#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 0.00 -3.18 3.17 0.00 -1.26 -5.01 120.51 114.22 1d9n n ALA 2 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 1d9n n ALA 2 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1d9n n ALA 2 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1d9n n GLU 3 N -3.07 3.90 -0.79 0.00 0.00 -1.21 -4.24 120.64 115.23 1d9n n GLU 3 Ca 0.00 -4.54 -0.04 0.00 0.00 0.00 0.00 57.16 52.58 1d9n n GLU 3 Cb 0.00 -2.48 0.22 0.00 0.00 0.00 0.00 31.44 29.18 1d9n n GLU 3 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1d9n n ASP 4 N 1.63 3.09 -2.99 -1.84 8.00 -1.26 -4.94 116.55 118.24 1d9n n ASP 4 Ca 0.26 -3.55 -0.01 0.00 0.71 0.00 0.00 54.79 52.20 1d9n n ASP 4 Cb 0.36 -0.65 -0.01 0.00 -0.02 0.00 0.00 41.12 40.80 1d9n n ASP 4 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 1d9n n TRP 5 N -0.93 -1.48 -3.36 1.24 7.02 -1.26 -4.99 117.44 113.68 1d9n n TRP 5 Ca 0.34 0.73 -0.21 0.00 -1.02 0.00 0.00 57.50 57.34 1d9n n TRP 5 Cb 1.11 -2.06 0.02 0.00 -2.42 0.00 0.00 31.31 27.96 1d9n n TRP 5 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1d9n s LEU 6 N -0.90 3.08 0.32 -0.99 1.43 -0.94 -4.83 118.68 115.84 1d9n s LEU 6 Ca -0.03 -0.91 -0.29 0.00 -1.03 0.00 0.00 54.13 51.87 1d9n s LEU 6 Cb 0.00 -1.67 -0.11 0.00 0.03 0.00 0.00 46.19 44.45 1d9n s LEU 6 CO 0.28 -1.12 1.50 1.51 0.23 0.00 0.00 176.35 178.75 1d9n s ASP 7 N -4.45 6.46 -0.43 2.29 -4.77 -1.26 -0.61 116.67 113.91 1d9n s ASP 7 Ca 0.51 2.90 -0.18 0.00 -3.30 0.00 0.00 52.55 52.48 1d9n s ASP 7 Cb -0.05 -2.65 0.02 0.00 -1.09 0.00 0.00 42.92 39.16 1d9n s ASP 7 CO 0.32 -0.82 0.49 0.00 0.70 0.00 0.00 175.17 175.86 1d9n h PRO 9 N 8.77 0.19 -0.94 0.00 0.13 -1.89 -0.02 132.00 138.24 1d9n h PRO 9 Ca -0.26 -0.30 0.28 0.00 -0.87 0.00 0.00 66.00 64.85 1d9n h PRO 9 Cb 1.11 0.11 -0.16 0.00 0.13 0.00 0.00 31.00 32.19 1d9n h PRO 9 CO 0.82 1.13 0.25 0.00 -0.23 0.00 0.00 178.00 179.97 1d9n h ALA 10 N 0.08 1.43 0.00 -0.56 0.00 -1.92 -3.15 119.26 115.14 1d9n h ALA 10 Ca -0.08 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1d9n h ALA 10 Cb 1.35 0.38 0.00 0.00 0.00 0.00 0.00 17.79 19.52 1d9n h ALA 10 CO 0.09 -0.58 -0.73 1.28 0.00 0.00 0.00 179.25 179.31 1d9n n LEU 11 N -5.29 1.61 0.00 0.00 4.77 -1.25 -4.94 117.00 111.91 1d9n n LEU 11 Ca 0.25 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.60 1d9n n LEU 11 Cb 0.82 -0.74 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1d9n n LEU 11 CO 0.02 -0.35 0.00 0.61 -1.33 0.00 0.00 177.39 176.34 1d9n n GLY 12 N 1.51 -0.20 3.84 -0.72 0.00 -0.02 -5.00 105.19 104.60 1d9n