#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 -0.18 -3.31 -5.12 0.00 -1.26 -4.95 120.51 105.68 1d9n n ALA 2 Ca 0.00 0.19 -0.14 0.00 0.00 0.00 0.00 53.44 53.50 1d9n n ALA 2 Cb 0.00 -1.52 -0.09 0.00 0.00 0.00 0.00 19.45 17.84 1d9n n ALA 2 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1d9n s GLU 3 N -2.90 0.63 -0.58 0.00 2.02 -1.26 -5.03 118.70 111.58 1d9n s GLU 3 Ca 0.00 0.25 0.06 0.00 0.02 0.00 0.00 54.97 55.30 1d9n s GLU 3 Cb 0.00 0.29 0.28 0.00 0.10 0.00 0.00 34.13 34.80 1d9n s GLU 3 CO 0.00 -0.14 0.78 -3.47 0.02 0.00 0.00 175.26 172.45 1d9n n ASP 4 N 2.01 3.45 -4.34 -0.19 2.03 -1.26 -5.05 116.55 113.20 1d9n n ASP 4 Ca -0.17 -3.42 -0.54 0.00 0.52 0.00 0.00 54.79 51.18 1d9n n ASP 4 Cb 0.57 -0.63 -0.11 0.00 -0.72 0.00 0.00 41.12 40.22 1d9n n ASP 4 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 1d9n n TRP 5 N 0.56 1.20 -4.21 -0.67 7.02 -1.26 -4.75 117.44 115.34 1d9n n TRP 5 Ca 0.29 0.57 -0.23 0.00 -1.02 0.00 0.00 57.50 57.11 1d9n n TRP 5 Cb 0.43 -2.37 -0.06 0.00 -2.42 0.00 0.00 31.31 26.88 1d9n n TRP 5 CO 0.00 0.00 0.00 -0.48 -2.02 0.00 0.00 177.69 175.19 1d9n s LEU 6 N 6.91 3.47 0.30 -0.99 2.34 -1.03 -4.90 118.68 124.77 1d9n s LEU 6 Ca 1.19 -0.44 -0.29 0.00 0.06 0.00 0.00 54.13 54.66 1d9n s LEU 6 Cb -1.26 -2.02 -0.13 0.00 -0.56 0.00 0.00 46.19 42.22 1d9n s LEU 6 CO 0.58 0.01 1.20 -0.90 -1.06 0.00 0.00 176.35 176.18 1d9n n ASP 7 N -0.83 2.17 -4.46 1.48 5.68 -1.26 -1.24 116.55 118.09 1d9n n ASP 7 Ca -0.08 1.18 -0.43 0.00 -0.50 0.00 0.00 54.79 54.97 1d9n n ASP 7 Cb 0.58 -1.39 -0.09 0.00 -1.14 0.00 0.00 41.12 39.07 1d9n n ASP 7 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1d9n h PRO 9 N 8.68 0.58 -1.55 0.00 0.13 -1.89 -0.23 132.00 137.72 1d9n h PRO 9 Ca -0.27 -0.72 0.46 0.00 -0.87 0.00 0.00 66.00 64.60 1d9n h PRO 9 Cb 1.12 0.23 -0.09 0.00 0.13 0.00 0.00 31.00 32.39 1d9n h PRO 9 CO 0.78 1.31 1.08 0.00 -0.23 0.00 0.00 178.00 180.94 1d9n h ALA 10 N 0.42 3.27 0.00 -0.56 0.00 -1.92 -3.25 119.26 117.22 1d9n h ALA 10 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1d9n h ALA 10 Cb 1.82 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1d9n h ALA 10 CO 0.22 -1.80 -0.06 1.28 0.00 0.00 0.00 179.25 178.88 1d9n n LEU 11 N -4.26 0.38 0.00 0.00 4.77 -1.22 -4.90 117.00 111.78 1d9n n LEU 11 Ca 0.37 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 1d9n n LEU 11 Cb 1.61 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 42.50 1d9n n LEU 11 CO 0.35 -0.55 0.00 0.61 -1.33 0.00 0.00 177.39 176.48 1d9n n GLY 12 N 3.09 -0.62 3.85 -0.72 0.00 -0.10 -5.05 105.19 105.65 1d9n n GLY 12 Ca -0.01 -0.56 -0.29 