#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 -1.25 -3.72 -5.12 0.00 -1.26 -5.13 120.51 104.04 1d9n n ALA 2 Ca 0.00 -0.89 -0.17 0.00 0.00 0.00 0.00 53.44 52.38 1d9n n ALA 2 Cb 0.00 -1.55 -0.17 0.00 0.00 0.00 0.00 19.45 17.73 1d9n n ALA 2 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1d9n s GLU 3 N 0.13 -0.04 0.00 0.00 -1.05 -1.26 -4.69 118.70 111.79 1d9n s GLU 3 Ca 0.17 0.31 0.08 0.00 -0.15 0.00 0.00 54.97 55.38 1d9n s GLU 3 Cb 0.26 -0.36 0.13 0.00 -0.44 0.00 0.00 34.13 33.73 1d9n s GLU 3 CO -0.09 -0.25 0.98 -3.47 0.95 0.00 0.00 175.26 173.39 1d9n n ASP 4 N 4.75 0.22 -2.80 0.83 2.03 -1.26 -5.03 116.55 115.29 1d9n n ASP 4 Ca -0.15 -1.86 -0.03 0.00 0.52 0.00 0.00 54.79 53.27 1d9n n ASP 4 Cb 0.50 -0.16 -0.02 0.00 -0.72 0.00 0.00 41.12 40.72 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 0.16 -2.37 -4.10 -0.67 7.02 -1.26 -4.98 117.44 111.24 1d9n n TRP 5 Ca -0.01 1.38 -0.30 0.00 -1.02 0.00 0.00 57.50 57.55 1d9n n TRP 5 Cb 0.81 -2.53 -0.07 0.00 -2.42 0.00 0.00 31.31 27.10 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 -0.34 3.59 0.47 -0.99 1.02 -0.85 -4.84 118.68 116.74 1d9n s LEU 6 Ca -0.15 -0.12 -0.20 0.00 0.02 0.00 0.00 54.13 53.68 1d9n s LEU 6 Cb 0.01 -2.30 -0.12 0.00 0.02 0.00 0.00 46.19 43.80 1d9n s LEU 6 CO 0.40 0.17 0.42 -0.90 0.02 0.00 0.00 176.35 176.46 1d9n n ASP 7 N 0.48 -1.41 -4.50 2.29 5.68 -1.26 -0.57 116.55 117.26 1d9n n ASP 7 Ca -0.10 0.82 -0.43 0.00 -0.50 0.00 0.00 54.79 54.58 1d9n n ASP 7 Cb 0.52 -1.08 -0.07 0.00 -1.14 0.00 0.00 41.12 39.34 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 8.83 0.00 -0.19 0.00 0.13 -1.88 1.00 132.00 139.89 1d9n h PRO 9 Ca -0.26 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.74 1d9n h PRO 9 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1d9n h PRO 9 CO 0.86 0.94 -0.42 0.00 -0.23 0.00 0.00 178.00 179.15 1d9n h ALA 10 N 1.06 0.91 0.00 -0.56 0.00 -1.91 -3.36 119.26 115.40 1d9n h ALA 10 Ca -0.01 -0.44 -0.33 0.00 0.00 0.00 0.00 54.91 54.13 1d9n h ALA 10 Cb 1.73 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 19.37 1d9n h ALA 10 CO 0.12 0.64 -2.09 1.28 0.00 0.00 0.00 179.25 179.20 1d9n n LEU 11 N -4.02 1.43 0.00 0.00 4.77 -1.23 -4.92 117.00 113.04 1d9n n LEU 11 Ca -0.02 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 1d9n n LEU 11 Cb 0.51 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1d9n n LEU 11 CO 0.44 0.40 0.00 0.61 -1.33 0.00 0.00 177.39 177.51 1d9n n GLY 12 N 1.74 0.75 3.85 -0.72 0.00 0.35 -5.00 105.19 