n GLY 12 Ca -0.10 -1.12 -0.31 0.00 0.00 0.00 0.00 46.02 44.49 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 -2.00 3.43 0.00 1.61 0.04 -1.26 -3.83 135.00 132.99 1d9n s PRO 13 Ca 0.00 0.89 0.00 0.00 0.04 0.00 0.00 61.00 61.93 1d9n s PRO 13 Cb 0.00 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.48 1d9n s PRO 13 CO 0.00 -0.70 0.00 0.41 0.04 0.00 0.00 177.00 176.75 1d9n n GLY 14 N -2.17 1.95 3.71 0.56 0.00 -1.26 -4.97 105.19 103.01 1d9n n GLY 14 Ca 0.07 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 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 -0.29 3.66 -0.24 1.61 -0.11 -1.25 -2.74 118.94 119.58 1d9n s TRP 15 Ca 0.00 1.67 -0.13 0.00 1.22 0.00 0.00 56.10 58.87 1d9n s TRP 15 Cb 0.00 -3.14 -0.05 0.00 -1.50 0.00 0.00 33.47 28.78 1d9n s TRP 15 CO 0.00 -0.12 0.25 0.15 -4.62 0.00 0.00 176.95 172.61 1d9n s LYS 16 N 0.87 4.08 -0.43 5.86 -0.14 -0.92 -1.78 119.74 127.29 1d9n s LYS 16 Ca 0.52 -0.11 -0.15 0.00 -1.36 0.00 0.00 55.97 54.87 1d9n s LYS 16 Cb -0.22 -3.56 0.03 0.00 -1.68 0.00 0.00 37.83 32.40 1d9n s LYS 16 CO 0.28 -0.03 0.34 0.50 -0.76 0.00 0.00 175.35 175.68 1d9n s ARG 17 N 1.31 2.99 -0.14 1.68 6.06 0.22 -2.12 118.95 128.94 1d9n s ARG 17 Ca 0.11 -1.07 -0.08 0.00 -2.50 0.00 0.00 55.73 52.20 1d9n s ARG 17 Cb -0.14 -4.01 -0.04 0.00 0.06 0.00 0.00 34.95 30.81 1d9n s ARG 17 CO 0.07 -0.83 0.14 0.50 -2.50 0.00 0.00 175.30 172.69 1d9n s ARG 18 N 1.73 3.62 0.15 5.12 3.52 0.91 -2.23 118.95 131.76 1d9n s ARG 18 Ca 0.06 -0.14 0.09 0.00 -0.13 0.00 0.00 55.73 55.61 1d9n s ARG 18 Cb -0.20 -3.24 -0.04 0.00 -1.56 0.00 0.00 34.95 29.91 1d9n s ARG 18 CO 0.10 0.67 -0.21 -1.83 -0.81 0.00 0.00 175.30 173.22 1d9n s GLU 19 N -0.72 1.27 0.38 5.12 -1.05 -1.26 -1.75 118.70 120.69 1d9n s GLU 19 Ca 0.14 -1.34 0.04 0.00 -0.15 0.00 0.00 54.97 53.65 1d9n s GLU 19 Cb -0.12 -1.48 -0.04 0.00 -0.44 0.00 0.00 34.13 32.06 1d9n s GLU 19 CO 0.03 0.32 0.10 0.08 0.95 0.00 0.00 175.26 176.74 1d9n s VAL 20 N -1.62 0.81 -0.48 1.83 1.01 -0.44 -3.31 120.40 118.20 1d9n s VAL 20 Ca 0.13 -2.00 0.08 0.00 0.00 0.00 0.00 61.98 60.20 1d9n s VAL 20 Cb -0.08 -2.49 0.34 0.00 0.00 0.00 0.00 36.38 34.16 1d9n s VAL 20 CO 0.06 0.00 0.85 0.49 0.00 0.00 0.00 175.10 176.50 1d9n n PHE 21 N -0.84 2.29 -2.21 5.22 3.72 -1.26 -4.33 117.46 120.04 1d9n n PHE 21 Ca -0.05 -3.92 -0.31 0.00 -0.05 0.00 0.00 57.45 53.11 1d9n n PHE 21 Cb 0.66 -0.46 -0.04 0.00 -0.94 0.00 0.00 39.48 38.69 1d9n n PHE 21 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1d9n s ARG 22 N -3.00 2.88 0.14 -1.08 0.52 -1.26 -4.80 118.95 112.35 1d9n s ARG 22 Ca 0.45 -0.53 -0.18 0.00 -0.52 0.00 0.00 55.73 54.95 1d9n s ARG 22 Cb 0.31 -5.13 -0.00 0.00 0.52 0.00 0.00 34.95 30.65 1d9n s ARG 22 CO -0.11 -2.99 1.77 0.87 0.02 0.00 0.00 175.30 174.85 1d9n h LYS 23 N 10.89 0.29 0.00 3.54 6.56 -1.96 -3.34 116.57 132.54 1d9n h LYS 23 Ca 0.12 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.69 1d9n h LYS 23 Cb 1.01 -0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.61 1d9n h LYS 23 CO 1.28 0.19 0.00 -1.13 -2.06 0.00 0.00 179.45 177.73 1d9n n SER 24 N -4.97 -2.03 0.07 0.86 3.41 -1.26 -4.84 113.62 104.85 1d9n n SER 24 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 1d9n n SER 24 Cb 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 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 0.00 -0.12 3.38 5.00 0.00 -1.26 -5.07 105.19 107.11 1d9n n GLY 25 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 -3.31 -3.00 -2.42 4.61 0.00 -1.26 -4.87 120.51 110.26 1d9n n ALA 26 Ca 0.00 -0.76 -0.40 0.00 0.00 0.00 0.00 53.44 52.28 1d9n n ALA 26 Cb 0.08 -1.72 0.02 0.00 0.00 0.00 0.00 19.45 17.83 1d9n n ALA 26 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1d9n n THR 27 N -3.76 5.19 -3.78 0.00 -1.04 -1.26 -4.83 114.28 104.80 1d9n n THR 27 Ca 0.05 -5.44 -0.29 0.00 -2.04 0.00 0.00 64.05 56.34 1d9n n THR 27 Cb 0.56 -1.44 -0.12 0.00 -1.82 0.00 0.00 70.33 67.50 1d9n n THR 27 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1d9n n GLY 29 N 2.71 1.67 3.16 0.00 0.00 -1.26 -5.00 105.19 106.46 1d9n n GLY 29 Ca 0.16 -1.28 -0.39 0.00 0.00 0.00 0.00 46.02 44.51 1d9n n GLY 29 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1d9n s ARG 30 N -4.04 2.56 0.18 1.61 6.06 -1.26 -4.95 118.95 119.10 1d9n s ARG 30 Ca 0.00 -2.20 0.00 0.00 -2.50 0.00 0.00 55.73 51.03 1d9n s ARG 30 Cb 0.00 -3.83 0.00 0.00 0.06 0.00 0.00 34.95 31.18 1d9n s ARG 30 CO 0.00 -1.17 0.00 0.43 -2.50 0.00 0.00 175.30 172.06 1d9n n SER 31 N 4.10 -4.28 -4.94 -2.12 7.64 -1.25 -4.95 113.62 107.82 1d9n n SER 31 Ca 0.03 0.49 -0.25 0.00 1.01 0.00 0.00 58.87 60.15 1d9n n SER 31 Cb 0.40 -1.26 -0.02 0.00 -1.01 0.00 0.00 64.21 62.33 1d9n n SER 31 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1d9n s ASP 32 N -2.10 6.35 -0.03 6.43 -1.08 -1.26 -4.89 116.67 120.08 1d9n s ASP 32 Ca 0.00 0.41 -0.01 0.00 -0.52 0.00 0.00 52.55 52.43 1d9n s ASP 32 Cb 0.00 -2.01 0.03 0.00 -1.46 0.00 0.00 42.92 39.48 1d9n s ASP 32 CO 0.00 -0.17 0.05 -0.89 0.52 0.00 0.00 175.17 174.67 1d9n s THR 33 N -2.10 -0.07 0.31 1.71 2.01 -1.26 -1.32 115.64 114.92 1d9n s THR 33 Ca 0.39 0.34 0.10 0.00 0.31 0.00 0.00 61.69 62.83 1d9n s THR 33 Cb -0.10 -0.14 -0.06 0.00 0.01 0.00 0.00 72.50 72.21 1d9n s THR 33 CO 0.32 0.15 -0.13 -0.31 -0.69 0.00 0.00 174.62 173.96 1d9n s TYR 34 N 1.77 2.31 0.13 4.92 2.02 -0.72 -4.93 117.35 122.85 1d9n s TYR 34 Ca -0.00 -0.46 0.05 0.00 -0.37 0.00 0.00 57.07 56.29 1d9n s TYR 34 Cb -0.12 -1.21 -0.04 0.00 -0.40 0.00 0.00 41.96 40.19 1d9n s TYR 34 CO -0.03 0.60 -0.12 0.71 -1.57 0.00 0.00 175.55 175.14 1d9n s TYR 35 N -2.62 1.33 -0.12 2.71 2.02 -1.02 -0.07 117.35 119.59 1d9n s TYR 35 Ca 0.31 -0.64 -0.03 0.00 -0.37 0.00 0.00 57.07 56.34 1d9n s TYR 35 Cb -0.00 -0.68 0.05 0.00 -0.40 0.00 0.00 41.96 40.92 1d9n s TYR 35 CO 0.15 0.12 0.07 -1.14 -1.57 0.00 0.00 175.55 173.18 1d9n s GLN 36 N -3.13 0.10 0.96 -0.62 0.74 -0.90 -2.41 119.66 114.40 1d9n s GLN 36 Ca 0.12 0.07 -0.11 0.00 0.05 0.00 0.00 55.36 55.49 1d9n s GLN 36 Cb -0.02 -1.32 0.17 0.00 1.10 0.00 0.00 33.01 32.94 1d9n s GLN 36 CO 0.02 -0.52 1.10 -1.12 -0.55 0.00 0.00 175.29 174.22 1d9n s SER 37 N 2.11 2.72 0.00 6.67 0.01 -0.23 -2.15 113.70 122.83 1d9n s SER 37 Ca 0.03 1.87 0.19 0.00 1.31 0.00 0.00 55.95 59.36 1d9n s SER 37 Cb -0.14 -2.44 1.16 0.00 0.21 0.00 0.00 66.02 64.81 1d9n s SER 37 CO -0.06 -3.18 1.67 -0.81 0.41 0.00 0.00 173.24 171.27 1d9n n PRO 38 N -4.26 0.88 -0.01 12.44 -0.04 -1.11 -2.81 135.00 140.09 1d9n n PRO 38 Ca 0.09 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.63 1d9n n PRO 38 Cb 0.53 -1.35 -0.13 0.00 -0.04 0.00 0.00 33.50 32.52 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 -0.85 0.00 0.00 0.52 5.66 -1.26 -4.96 114.28 113.39 1d9n n THR 39 Ca 0.15 -0.31 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 1d9n n THR 39 Cb 0.07 0.38 0.00 0.00 -1.55 0.00 0.00 70.33 69.23 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 1.46 1.52 3.56 1.09 0.00 -1.12 -5.09 105.19 106.60 1d9n n GLY 40 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1d9n n GLY 40 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1d9n s ASP 41 N -2.00 6.25 -0.27 1.61 1.11 -1.26 -4.92 116.67 117.19 1d9n s ASP 41 Ca 0.00 -0.05 -0.11 0.00 0.18 0.00 0.00 52.55 52.56 1d9n s ASP 41 Cb 0.00 -2.23 -0.05 0.00 1.07 0.00 0.00 42.92 41.71 1d9n s ASP 41 CO 0.00 -0.37 0.20 0.00 1.18 0.00 0.00 175.17 176.18 1d9n s ARG 42 N 2.19 3.99 0.17 8.23 3.03 -1.26 -1.06 118.95 134.23 1d9n s ARG 42 Ca 0.15 -0.27 0.08 0.00 2.03 0.00 0.00 55.73 57.73 1d9n s ARG 42 Cb -0.16 -3.63 -0.04 0.00 -1.03 0.00 0.00 34.95 30.09 1d9n s ARG 42 CO 0.12 -0.13 -0.16 0.42 -1.13 0.00 0.00 175.30 174.42 1d9n s ILE 43 N 1.60 1.70 0.00 4.99 1.09 -1.01 -5.04 121.20 124.53 1d9n s ILE 43 Ca 0.08 -1.97 