.37 -0.01 0.00 -0.13 0.00 0.00 55.73 55.27 1d9n s ARG 17 Cb -0.17 -3.92 -0.04 0.00 -1.56 0.00 0.00 34.95 29.26 1d9n s ARG 17 CO 0.09 -0.90 0.19 0.50 -0.81 0.00 0.00 175.30 174.37 1d9n s ARG 18 N 2.62 3.40 -0.01 5.12 3.52 -0.88 -2.50 118.95 130.21 1d9n s ARG 18 Ca 0.20 -0.41 -0.01 0.00 -0.13 0.00 0.00 55.73 55.38 1d9n s ARG 18 Cb -0.15 -3.04 -0.04 0.00 -1.56 0.00 0.00 34.95 30.16 1d9n s ARG 18 CO 0.17 0.63 0.11 -1.83 -0.81 0.00 0.00 175.30 173.57 1d9n s GLU 19 N -2.28 3.19 0.20 5.12 -1.05 -1.26 -2.36 118.70 120.27 1d9n s GLU 19 Ca 0.32 -0.42 0.10 0.00 -0.15 0.00 0.00 54.97 54.82 1d9n s GLU 19 Cb -0.13 -2.94 -0.04 0.00 -0.44 0.00 0.00 34.13 30.58 1d9n s GLU 19 CO 0.24 0.66 -0.18 0.08 0.95 0.00 0.00 175.26 177.02 1d9n s VAL 20 N -1.21 2.70 -0.38 1.83 1.01 0.12 -4.83 120.40 119.63 1d9n s VAL 20 Ca 0.23 -1.93 0.05 0.00 0.00 0.00 0.00 61.98 60.34 1d9n s VAL 20 Cb -0.12 -2.33 0.45 0.00 0.00 0.00 0.00 36.38 34.38 1d9n s VAL 20 CO 0.14 -0.15 1.34 2.22 0.00 0.00 0.00 175.10 178.65 1d9n n PHE 21 N 0.06 2.91 -2.28 5.22 -1.74 -1.26 -3.37 117.46 117.00 1d9n n PHE 21 Ca -0.11 -2.45 -0.05 0.00 -0.56 0.00 0.00 57.45 54.27 1d9n n PHE 21 Cb 0.56 -0.51 -0.01 0.00 1.52 0.00 0.00 39.48 41.04 1d9n n PHE 21 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 1d9n n ARG 22 N -0.71 -2.43 0.00 3.97 1.74 -1.23 0.01 116.66 118.00 1d9n n ARG 22 Ca 0.47 0.27 0.00 0.00 -0.77 0.00 0.00 57.85 57.82 1d9n n ARG 22 Cb 0.87 -4.75 0.00 0.00 -1.02 0.00 0.00 32.46 27.56 1d9n n ARG 22 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1d9n n LYS 23 N -2.44 0.00 -0.24 5.56 5.02 -1.26 -2.69 118.16 122.10 1d9n n LYS 23 Ca -0.06 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.30 1d9n n LYS 23 Cb 0.49 0.00 0.19 0.00 -0.02 0.00 0.00 35.03 35.70 1d9n n LYS 23 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1d9n n SER 24 N 1.56 3.22 -3.89 4.39 3.41 -1.20 -4.72 113.62 116.40 1d9n n SER 24 Ca 0.00 -2.09 -0.42 0.00 -0.26 0.00 0.00 58.87 56.10 1d9n n SER 24 Cb 0.00 -0.31 0.01 0.00 -0.26 0.00 0.00 64.21 63.65 1d9n n SER 24 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1d9n n GLY 25 N 0.63 5.41 0.10 5.00 0.00 0.10 -4.64 105.19 111.79 1d9n n GLY 25 Ca 0.15 -2.65 -0.16 0.00 0.00 0.00 0.00 46.02 43.35 1d9n n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d9n h ALA 26 N 5.07 0.01 -0.29 4.61 0.00 -1.82 -3.34 119.26 123.50 1d9n h ALA 26 Ca 0.28 -0.53 -0.24 0.00 0.00 0.00 0.00 54.91 54.42 1d9n h ALA 26 Cb 0.54 