106.16 1d9n n GLY 12 Ca -0.39 -1.66 -0.31 0.00 0.00 0.00 0.00 46.02 43.66 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 -1.91 3.02 0.00 1.61 0.04 -1.26 -3.06 135.00 133.44 1d9n s PRO 13 Ca 0.00 0.73 0.00 0.00 0.04 0.00 0.00 61.00 61.77 1d9n s PRO 13 Cb 0.00 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1d9n s PRO 13 CO 0.00 -0.98 0.00 0.41 0.04 0.00 0.00 177.00 176.47 1d9n n GLY 14 N -2.48 1.80 3.69 0.56 0.00 -1.26 -4.94 105.19 102.56 1d9n n GLY 14 Ca 0.07 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.03 3.30 -0.21 1.61 -0.00 -1.25 -3.85 118.94 118.51 1d9n s TRP 15 Ca 0.00 1.33 -0.09 0.00 -0.00 0.00 0.00 56.10 57.34 1d9n s TRP 15 Cb 0.00 -3.35 -0.04 0.00 -0.00 0.00 0.00 33.47 30.07 1d9n s TRP 15 CO 0.00 -1.00 0.10 0.15 -0.00 0.00 0.00 176.95 176.20 1d9n s LYS 16 N 2.04 4.01 -0.48 5.86 3.01 -1.00 -1.60 119.74 131.58 1d9n s LYS 16 Ca 0.54 -0.31 -0.15 0.00 -1.01 0.00 0.00 55.97 55.04 1d9n s LYS 16 Cb -0.23 -3.36 0.08 0.00 -1.01 0.00 0.00 37.83 33.32 1d9n s LYS 16 CO 0.22 0.17 0.41 0.50 0.51 0.00 0.00 175.35 177.15 1d9n s ARG 17 N 0.69 2.95 -0.16 1.68 3.52 0.27 -2.43 118.95 125.48 1d9n s ARG 17 Ca 0.05 -1.43 -0.08 0.00 -0.13 0.00 0.00 55.73 54.14 1d9n s ARG 17 Cb -0.13 -4.14 -0.04 0.00 -1.56 0.00 0.00 34.95 29.08 1d9n s ARG 17 CO 0.01 -1.08 0.12 0.50 -0.81 0.00 0.00 175.30 174.04 1d9n s ARG 18 N 1.61 3.76 0.06 5.12 3.52 -0.39 -2.01 118.95 130.63 1d9n s ARG 18 Ca 0.04 -0.20 0.07 0.00 -0.13 0.00 0.00 55.73 55.51 1d9n s ARG 18 Cb -0.25 -3.26 -0.03 0.00 -1.56 0.00 0.00 34.95 29.84 1d9n s ARG 18 CO 0.06 0.54 -0.16 -1.83 -0.81 0.00 0.00 175.30 173.09 1d9n s GLU 19 N -0.34 2.05 0.03 5.12 -1.05 -1.26 -0.88 118.70 122.37 1d9n s GLU 19 Ca 0.11 -1.01 -0.00 0.00 -0.15 0.00 0.00 54.97 53.92 1d9n s GLU 19 Cb -0.12 -2.21 -0.03 0.00 -0.44 0.00 0.00 34.13 31.34 1d9n s GLU 19 CO 0.01 0.53 -0.03 0.08 0.95 0.00 0.00 175.26 176.80 1d9n s VAL 20 N -1.00 0.18 -1.52 1.83 1.01 0.90 -4.29 120.40 117.51 1d9n s VAL 20 Ca 0.16 -1.18 0.00 0.00 0.00 0.00 0.00 61.98 60.96 1d9n s VAL 20 Cb -0.11 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 35.62 1d9n s VAL 20 CO 0.07 -0.63 0.00 0.49 0.00 0.00 0.00 175.10 175.03 1d9n n PHE 21 N 1.16 -0.97 -2.97 5.22 3.01 -1.26 0.23 117.46 121.88 1d9n n PHE 21 Ca -0.21 0.00 -0.44 0.00 1.01 0.00 0.00 57.45 57.81 1d9n n PHE 21 Cb 0.57 -3.32 -0.03 0.00 -0.01 0.00 0.00 39.48 36.68 1d9n n PHE 21 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 1d9n s ARG 22 N -4.68 3.30 -0.10 -1.08 