0.00 0.00 -1.10 0.00 0.00 60.65 57.66 1d9n s ILE 43 Cb -0.15 -1.84 0.00 0.00 -1.06 0.00 0.00 42.46 39.40 1d9n s ILE 43 CO 0.09 -0.42 0.02 -1.14 -0.10 0.00 0.00 174.94 173.39 1d9n n ARG 44 N 0.14 1.97 -1.58 2.79 0.63 -1.26 -2.43 116.66 116.92 1d9n n ARG 44 Ca -0.12 -0.02 -0.25 0.00 -0.92 0.00 0.00 57.85 56.54 1d9n n ARG 44 Cb 0.58 -0.23 0.17 0.00 0.45 0.00 0.00 32.46 33.43 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 -0.29 0.03 -0.09 6.15 7.64 -1.26 -4.92 113.62 120.88 1d9n n SER 45 Ca 0.00 -1.40 -0.13 0.00 1.01 0.00 0.00 58.87 58.35 1d9n n SER 45 Cb 0.02 -0.86 -0.04 0.00 -1.01 0.00 0.00 64.21 62.32 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 -3.41 0.49 0.08 1.43 4.81 -1.26 -4.17 118.16 116.13 1d9n n LYS 46 Ca 0.14 0.20 0.12 0.00 -0.87 0.00 0.00 58.31 57.90 1d9n n LYS 46 Cb 0.49 -1.34 0.28 0.00 0.02 0.00 0.00 35.03 34.47 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 -4.29 0.46 -0.00 3.15 0.31 -1.26 -2.96 118.33 113.74 1d9n n VAL 47 Ca -0.22 -0.28 -0.18 0.00 -0.01 0.00 0.00 64.34 63.65 1d9n n VAL 47 Cb 0.57 -0.33 -0.09 0.00 -0.91 0.00 0.00 33.84 33.07 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 0.59 0.00 5.55 5.08 -1.98 0.15 114.58 123.96 1d9n h GLU 48 Ca 0.00 -0.55 -0.11 0.00 -1.00 0.00 0.00 59.36 57.70 1d9n h GLU 48 Cb 0.74 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 1d9n h GLU 48 CO 0.00 1.17 -0.50 1.37 -1.00 0.00 0.00 179.01 180.05 1d9n h LEU 49 N 0.21 0.00 -0.16 1.33 8.10 -1.72 -1.81 115.31 121.26 1d9n h LEU 49 Ca -0.07 0.00 -0.12 0.00 0.11 0.00 0.00 57.88 57.80 1d9n h LEU 49 Cb 1.38 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.60 1d9n h LEU 49 CO 0.14 0.50 -0.38 0.00 -4.11 0.00 0.00 178.44 174.60 1d9n h THR 50 N 0.00 1.35 0.00 0.15 1.03 -1.43 -2.40 112.91 111.62 1d9n h THR 50 Ca -0.01 -1.64 -0.00 0.00 -0.01 0.00 0.00 66.41 64.75 1d9n h THR 50 Cb 0.93 1.98 -0.00 0.00 -1.07 0.00 0.00 68.15 70.00 1d9n h THR 50 CO 0.07 0.50 -0.01 0.03 -0.01 0.00 0.00 175.52 176.09 1d9n h ARG 51 N 0.18 0.00 0.21 0.00 2.47 -0.43 -0.93 114.38 115.88 1d9n h ARG 51 Ca -0.00 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.71 1d9n h ARG 51 Cb 0.99 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.31 1d9n h ARG 51 CO 0.08 0.01 -0.10 -0.92 0.56 0.00 0.00 179.97 179.60 1d9n h TYR 52 N 0.00 -0.26 -0.50 3.04 3.20 -0.85 -3.33 116.97 118.27 1d9n h TYR 52 Ca -0.00 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.92 1d9n h TYR 52 Cb 0.07 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.37 1d9n h TYR 52 CO 0.00 -0.16 0.21 -0.07 -1.64 0.00 0.00 