0.03 -0.35 0.00 0.00 0.00 0.00 17.79 18.02 1d9n h ALA 26 CO 1.28 0.16 -0.96 -2.37 0.00 0.00 0.00 179.25 177.37 1d9n n THR 27 N -4.41 1.23 0.00 0.00 5.66 -1.26 -4.83 114.28 110.66 1d9n n THR 27 Ca -0.11 -2.60 0.00 0.00 -3.05 0.00 0.00 64.05 58.29 1d9n n THR 27 Cb 0.58 0.57 0.00 0.00 -1.55 0.00 0.00 70.33 69.93 1d9n n THR 27 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1d9n s GLY 29 N -1.00 2.71 0.87 0.00 0.00 -1.25 -5.02 107.32 103.63 1d9n s GLY 29 Ca 0.00 0.24 -0.14 0.00 0.00 0.00 0.00 44.72 44.82 1d9n s GLY 29 CO 0.00 0.64 0.48 -2.13 0.00 0.00 0.00 173.10 172.09 1d9n n ARG 30 N 0.97 -0.08 -3.79 2.90 3.00 -1.26 -4.62 116.66 113.78 1d9n n ARG 30 Ca -0.03 0.03 -0.37 0.00 -0.00 0.00 0.00 57.85 57.48 1d9n n ARG 30 Cb 0.50 -1.87 -0.13 0.00 0.00 0.00 0.00 32.46 30.96 1d9n n ARG 30 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1d9n s SER 31 N -1.84 5.03 0.56 6.15 1.04 -1.26 -3.56 113.70 119.82 1d9n s SER 31 Ca 0.60 -0.77 -0.03 0.00 0.48 0.00 0.00 55.95 56.23 1d9n s SER 31 Cb -0.26 -1.85 0.02 0.00 0.10 0.00 0.00 66.02 64.03 1d9n s SER 31 CO 0.64 -0.19 0.84 -1.81 0.98 0.00 0.00 173.24 173.69 1d9n s ASP 32 N 1.46 5.51 0.02 7.02 1.01 -1.22 -4.78 116.67 125.71 1d9n s ASP 32 Ca 0.02 0.47 0.04 0.00 0.71 0.00 0.00 52.55 53.79 1d9n s ASP 32 Cb -0.17 -1.47 -0.02 0.00 1.01 0.00 0.00 42.92 42.27 1d9n s ASP 32 CO 0.01 -1.05 -0.12 -0.89 0.21 0.00 0.00 175.17 173.33 1d9n s THR 33 N -2.88 0.97 0.29 -1.27 2.01 -1.26 0.14 115.64 113.64 1d9n s THR 33 Ca 0.54 -0.82 0.07 0.00 0.31 0.00 0.00 61.69 61.79 1d9n s THR 33 Cb -0.10 -0.87 -0.06 0.00 0.01 0.00 0.00 72.50 71.48 1d9n s THR 33 CO 0.42 0.05 -0.06 -0.31 -0.69 0.00 0.00 174.62 174.03 1d9n s TYR 34 N -0.69 2.03 0.09 4.92 2.02 -0.99 -4.84 117.35 119.90 1d9n s TYR 34 Ca 0.01 -0.67 0.10 0.00 -0.37 0.00 0.00 57.07 56.14 1d9n s TYR 34 Cb -0.07 -1.17 -0.03 0.00 -0.40 0.00 0.00 41.96 40.29 1d9n s TYR 34 CO 0.01 0.33 -0.25 0.71 -1.57 0.00 0.00 175.55 174.77 1d9n s TYR 35 N -2.95 2.18 -0.16 2.71 2.02 0.78 -2.08 117.35 119.86 1d9n s TYR 35 Ca 0.30 -0.39 -0.01 0.00 -0.37 0.00 0.00 57.07 56.59 1d9n s TYR 35 Cb 0.04 -1.23 0.05 0.00 -0.40 0.00 0.00 41.96 40.41 1d9n s TYR 35 CO 0.13 0.24 -0.02 -1.14 -1.57 0.00 0.00 175.55 173.19 1d9n s GLN 36 N -1.73 1.05 1.05 -0.62 -0.44 -0.90 -1.95 119.66 116.11 1d9n s GLN 36 Ca 0.12 -0.39 -0.15 0.00 -2.50 0.00 0.00 55.36 52.43 1d9n s GLN 36 Cb -0.10 -1.87 0.21 0.00 -1.64 0.00 0.00 33.01 29.62 1d9n s GLN 36 CO 0.04 -0.48 1.14 -1.54 0.50 0.00 0.00 175.29 174.95 1d9n s SER 37 N 1.76 2.27 0.00 6.67 1.04 -0.32 -2.43 113.70 122.68 1d9n s SER 37 Ca 0.01 0.81 0.25 0.00 0.48 0.00 0.00 55.95 57.50 1d9n s SER 37 Cb -0.15 -1.22 1.21 0.00 0.10 0.00 0.00 66.02 65.96 1d9n s SER 37 CO -0.07 -3.31 1.84 -0.81 0.98 0.00 0.00 173.24 171.87 1d9n n PRO 38 N -4.24 0.25 -0.03 4.02 -0.04 -1.26 -3.03 135.00 130.67 1d9n n PRO 38 Ca 0.10 0.05 0.03 0.00 -0.04 0.00 0.00 63.50 63.64 1d9n n PRO 38 Cb 0.59 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.42 1d9n n PRO 38 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1d9n n THR 39 N -1.35 0.33 0.00 0.52 -2.24 -1.26 -4.98 114.28 105.30 1d9n n THR 39 Ca 0.10 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 1d9n n THR 39 Cb 0.23 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 1d9n n THR 39 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1d9n n GLY 40 N 1.73 1.78 3.57 3.38 0.00 -1.17 -5.10 105.19 109.39 1d9n n GLY 40 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 1d9n n GLY 40 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1d9n s ASP 41 N -1.78 6.45 -0.56 1.61 -1.08 -1.26 -4.84 116.67 115.21 1d9n s ASP 41 Ca 0.00 0.20 -0.17 0.00 -0.52 0.00 0.00 52.55 52.06 1d9n s ASP 41 Cb 0.00 -2.34 0.12 0.00 -1.46 0.00 0.00 42.92 39.25 1d9n s ASP 41 CO 0.00 -0.60 0.58 -0.13 0.52 0.00 0.00 175.17 175.54 1d9n s ARG 42 N 2.74 3.02 0.06 4.34 3.00 -1.26 -1.18 118.95 129.68 1d9n s ARG 42 Ca 0.25 -1.58 0.07 0.00 0.00 0.00 0.00 55.73 54.47 1d9n s ARG 42 Cb -0.14 -4.29 -0.04 0.00 0.00 0.00 0.00 34.95 30.48 1d9n s ARG 42 CO 0.15 -1.41 -0.14 0.42 0.00 0.00 0.00 175.30 174.32 1d9n s ILE 43 N 1.97 3.09 0.00 1.52 1.09 -0.82 -4.92 121.20 123.12 1d9n s ILE 43 Ca 0.06 -1.19 0.00 0.00 -1.10 0.00 0.00 60.65 58.43 1d9n s ILE 43 Cb -0.28 -2.37 0.00 0.00 -1.06 0.00 0.00 42.46 38.76 1d9n s ILE 43 CO 0.04 0.25 0.17 -2.11 -0.10 0.00 0.00 174.94 173.19 1d9n n ARG 44 N 1.22 0.00 0.00 2.79 1.85 -1.26 -0.16 116.66 121.10 1d9n n ARG 44 Ca -0.15 -0.17 0.00 0.00 -1.00 0.00 0.00 57.85 56.53 1d9n n ARG 44 Cb 0.52 -0.49 0.00 0.00 -1.05 0.00 0.00 32.46 31.44 1d9n n ARG 44 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1d9n n SER 45 N 0.00 0.00 0.00 2.89 2.88 -1.26 -4.97 113.62 113.16 1d9n n SER 45 Ca 0.00 0.34 0.00 0.00 -1.33 0.00 0.00 58.87 57.88 1d9n n SER 45 Cb 0.34 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.80 1d9n n SER 45 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1d9n