3.00 -1.26 -3.28 118.95 114.85 1d9n s ARG 22 Ca 0.00 -1.39 -0.06 0.00 -1.00 0.00 0.00 55.73 53.28 1d9n s ARG 22 Cb 0.00 -4.50 0.02 0.00 0.00 0.00 0.00 34.95 30.47 1d9n s ARG 22 CO 0.00 -1.70 0.12 1.17 0.00 0.00 0.00 175.30 174.88 1d9n n LYS 23 N 6.73 -2.33 0.05 5.12 4.81 -1.16 -5.00 118.16 126.38 1d9n n LYS 23 Ca 0.06 2.00 0.00 0.00 -0.87 0.00 0.00 58.31 59.50 1d9n n LYS 23 Cb 0.46 -3.13 0.00 0.00 0.02 0.00 0.00 35.03 32.38 1d9n n LYS 23 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1d9n n SER 24 N 0.82 -0.71 -0.09 3.14 7.64 -1.26 -4.87 113.62 118.29 1d9n n SER 24 Ca -0.20 0.18 -0.10 0.00 1.01 0.00 0.00 58.87 59.76 1d9n n SER 24 Cb 0.31 0.94 -0.03 0.00 -1.01 0.00 0.00 64.21 64.41 1d9n n SER 24 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1d9n n GLY 25 N -0.59 -0.53 1.37 0.23 0.00 -1.26 -4.49 105.19 99.93 1d9n n GLY 25 Ca 0.00 -0.31 0.04 0.00 0.00 0.00 0.00 46.02 45.75 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 -4.43 3.39 -0.43 4.61 0.00 -1.26 -4.96 120.51 117.42 1d9n n ALA 26 Ca -0.16 -1.20 0.00 0.00 0.00 0.00 0.00 53.44 52.08 1d9n n ALA 26 Cb 0.53 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.90 1d9n n ALA 26 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1d9n n THR 27 N 0.37 0.00 -2.79 0.00 -2.24 -1.26 -3.77 114.28 104.59 1d9n n THR 27 Ca 0.18 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.53 1d9n n THR 27 Cb 0.85 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 69.05 1d9n n THR 27 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1d9n n GLY 29 N 5.99 0.98 3.00 0.00 0.00 -1.25 -5.09 105.19 108.83 1d9n n GLY 29 Ca 0.28 -0.09 -0.14 0.00 0.00 0.00 0.00 46.02 46.07 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 0.42 0.15 -0.11 1.61 3.52 -1.26 -5.09 118.95 118.19 1d9n s ARG 30 Ca 0.00 0.72 -0.01 0.00 -0.13 0.00 0.00 55.73 56.31 1d9n s ARG 30 Cb 0.00 -0.05 -0.03 0.00 -1.56 0.00 0.00 34.95 33.31 1d9n s ARG 30 CO 0.00 -0.27 -0.06 -1.54 -0.81 0.00 0.00 175.30 172.61 1d9n s SER 31 N 2.29 4.65 -0.59 -2.12 1.04 -1.20 -4.63 113.70 113.14 1d9n s SER 31 Ca 0.00 -0.08 -0.24 0.00 0.48 0.00 0.00 55.95 56.11 1d9n s SER 31 Cb -0.12 -1.44 0.05 0.00 0.10 0.00 0.00 66.02 64.61 1d9n s SER 31 CO -0.08 0.28 0.97 -1.81 0.98 0.00 0.00 173.24 173.57 1d9n s ASP 32 N -0.29 6.28 -0.27 7.02 1.01 0.64 -4.76 116.67 126.31 1d9n s ASP 32 Ca 0.04 -0.52 -0.11 0.00 0.71 0.00 0.00 52.55 52.67 1d9n s ASP 32 Cb -0.13 -2.44 -0.05 0.00 1.01 0.00 0.00 42.92 41.32 1d9n s ASP 32 CO 0.02 -1.33 