178.16 176.50 1d9n h LEU 53 N -1.06 0.25 0.00 2.82 4.07 -1.22 -3.49 115.31 116.69 1d9n h LEU 53 Ca -0.03 0.05 0.00 0.00 0.08 0.00 0.00 57.88 57.98 1d9n h LEU 53 Cb 0.22 0.01 0.00 0.00 1.08 0.00 0.00 40.66 41.97 1d9n h LEU 53 CO 0.05 0.18 0.00 0.61 -1.08 0.00 0.00 178.44 178.19 1d9n n GLY 54 N -1.26 0.50 0.16 0.83 0.00 -0.37 -4.74 105.19 100.31 1d9n n GLY 54 Ca 0.05 -1.90 0.04 0.00 0.00 0.00 0.00 46.02 44.22 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 -1.92 -3.20 132.00 128.62 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 0.41 -0.01 0.00 -0.23 0.00 0.00 178.00 178.17 1d9n h ALA 56 N 1.59 1.03 -3.16 -0.56 0.00 -1.93 -3.37 119.26 112.86 1d9n h ALA 56 Ca -0.00 -0.01 -0.56 0.00 0.00 0.00 0.00 54.91 54.34 1d9n h ALA 56 Cb 1.27 -0.00 -0.40 0.00 0.00 0.00 0.00 17.79 18.66 1d9n h ALA 56 CO 0.05 0.01 -0.76 0.00 0.00 0.00 0.00 179.25 178.55 1d9n s ASP 58 N 1.74 5.68 0.00 0.00 1.11 -1.26 -4.48 116.67 119.46 1d9n s ASP 58 Ca 0.06 0.02 0.00 0.00 0.18 0.00 0.00 52.55 52.81 1d9n s ASP 58 Cb -0.17 -1.56 0.00 0.00 1.07 0.00 0.00 42.92 42.25 1d9n s ASP 58 CO -0.21 0.15 0.59 0.18 1.18 0.00 0.00 175.17 177.07 1d9n n LEU 59 N 0.29 0.53 -0.25 1.23 4.32 -1.26 -4.71 117.00 117.15 1d9n n LEU 59 Ca -0.08 -0.53 0.05 0.00 -0.02 0.00 0.00 56.01 55.43 1d9n n LEU 59 Cb 0.52 0.00 0.17 0.00 -1.62 0.00 0.00 43.42 42.49 1d9n n LEU 59 CO 0.45 0.13 0.87 0.74 -1.22 0.00 0.00 177.39 178.37 1d9n h THR 60 N 2.03 0.42 -0.02 -5.08 2.02 -1.94 0.17 112.91 110.51 1d9n h THR 60 Ca 0.00 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.12 1d9n h THR 60 Cb 0.82 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 1d9n h THR 60 CO 0.00 0.03 -0.21 0.18 0.37 0.00 0.00 175.52 175.89 1d9n n LEU 61 N -5.26 2.48 -4.71 2.58 7.99 -1.26 -4.94 117.00 113.87 1d9n n LEU 61 Ca 0.14 -0.86 -0.42 0.00 -0.01 0.00 0.00 56.01 54.86 1d9n n LEU 61 Cb 0.47 -0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.75 1d9n n LEU 61 CO 0.09 0.43 1.40 0.12 -1.51 0.00 0.00 177.39 177.91 1d9n s PHE 62 N -2.21 2.75 -0.70 -1.77 5.36 0.60 -3.91 117.98 118.08 1d9n s PHE 62 Ca 0.24 0.26 -0.27 0.00 -0.96 0.00 0.00 56.93 56.20 1d9n s PHE 62 Cb 0.19 -4.16 0.03 0.00 -0.34 0.00 0.00 43.02 38.74 1d9n s PHE 62 CO 0.42 -4.46 1.31 -0.51 -1.46 0.00 0.00 175.22 170.52 1d9n s ASP 63 N 1.49 6.15 -0.59 6.13 1.01 0.69 -4.87 116.67 126.68 1d9n s ASP 63 Ca 0.76 -0.30 -0.06 0.00 0.71 0.00 0.00 52.55 53.66 1d9n s ASP 63 Cb -0.49 -2.56 -0.06 0.00 1.01 0.00 0.00 42.92 40.82 1d9n s ASP 63 CO 0.33 -1.82 1.73 0.33 0.21 0.00 0.00 175.17 175.96 1d9n n PHE 64 N 9.44 0.94 0.00 4.23 