n LYS 46 N -0.38 0.00 0.03 -1.46 4.81 -1.26 -4.88 118.16 115.01 1d9n n LYS 46 Ca 0.00 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.55 1d9n n LYS 46 Cb 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 35.03 34.97 1d9n n LYS 46 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1d9n n VAL 47 N 0.00 0.20 0.09 3.15 0.31 -1.26 -3.50 118.33 117.32 1d9n n VAL 47 Ca 0.00 -0.43 -0.05 0.00 -0.01 0.00 0.00 64.34 63.85 1d9n n VAL 47 Cb 0.00 0.01 0.08 0.00 -0.91 0.00 0.00 33.84 33.03 1d9n n VAL 47 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1d9n h GLU 48 N 0.00 0.16 0.00 5.55 5.08 -1.97 -1.19 114.58 122.21 1d9n h GLU 48 Ca 0.00 -0.14 -0.19 0.00 -1.00 0.00 0.00 59.36 58.04 1d9n h GLU 48 Cb 0.91 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.17 1d9n h GLU 48 CO 0.00 0.80 -0.90 1.37 -1.00 0.00 0.00 179.01 179.28 1d9n h LEU 49 N 0.11 0.00 0.01 1.33 8.10 -1.94 -2.60 115.31 120.32 1d9n h LEU 49 Ca -0.02 0.00 -0.00 0.00 0.11 0.00 0.00 57.88 57.97 1d9n h LEU 49 Cb 1.24 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.46 1d9n h LEU 49 CO 0.10 0.90 -0.00 0.00 -4.11 0.00 0.00 178.44 175.33 1d9n h THR 50 N 0.00 1.38 -0.04 0.15 1.03 -1.55 -2.78 112.91 111.10 1d9n h THR 50 Ca -0.01 -1.18 0.01 0.00 -0.01 0.00 0.00 66.41 65.22 1d9n h THR 50 Cb 1.63 2.18 -0.00 0.00 -1.07 0.00 0.00 68.15 70.89 1d9n h THR 50 CO 0.12 0.30 0.03 0.08 -0.01 0.00 0.00 175.52 176.04 1d9n h ARG 51 N -0.52 0.00 0.44 0.00 0.11 -1.28 -1.09 114.38 112.04 1d9n h ARG 51 Ca -0.00 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.07 1d9n h ARG 51 Cb 0.51 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.57 1d9n h ARG 51 CO 0.00 0.00 -0.37 -0.92 0.10 0.00 0.00 179.97 178.78 1d9n h TYR 52 N 0.00 -1.01 -0.80 4.08 3.20 -1.19 -2.36 116.97 118.89 1d9n h TYR 52 Ca 0.02 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 1d9n h TYR 52 Cb 0.07 0.38 -0.04 0.00 1.54 0.00 0.00 36.73 38.69 1d9n h TYR 52 CO 0.00 -0.54 0.39 -0.07 -1.64 0.00 0.00 178.16 176.30 1d9n h LEU 53 N -0.82 1.05 0.00 2.82 4.07 -1.25 -3.49 115.31 117.69 1d9n h LEU 53 Ca -0.04 -0.13 0.00 0.00 0.08 0.00 0.00 57.88 57.79 1d9n h LEU 53 Cb 0.71 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 42.18 1d9n h LEU 53 CO -0.02 0.88 0.00 0.61 -1.08 0.00 0.00 178.44 178.83 1d9n n GLY 54 N -1.00 0.67 0.00 0.83 0.00 -0.47 -4.70 105.19 100.52 1d9n n GLY 54 Ca 0.08 -2.11 0.13 0.00 0.00 0.00 0.00 46.02 44.11 1d9n n GLY 54 