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.29 1.75 0.00 1.61 0.04 -1.26 -3.83 135.00 132.02 1d9n s PRO 13 Ca 0.00 0.24 0.00 0.00 0.04 0.00 0.00 61.00 61.28 1d9n s PRO 13 Cb 0.00 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.63 1d9n s PRO 13 CO 0.00 -1.77 0.00 0.41 0.04 0.00 0.00 177.00 175.68 1d9n n GLY 14 N -2.82 1.17 3.68 0.56 0.00 -1.26 -4.89 105.19 101.62 1d9n n GLY 14 Ca 0.07 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1d9n n GLY 14 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1d9n s TRP 15 N 0.00 1.99 -0.26 1.61 -0.11 -1.26 -4.24 118.94 116.67 1d9n s TRP 15 Ca 0.00 -0.02 -0.09 0.00 1.22 0.00 0.00 56.10 57.21 1d9n s TRP 15 Cb 0.00 -4.11 -0.04 0.00 -1.50 0.00 0.00 33.47 27.82 1d9n s TRP 15 CO 0.00 -4.68 0.12 0.15 -4.62 0.00 0.00 176.95 167.91 1d9n s LYS 16 N 3.26 3.79 -0.35 5.86 3.01 -1.06 -1.82 119.74 132.43 1d9n s LYS 16 Ca 0.80 -0.41 -0.17 0.00 -1.01 0.00 0.00 55.97 55.19 1d9n s LYS 16 Cb -0.42 -3.45 -0.01 0.00 -1.01 0.00 0.00 37.83 32.94 1d9n s LYS 16 CO 0.36 -0.16 0.44 0.50 0.51 0.00 0.00 175.35 177.00 1d9n s ARG 17 N 1.61 3.58 -0.12 1.68 3.52 -0.38 -2.35 118.95 126.49 1d9n s ARG 17 Ca 0.06 -0.29 -0.07 0.00 -0.13 0.00 0.00 55.73 55.30 1d9n s ARG 17 Cb -0.15 -3.81 -0.04 0.00 -1.56 0.00 0.00 34.95 29.39 1d9n s ARG 17 CO 0.06 -0.60 0.13 0.50 -0.81 0.00 0.00 175.30 174.59 1d9n s ARG 18 N 2.22 3.47 0.00 5.12 3.00 -0.41 -2.48 118.95 129.88 1d9n s ARG 18 Ca 0.15 -0.15 0.02 0.00 -1.00 0.00 0.00 55.73 54.76 1d9n s ARG 18 Cb -0.16 -3.19 -0.04 0.00 0.00 0.00 0.00 34.95 31.56 1d9n s ARG 18 CO 0.13 0.75 -0.02 -1.83 0.00 0.00 0.00 175.30 174.33 1d9n s GLU 19 N -0.94 2.72 0.19 5.12 -1.05 -1.26 -2.01 118.70 121.46 1d9n s GLU 19 Ca 0.14 -0.65 0.07 0.00 -0.15 0.00 0.00 54.97 54.39 1d9n s GLU 19 Cb -0.12 -2.62 -0.05 0.00 -0.44 0.00 0.00 34.13 30.90 1d9n s GLU 19 CO 0.04 0.62 -0.13 0.08 0.95 0.00 0.00 175.26 176.81 1d9n s VAL 20 N -1.07 1.56 -0.70 1.83 1.01 0.49 -4.72 120.40 118.79 1d9n s VAL 20 Ca 0.19 -2.16 0.04 0.00 0.00 0.00 0.00 61.98 60.05 1d9n s VAL 20 Cb -0.11 -1.97 0.29 0.00 0.00 0.00 0.00 36.38 34.58 1d9n s VAL 20 CO 0.10 -0.64 0.98 2.22 0.00 0.00 0.00 175.10 177.76 1d9n n PHE 21 N -0.31 3.54 -1.52 5.22 -1.74 -1.26 -3.22 117.46 118.18 1d9n n PHE 21 Ca -0.09 -3.80 -0.16 0.00 -0.56 0.00 0.00 57.45 52.85 1d9n n PHE 21 Cb 0.60 -0.67 -0.13 0.00 1.52 0.00 0.00 39.48 40.81 1d9n n PHE 21 CO 0.00 0.00 0.00 2.89 -0.56 0.00 0.00 176.76 179.09 1d9n n ARG 22 N 0.51 0.31 -1.47 3.97 -4.01 -1.26 -4.55 116.66 110.16 1d9n n ARG 22 Ca 0.31 -0.58 0.19 0.00 -1.04 0.00 0.00 57.85 56.72 1d9n n ARG 22 Cb 0.38 -2.66 -0.07 0.00 -3.04 0.00 0.00 32.46 27.06 