7.35 -1.26 -2.37 117.46 135.78 1d9n n PHE 64 Ca 0.05 -1.45 0.00 0.00 -0.76 0.00 0.00 57.45 55.29 1d9n n PHE 64 Cb 0.49 -1.31 0.00 0.00 0.35 0.00 0.00 39.48 39.01 1d9n n PHE 64 CO 0.00 0.00 0.00 1.17 -0.76 0.00 0.00 176.76 177.17 1d9n n LYS 65 N 4.82 0.00 -0.13 -4.13 0.00 -1.26 -4.82 118.16 112.65 1d9n n LYS 65 Ca 0.31 0.00 -0.18 0.00 0.00 0.00 0.00 58.31 58.45 1d9n n LYS 65 Cb 0.12 0.00 -0.12 0.00 0.00 0.00 0.00 35.03 35.04 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 -0.70 0.64 0.00 1.64 6.02 -1.00 -4.98 117.38 119.00 1d9n n GLN 66 Ca 0.00 0.15 0.00 0.00 -0.01 0.00 0.00 57.00 57.14 1d9n n GLN 66 Cb 0.00 -1.51 0.00 0.00 1.02 0.00 0.00 30.24 29.75 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 2.28 1.40 3.15 1.08 0.00 -1.06 -5.08 105.19 106.96 1d9n n GLY 67 Ca -0.45 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.48 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 0.13 0.27 -0.61 -5.25 -1.26 -4.15 121.20 108.33 1d9n s ILE 68 Ca 0.00 -1.83 -0.04 0.00 -0.99 0.00 0.00 60.65 57.79 1d9n s ILE 68 Cb 0.00 -1.87 -0.02 0.00 2.95 0.00 0.00 42.46 43.52 1d9n s ILE 68 CO 0.00 -0.61 0.35 -1.48 -1.79 0.00 0.00 174.94 171.41 1d9n s LEU 69 N -3.00 0.96 -0.16 0.37 2.34 -1.26 0.25 118.68 118.17 1d9n s LEU 69 Ca 0.18 -1.34 -0.14 0.00 0.06 0.00 0.00 54.13 52.89 1d9n s LEU 69 Cb 0.07 1.10 0.04 0.00 -0.56 0.00 0.00 46.19 46.85 1d9n s LEU 69 CO -0.02 -1.09 0.43 0.00 -1.06 0.00 0.00 176.35 174.61 1d9n s TYR 71 N 0.32 1.37 0.00 0.00 -0.85 -1.26 -4.54 117.35 112.38 1d9n s TYR 71 Ca -0.01 -0.55 0.00 0.00 -0.52 0.00 0.00 57.07 55.99 1d9n s TYR 71 Cb -0.03 -0.72 0.00 0.00 0.38 0.00 0.00 41.96 41.59 1d9n s TYR 71 CO -0.00 0.13 0.00 -0.35 -1.52 0.00 0.00 175.55 173.80 1d9n n PRO 72 N 0.60 0.95 -2.78 -3.49 -0.04 -1.26 -4.83 135.00 124.15 1d9n n PRO 72 Ca -0.16 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.23 1d9n n PRO 72 Cb 0.57 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.04 1d9n n PRO 72 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1d9n n ALA 73 N -3.00 -2.96 -1.00 0.55 0.00 -1.26 -5.01 120.51 107.82 1d9n n ALA 73 Ca 0.00 1.01 0.00 0.00 0.00 0.00 0.00 53.44 54.45 1d9n n ALA 73 Cb 0.00 -3.36 0.00 0.00 0.00 0.00 0.00 19.45 16.09 1d9n n ALA 73 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1d9n n PRO 74 N -0.45 0.00 0.00 0.00 -0.04 -1.26 -5.31 135.00 127.95 1d9n n PRO 74 Ca 0.10 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.69 1d9n n PRO 74 Cb 0.44 -0.28 0.31 0.00 -0.04 0.00 0.00 33.50 33.93 1d9n n PRO 74 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82