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1d9n n PRO 55 N 0.00 0.25 0.07 1.61 -0.04 -1.26 -3.10 135.00 132.53 1d9n n PRO 55 Ca 0.00 0.04 0.12 0.00 -0.04 0.00 0.00 63.50 63.61 1d9n n PRO 55 Cb 0.00 -1.50 0.46 0.00 -0.04 0.00 0.00 33.50 32.42 1d9n n PRO 55 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1d9n n ALA 56 N -1.36 1.97 -3.55 0.55 0.00 -1.26 -4.68 120.51 112.18 1d9n n ALA 56 Ca 0.11 -0.01 -0.15 0.00 0.00 0.00 0.00 53.44 53.38 1d9n n ALA 56 Cb 0.25 -1.40 -0.16 0.00 0.00 0.00 0.00 19.45 18.14 1d9n n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d9n s ASP 58 N 0.81 3.52 0.00 0.00 2.15 -1.26 -4.60 116.67 117.29 1d9n s ASP 58 Ca -0.08 -0.89 0.00 0.00 0.43 0.00 0.00 52.55 52.01 1d9n s ASP 58 Cb -0.11 -0.29 0.00 0.00 -0.30 0.00 0.00 42.92 42.22 1d9n s ASP 58 CO -0.02 0.10 0.62 0.18 -0.17 0.00 0.00 175.17 175.88 1d9n n LEU 59 N 0.03 0.00 -0.26 -1.34 4.32 -1.26 -4.81 117.00 113.68 1d9n n LEU 59 Ca -0.11 -0.75 0.08 0.00 -0.02 0.00 0.00 56.01 55.22 1d9n n LEU 59 Cb 0.57 0.00 0.33 0.00 -1.62 0.00 0.00 43.42 42.70 1d9n n LEU 59 CO 0.32 0.47 1.23 0.74 -1.22 0.00 0.00 177.39 178.92 1d9n h THR 60 N 5.11 0.95 -0.32 -5.08 2.02 -1.91 -1.60 112.91 112.08 1d9n h THR 60 Ca 0.00 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 66.90 1d9n h THR 60 Cb 1.15 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 1d9n h THR 60 CO 0.00 0.15 0.00 0.18 0.37 0.00 0.00 175.52 176.22 1d9n n LEU 61 N -4.52 2.85 -4.73 2.58 7.99 -1.26 -4.99 117.00 114.92 1d9n n LEU 61 Ca 0.14 -1.89 -0.41 0.00 -0.01 0.00 0.00 56.01 53.84 1d9n n LEU 61 Cb 0.32 -0.21 -0.03 0.00 -0.11 0.00 0.00 43.42 43.39 1d9n n LEU 61 CO 0.31 0.70 0.94 0.12 -1.51 0.00 0.00 177.39 177.96 1d9n s PHE 62 N -1.00 3.34 -0.65 -1.77 5.36 -0.60 -3.25 117.98 119.41 1d9n s PHE 62 Ca 0.23 1.27 -0.23 0.00 -0.96 0.00 0.00 56.93 57.24 1d9n s PHE 62 Cb 0.12 -3.53 0.06 0.00 -0.34 0.00 0.00 43.02 39.34 1d9n s PHE 62 CO 0.16 -1.61 1.00 0.34 -1.46 0.00 0.00 175.22 173.64 1d9n s ASP 63 N 0.45 6.19 -0.47 6.13 2.15 0.62 -4.90 116.67 126.83 1d9n s ASP 63 Ca 0.56 -0.85 -0.21 0.00 0.43 0.00 0.00 52.55 52.48 1d9n s ASP 63 Cb -0.34 -2.44 -0.20 0.00 -0.30 0.00 0.00 42.92 39.64 1d9n s ASP 63 CO 0.35 -1.46 1.75 0.33 -0.17 0.00 0.00 175.17 175.98 1d9n n PHE 64 N 7.87 1.03 0.00 -5.34 -0.00 -1.26 -2.17 117.46 117.58 1d9n n PHE 64 Ca -0.02 -1.28 0.00 0.00 -0.00 0.00 0.00 57.45 56.15 1d9n n PHE 64 Cb 0.46 -1.29 0.00 0.00 -0.00 0.00 0.00 39.48 38.65 1d9n n PHE 