1d9n n ARG 22 CO 0.00 0.00 0.00 1.63 -3.04 0.00 0.00 177.63 176.22 1d9n n LYS 23 N 7.42 -3.22 -4.45 2.89 5.02 -1.26 -4.93 118.16 119.63 1d9n n LYS 23 Ca 0.52 2.46 -0.25 0.00 -2.02 0.00 0.00 58.31 59.01 1d9n n LYS 23 Cb 0.34 -3.83 -0.11 0.00 -0.02 0.00 0.00 35.03 31.41 1d9n n LYS 23 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1d9n s SER 24 N -7.29 3.53 0.00 4.39 0.15 -1.26 -5.07 113.70 108.15 1d9n s SER 24 Ca 0.00 -0.97 0.00 0.00 0.70 0.00 0.00 55.95 55.68 1d9n s SER 24 Cb 0.00 -0.28 0.00 0.00 -1.71 0.00 0.00 66.02 64.03 1d9n s SER 24 CO 0.00 0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.12 1d9n n GLY 25 N -0.32 0.92 3.32 9.45 0.00 -1.26 -5.14 105.19 112.17 1d9n n GLY 25 Ca -0.08 0.42 -0.32 0.00 0.00 0.00 0.00 46.02 46.05 1d9n n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d9n n ALA 26 N -3.00 -3.83 -1.65 4.61 0.00 -1.26 -4.67 120.51 110.72 1d9n n ALA 26 Ca 0.00 -1.23 -0.30 0.00 0.00 0.00 0.00 53.44 51.91 1d9n n ALA 26 Cb 0.00 -1.63 -0.04 0.00 0.00 0.00 0.00 19.45 17.78 1d9n n ALA 26 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1d9n s THR 27 N -2.28 3.07 -1.34 0.00 -1.32 -1.26 -3.05 115.64 109.47 1d9n s THR 27 Ca 0.59 0.00 -0.05 0.00 -1.21 0.00 0.00 61.69 61.02 1d9n s THR 27 Cb -0.15 -3.18 -0.00 0.00 -1.51 0.00 0.00 72.50 67.65 1d9n s THR 27 CO 0.66 -0.18 0.52 0.00 -2.21 0.00 0.00 174.62 173.41 1d9n h GLY 29 N -1.87 -1.32 -3.60 0.00 0.00 -1.87 -3.46 103.07 90.95 1d9n h GLY 29 Ca -0.64 0.49 -0.07 0.00 0.00 0.00 0.00 47.33 47.11 1d9n h GLY 29 CO 0.59 -0.48 -0.13 1.09 0.00 0.00 0.00 176.54 177.62 1d9n s ARG 30 N -5.71 0.93 0.01 4.80 1.70 -1.26 -5.10 118.95 114.32 1d9n s ARG 30 Ca -0.18 -0.47 -0.02 0.00 -0.47 0.00 0.00 55.73 54.59 1d9n s ARG 30 Cb 0.02 0.41 -0.01 0.00 -0.57 0.00 0.00 34.95 34.80 1d9n s ARG 30 CO 0.55 -0.33 0.02 -1.54 -1.08 0.00 0.00 175.30 172.92 1d9n s SER 31 N -2.20 0.16 0.24 -2.89 1.04 -1.26 -4.76 113.70 104.03 1d9n s SER 31 Ca -0.03 -0.37 -0.30 0.00 0.48 0.00 0.00 55.95 55.73 1d9n s SER 31 Cb -0.00 0.12 -0.09 0.00 0.10 0.00 0.00 66.02 66.15 1d9n s SER 31 CO -0.05 -0.28 0.95 -1.81 0.98 0.00 0.00 173.24 173.03 1d9n s ASP 32 N -1.27 7.63 -0.09 7.02 1.01 -1.20 -4.63 116.67 125.15 1d9n s ASP 32 Ca -0.14 1.96 0.01 0.00 0.71 0.00 0.00 52.55 55.09 1d9n s ASP 32 Cb -0.08 -2.61 0.02 0.00 1.01 0.00 0.00 42.92 41.25 1d9n s ASP 32 CO -0.00 0.14 -0.11 -0.89 0.21 0.00 0.00 175.17 174.52 1d9n s THR 33 N -1.15 1.13 0.37 -1.27 2.01 -1.26 -0.38 115.64 115.09 1d9n s THR 33 Ca 0.41 -0.43 0.08 0.00 0.31 0.00 0.00 61.69 62.07 1d9n s THR 33 Cb -0.26 -1.07 -0.05 0.00 0.01 0.00 0.00 72.50 71.13 1d9n s THR 33 CO 0.32 0.37 0.09 -0.31 -0.69 0.00 0.00 174.62 174.40 1d9n s TYR 34 N 1.06 2.59 0.02 4.92 1.51 -0.85 -4.89 117.35 121.70 1d9n s TYR 34 Ca -0.07 -0.51 0.02 0.00 -1.01 0.00 0.00 57.07 55.50 1d9n s TYR 34 Cb -0.15 -1.70 -0.02 0.00 -0.11 0.00 0.00 41.96 39.99 1d9n s TYR 34 CO -0.01 0.36 -0.06 0.71 -1.11 0.00 0.00 175.55 175.43 1d9n s TYR 35 N -2.55 0.52 -0.09 2.71 1.51 -0.96 -1.28 117.35 117.19 1d9n s TYR 35 Ca 0.37 -0.34 0.01 0.00 -1.01 0.00 0.00 57.07 56.10 1d9n s TYR 35 Cb 0.02 -0.32 0.02 0.00 -0.11 0.00 0.00 41.96 41.57 1d9n s TYR 35 CO 0.21 -0.07 -0.11 -1.14 -1.11 0.00 0.00 175.55 173.33 1d9n s GLN 36 N -1.01 1.71 1.17 -0.62 0.74 -0.99 -1.21 119.66 119.45 1d9n s GLN 36 Ca -0.06 -0.37 -0.17 0.00 0.05 0.00 0.00 55.36 54.81 1d9n s GLN 36 Cb -0.07 -1.57 0.27 0.00 1.10 0.00 0.00 33.01 32.74 1d9n s GLN 36 CO 0.00 -0.12 1.08 -1.12 -0.55 0.00 0.00 175.29 174.58 1d9n s SER 37 N 1.18 1.15 0.00 6.67 0.01 -0.17 -2.57 113.70 119.96 1d9n s SER 37 Ca -0.04 0.88 0.13 0.00 1.31 0.00 0.00 55.95 58.23 1d9n s SER 37 Cb -0.14 -1.30 0.81 0.00 0.21 0.00 0.00 66.02 65.60 1d9n s SER 37 CO -0.03 -4.01 1.45 -0.81 0.41 0.00 0.00 173.24 170.25 1d9n n PRO 38 N -4.72 0.91 -0.01 12.44 -0.04 -1.26 -3.13 135.00 139.19 1d9n n PRO 38 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1d9n n PRO 38 Cb 0.59 -1.23 -0.04 0.00 -0.04 0.00 0.00 33.50 32.77 1d9n n PRO 38 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1d9n n THR 39 N -0.73 0.18 0.00 0.52 5.66 -1.26 -5.00 114.28 113.65 1d9n n THR 39 Ca 0.10 -0.18 0.00 0.00 -3.05 0.00 0.00 64.05 60.92 1d9n n THR 39 Cb 0.05 -0.22 0.00 0.00 -1.55 0.00 0.00 70.33 68.60 1d9n n THR 39 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1d9n n GLY 40 N 2.41 1.17 3.55 1.09 0.00 -1.18 -5.10 105.19 107.12 1d9n n GLY 40 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.58 6.39 -0.05 1.61 -1.08 -1.26 -4.85 116.67 115.85 1d9n s ASP 41 Ca 0.00 -0.06 -0.12 0.00 -0.52 0.00 0.00 52.55 51.85 1d9n s ASP 41 Cb 0.00 -2.33 -0.05 0.00 -1.46 0.00 0.00 42.92 39.08 1d9n s ASP 41 CO 0.00 -0.69 0.32 -0.13 0.52 0.00 0.00 175.17 175.18 1d9n s ARG 42 N 2.81 3.79 0.11 4.34 3.00 -1.26 -1.00 118.95 130.74 1d9n s ARG 42 Ca 0.24 0.22 0.01 0.00 0.00 0.00 0.00 55.73 56.21 1d9n s ARG 42 Cb -0.14 -3.22 -0.04 0.00 0.00 0.00 0.00 34.95 31.54 1d9n s ARG 42 CO 0.17 0.69 -0.04 0.42 0.00 0.00 0.00 175.30 176.54 1d9n s ILE 43 N -0.96 0.64 0.00 1.52 1.01 -0.35 -4.99 121.20 118.07 1d9n s ILE 43 Ca 0.21 -1.94 0.00 0.00 0.00 0.00 0.00 60.65 58.92 1d9n s ILE 43 Cb -0.15 -1.79 0.00 0.00 0.01 0.00 0.00 42.46 40.53 1d9n s ILE 43 CO 0.10 -0.77 0.44 -1.14 0.00 0.00 0.00 174.94 173.57 