64 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.76 177.93 1d9n n LYS 65 N 6.80 0.00 -0.00 -4.13 0.00 -1.26 -4.15 118.16 115.42 1d9n n LYS 65 Ca 0.43 0.00 -0.04 0.00 0.00 0.00 0.00 58.31 58.71 1d9n n LYS 65 Cb 0.34 0.00 -0.12 0.00 0.00 0.00 0.00 35.03 35.25 1d9n n LYS 65 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1d9n n GLN 66 N 0.00 0.63 -1.03 1.64 6.02 -0.92 -4.83 117.38 118.89 1d9n n GLN 66 Ca 0.00 0.21 0.00 0.00 -0.01 0.00 0.00 57.00 57.20 1d9n n GLN 66 Cb 0.00 -1.76 0.00 0.00 1.02 0.00 0.00 30.24 29.50 1d9n n GLN 66 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1d9n n GLY 67 N 1.49 1.14 3.26 1.08 0.00 -1.03 -5.06 105.19 106.06 1d9n n GLY 67 Ca -0.15 -0.39 -0.16 0.00 0.00 0.00 0.00 46.02 45.33 1d9n n GLY 67 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1d9n s ILE 68 N -2.17 0.00 0.00 -0.61 -5.25 -1.26 -4.15 121.20 107.76 1d9n s ILE 68 Ca 0.00 -1.98 0.00 0.00 -0.99 0.00 0.00 60.65 57.68 1d9n s ILE 68 Cb 0.00 -2.50 0.00 0.00 2.95 0.00 0.00 42.46 42.91 1d9n s ILE 68 CO 0.00 0.00 0.00 0.00 -1.79 0.00 0.00 174.94 173.15 1d9n n LEU 69 N -0.45 0.00 0.00 0.37 -0.00 -1.26 0.23 117.00 115.88 1d9n n LEU 69 Ca 0.05 0.00 -0.06 0.00 -0.00 0.00 0.00 56.01 56.00 1d9n n LEU 69 Cb 0.64 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 44.08 1d9n n LEU 69 CO 0.32 0.00 0.34 0.00 -0.00 0.00 0.00 177.39 178.05 1d9n s TYR 71 N -4.66 -0.51 0.08 0.00 -0.85 -1.26 -4.41 117.35 105.75 1d9n s TYR 71 Ca 0.10 1.05 -0.30 0.00 -0.52 0.00 0.00 57.07 57.40 1d9n s TYR 71 Cb -0.03 0.39 -0.05 0.00 0.38 0.00 0.00 41.96 42.65 1d9n s TYR 71 CO 0.08 -0.36 1.04 -1.25 -1.52 0.00 0.00 175.55 173.53 1d9n s PRO 72 N -0.52 4.59 -0.39 -3.49 0.04 -1.26 -4.99 135.00 128.99 1d9n s PRO 72 Ca -0.02 1.55 0.10 0.00 0.04 0.00 0.00 61.00 62.68 1d9n s PRO 72 Cb -0.02 -3.38 0.30 0.00 0.04 0.00 0.00 34.50 31.44 1d9n s PRO 72 CO 0.01 0.02 0.66 0.00 0.04 0.00 0.00 177.00 177.73 1d9n n ALA 73 N 3.24 1.98 -2.61 8.56 0.00 -1.26 -5.10 120.51 125.33 1d9n n ALA 73 Ca 0.05 -3.27 -0.42 0.00 0.00 0.00 0.00 53.44 49.79 1d9n n ALA 73 Cb 0.49 -0.90 -0.03 0.00 0.00 0.00 0.00 19.45 19.01 1d9n n ALA 73 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1d9n s PRO 74 N -1.70 4.43 0.00 0.00 0.04 -1.26 -5.38 135.00 131.13 1d9n s PRO 74 Ca 0.37 1.50 0.00 0.00 0.04 0.00 0.00 61.00 62.91 1d9n s PRO 74 Cb 0.27 -3.52 0.00 0.00 0.04 0.00 0.00 34.50 31.29 1d9n s PRO 74 CO -0.10 -0.29 0.00 0.36 0.04 0.00 0.00 177.00 177.01