1d9n n ARG 44 N -0.08 0.00 -0.94 2.79 0.63 -1.26 -2.27 116.66 115.52 1d9n n ARG 44 Ca -0.11 -0.28 0.02 0.00 -0.92 0.00 0.00 57.85 56.57 1d9n n ARG 44 Cb 0.61 -0.19 0.37 0.00 0.45 0.00 0.00 32.46 33.71 1d9n n ARG 44 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1d9n n SER 45 N 0.00 5.39 0.00 6.15 7.64 -1.26 -4.99 113.62 126.55 1d9n n SER 45 Ca 0.00 -3.02 0.00 0.00 1.01 0.00 0.00 58.87 56.86 1d9n n SER 45 Cb 0.54 -0.71 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 1d9n n SER 45 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1d9n n LYS 46 N 0.35 0.00 -0.26 1.43 4.81 -1.26 -2.35 118.16 120.88 1d9n n LYS 46 Ca 0.32 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.78 1d9n n LYS 46 Cb 1.26 0.00 0.24 0.00 0.02 0.00 0.00 35.03 36.55 1d9n n LYS 46 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1d9n h VAL 47 N 0.00 1.15 -0.81 3.15 2.07 -1.94 -0.81 116.25 119.05 1d9n h VAL 47 Ca 0.00 -0.36 0.15 0.00 0.82 0.00 0.00 66.70 67.32 1d9n h VAL 47 Cb 0.00 0.02 -0.10 0.00 -1.52 0.00 0.00 31.29 29.69 1d9n h VAL 47 CO 0.00 0.19 0.36 -0.08 0.02 0.00 0.00 177.57 178.06 1d9n h GLU 48 N 1.04 0.49 0.00 1.57 4.81 -1.87 1.14 114.58 121.76 1d9n h GLU 48 Ca 0.32 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.47 1d9n h GLU 48 Cb 0.01 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 1d9n h GLU 48 CO -0.09 0.33 -0.25 1.37 -0.73 0.00 0.00 179.01 179.63 1d9n h LEU 49 N 0.51 0.00 0.17 1.64 8.10 -1.40 -1.58 115.31 122.74 1d9n h LEU 49 Ca 0.45 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 58.43 1d9n h LEU 49 Cb 0.70 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.92 1d9n h LEU 49 CO -0.40 0.25 -0.08 0.74 -4.11 0.00 0.00 178.44 174.84 1d9n h THR 50 N 0.00 0.00 -0.53 0.15 2.02 0.16 -2.93 112.91 111.79 1d9n h THR 50 Ca -0.00 -0.21 0.15 0.00 0.77 0.00 0.00 66.41 67.12 1d9n h THR 50 Cb 0.52 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 1d9n h THR 50 CO 0.03 0.00 0.72 0.08 0.37 0.00 0.00 175.52 176.73 1d9n h ARG 51 N -0.44 0.00 0.83 6.66 0.11 -0.73 0.28 114.38 121.09 1d9n h ARG 51 Ca -0.02 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.02 1d9n h ARG 51 Cb 0.17 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.26 1d9n h ARG 51 CO 0.04 0.00 -0.40 -0.92 0.10 0.00 0.00 179.97 178.79 1d9n h TYR 52 N 0.00 -1.04 0.51 4.08 3.20 -1.14 -3.26 116.97 119.32 1d9n h TYR 52 Ca 0.25 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.07 1d9n h TYR 52 Cb 1.70 0.34 0.00 0.00 1.54 0.00 0.00 36.73 40.31 1d9n h TYR 52 CO 0.00 -0.65 -0.24 -0.07 -1.64 0.00 0.00 178.16 175.56 1d9n h LEU 53 N -1.29 -0.58 0.00 2.82 4.07 -0.80 -3.49 115.31 116.04 1d9n h LEU 53 Ca -0.11 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.85 1d9n h LEU 53 Cb 0.86 0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.75 1d9n h LEU 53 CO 0.19 -0.39 0.00 0.61 -1.08 0.00 0.00 178.44 177.77 1d9n n GLY 54 N -1.28 0.68 0.21 0.83 0.00 -0.67 -4.84 105.19 100.12 1d9n n GLY 54 Ca -0.12 -1.64 0.13 0.00 0.00 0.00 0.00 46.02 44.39 1d9n n GLY 54 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1d9n h PRO 55 N 0.00 0.00 0.00 1.61 0.13 -1.90 -3.12 132.00 128.71 1d9n h PRO 55 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1d9n h PRO 55 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1d9n h PRO 55 CO 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 177.77 1d9n n ALA 56 N -2.03 1.48 -2.98 -0.56 0.00 -1.26 -4.58 120.51 110.58 1d9n n ALA 56 Ca 0.04 -0.02 -0.19 0.00 0.00 0.00 0.00 53.44 53.27 1d9n n ALA 56 Cb 0.46 -1.19 -0.15 0.00 0.00 0.00 0.00 19.45 18.57 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 0.14 1.60 0.00 0.00 2.15 -1.26 -4.70 116.67 114.60 1d9n s ASP 58 Ca -0.02 -0.56 0.00 0.00 0.43 0.00 0.00 52.55 52.41 1d9n s ASP 58 Cb -0.07 -0.06 0.00 0.00 -0.30 0.00 0.00 42.92 42.49 1d9n s ASP 58 CO 0.00 -0.05 0.32 0.18 -0.17 0.00 0.00 175.17 175.45 1d9n n LEU 59 N 1.50 0.00 -0.18 -1.34 4.32 -1.26 -4.77 117.00 115.27 1d9n n LEU 59 Ca -0.20 -0.25 0.29 0.00 -0.02 0.00 0.00 56.01 55.83 1d9n n LEU 59 Cb 0.54 0.00 0.72 0.00 -1.62 0.00 0.00 43.42 43.07 1d9n n LEU 59 CO 0.22 0.22 1.27 0.74 -1.22 0.00 0.00 177.39 178.62 1d9n h THR 60 N 3.16 0.45 -0.00 -5.08 2.02 -1.95 0.29 112.91 111.80 1d9n h THR 60 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1d9n h THR 60 Cb 1.01 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1d9n h THR 60 CO 0.00 0.00 -0.38 0.18 0.37 0.00 0.00 175.52 175.69 1d9n n LEU 61 N -4.10 0.68 -4.72 2.58 7.99 -1.26 -4.99 117.00 113.18 1d9n n LEU 61 Ca 0.19 -0.58 -0.43 0.00 -0.01 0.00 0.00 56.01 55.19 1d9n n LEU 61 Cb 1.02 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 44.30 1d9n n LEU 61 CO 0.37 0.15 1.32 0.33 -1.51 0.00 0.00 177.39 178.05 1d9n n PHE 62 N -0.93 2.71 -2.63 -1.77 7.35 0.10 -4.27 117.46 118.01 1d9n n PHE 62 Ca 0.02 0.12 -0.43 0.00 -0.76 0.00 0.00 57.45 56.40 1d9n n PHE 62 Cb 0.17 -2.64 -0.02 0.00 0.35 0.00 0.00 39.48 37.34 1d9n n PHE 62 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 1d9n s ASP 63 N 0.99 6.97 -0.76 -2.13 1.11 0.20 -4.89 116.67 118.14 1d9n s ASP 63 Ca 0.73 1.17 -0.06 0.00 0.18 0.00 0.00 52.55 54.58 1d9n s ASP 63 Cb -0.53 -2.54 -0.10 0.00 1.07 0.00 0.00 42.92 40.82 1d9n s ASP 63 CO 0.36 -0.83 2.47 0.33 1.18 0.00 0.00 175.17 178.68 1d9n n PHE 64 N 6.74 1.14 0.00 4.23 7.35 -1.26 -2.74 117.46 132.92 1d9n n PHE 64 Ca 0.12 -1.90 0.00 0.00 -0.76 0.00 0.00 57.45 54.92 1d9n n PHE 64 Cb 0.47 -1.70 0.00 0.00 0.35 0.00 0.00 39.48 38.60 1d9n n PHE 64 CO 0.00 0.00 0.00 0.36 -0.76 0.00 0.00 176.76 176.36 1d9n n LYS 65 N 3.57 0.00 -0.00 -4.13 2.85 -1.26 -4.62 118.16 114.57 1d9n n LYS 65 Ca 0.47 0.00 -0.18 0.00 -1.05 0.00 0.00 58.31 57.55 1d9n n LYS 65 Cb 0.32 0.00 -0.14 0.00 -0.65 0.00 0.00 35.03 34.56 1d9n n LYS 65 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 1d9n h GLN 66 N 0.00 0.17 0.00 -1.58 1.08 -1.89 -3.44 115.11 109.46 1d9n h GLN 66 Ca 0.00 -0.30 0.00 0.00 -1.45 0.00 0.00 58.65 56.90 1d9n h GLN 66 Cb 0.00 0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.54 1d9n h GLN 66 CO 0.00 1.14 0.00 0.41 -0.95 0.00 0.00 178.83 179.43 1d9n n GLY 67 N 1.64 1.89 3.12 3.46 0.00 -1.11 -5.04 105.19 109.15 1d9n n GLY 67 Ca -0.15 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.00 0.18 0.27 -0.61 -5.25 -1.26 -4.35 121.20 108.18 1d9n s ILE 68 Ca 0.00 -1.79 -0.02 0.00 -0.99 0.00 0.00 60.65 57.86 1d9n s ILE 68 Cb 0.00 -1.65 -0.02 0.00 2.95 0.00 0.00 42.46 43.74 1d9n s ILE 68 CO 0.00 -0.83 0.30 -1.48 -1.79 0.00 0.00 174.94 171.14 1d9n s LEU 69 N -2.95 1.11 0.00 0.37 2.34 -1.26 0.58 118.68 118.87 1d9n s LEU 69 Ca 0.11 -1.41 0.00 0.00 0.06 0.00 0.00 54.13 52.89 1d9n s LEU 69 Cb 0.08 0.89 0.00 0.00 -0.56 0.00 0.00 46.19 46.59 1d9n s LEU 69 CO -0.07 -1.04 0.00 0.00 -1.06 0.00 0.00 176.35 174.18 1d9n s TYR 71 N -8.40 -1.47 0.40 0.00 5.04 -1.26 -4.59 117.35 107.07 1d9n s TYR 71 Ca 0.00 0.12 -0.23 0.00 -2.44 0.00 0.00 57.07 54.52 1d9n s TYR 71 Cb 0.00 0.27 -0.10 0.00 0.35 0.00 0.00 41.96 42.48 1d9n s TYR 71 CO 0.00 -1.02 0.98 -1.25 -1.34 0.00 0.00 175.55 172.92 1d9n s PRO 72 N 1.73 4.26 0.00 4.97 0.04 -1.26 -4.70 135.00 140.04 1d9n s PRO 72 Ca 0.18 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.52 1d9n s PRO 72 Cb -0.02 -2.43 0.00 0.00 0.04 0.00 0.00 34.50 32.09 1d9n s PRO 72 CO -0.08 -0.02 0.00 0.00 0.04 0.00 0.00 177.00 176.94 1d9n n ALA 73 N -0.21 0.00 0.11 8.56 0.00 -1.26 -4.94 120.51 122.77 1d9n n ALA 73 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.48 1d9n n ALA 73 Cb 0.52 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.97 1d9n n ALA 73 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1d9n h PRO 74 N 0.00 0.00 0.00 0.00 0.13 -2.08 -3.59 132.00 126.47 1d9n h PRO 74 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1d9n h PRO 74 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1d9n h PRO 74 CO 0.00 0.70 0.00 1.63 -0.23 0.00 0.00 178.00 180.10