0.18 -0.89 0.21 0.00 0.00 175.17 173.36 1d9n s THR 33 N 4.11 5.21 0.15 -1.27 2.01 -1.26 -0.07 115.64 124.51 1d9n s THR 33 Ca 0.29 0.13 0.09 0.00 0.31 0.00 0.00 61.69 62.51 1d9n s THR 33 Cb -0.13 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 1d9n s THR 33 CO 0.17 0.26 -0.21 -0.31 -0.69 0.00 0.00 174.62 173.84 1d9n s TYR 34 N 1.71 1.97 0.05 4.92 2.02 -0.06 -4.82 117.35 123.15 1d9n s TYR 34 Ca 0.07 -0.42 0.09 0.00 -0.37 0.00 0.00 57.07 56.44 1d9n s TYR 34 Cb -0.16 -1.02 -0.03 0.00 -0.40 0.00 0.00 41.96 40.35 1d9n s TYR 34 CO 0.10 0.33 -0.23 0.71 -1.57 0.00 0.00 175.55 174.89 1d9n s TYR 35 N -1.60 2.41 0.00 2.71 2.02 -1.06 -1.26 117.35 120.58 1d9n s TYR 35 Ca 0.14 -0.35 0.03 0.00 -0.37 0.00 0.00 57.07 56.52 1d9n s TYR 35 Cb -0.08 -1.40 -0.01 0.00 -0.40 0.00 0.00 41.96 40.07 1d9n s TYR 35 CO 0.07 0.19 -0.10 -1.14 -1.57 0.00 0.00 175.55 173.00 1d9n s GLN 36 N -1.39 0.74 0.85 -0.62 0.74 -1.02 -1.63 119.66 117.33 1d9n s GLN 36 Ca 0.13 -0.42 -0.12 0.00 0.05 0.00 0.00 55.36 55.00 1d9n s GLN 36 Cb -0.10 -0.70 0.13 0.00 1.10 0.00 0.00 33.01 33.43 1d9n s GLN 36 CO 0.04 0.19 1.20 -1.12 -0.55 0.00 0.00 175.29 175.05 1d9n s SER 37 N -0.46 4.01 0.00 6.67 0.01 -0.18 -2.37 113.70 121.37 1d9n s SER 37 Ca 0.02 0.49 0.08 0.00 1.31 0.00 0.00 55.95 57.85 1d9n s SER 37 Cb -0.05 -0.83 0.50 0.00 0.21 0.00 0.00 66.02 65.86 1d9n s SER 37 CO -0.00 -2.18 1.28 -0.81 0.41 0.00 0.00 173.24 171.94 1d9n n PRO 38 N -3.42 0.94 -0.00 12.44 -0.04 -1.25 -2.99 135.00 140.69 1d9n n PRO 38 Ca 0.11 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.62 1d9n n PRO 38 Cb 0.60 -1.14 -0.07 0.00 -0.04 0.00 0.00 33.50 32.86 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 -0.64 0.00 0.00 0.52 -2.24 -1.26 -4.98 114.28 105.68 1d9n n THR 39 Ca 0.06 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1d9n n THR 39 Cb 0.03 0.74 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 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 1.48 1.73 3.64 3.38 0.00 -1.16 -5.10 105.19 109.16 1d9n n GLY 40 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.00 6.22 -0.20 1.61 2.15 -1.26 -4.91 116.67 118.28 1d9n s ASP 41 Ca 0.00 0.25 -0.06 0.00 0.43 0.00 0.00 52.55 53.17 1d9n s ASP 41 Cb 0.00 -2.17 -0.03 0.00 -0.30 0.00 0.00 42.92 40.42 1d9n s ASP 41 CO 0.00 -0.05 0.02 -0.60 -0.17 0.00 0.00 175.17 174.37 1d9n s ARG 42 N 1.46 3.69 0.09 4.34 3.52 -1.26 -1.01 118.95 129.77 1d9n s ARG 42 Ca 0.12 -0.48 0.07 0.00 -0.13 0.00 0.00 55.73 55.31 1d9n s ARG 42 Cb -0.15 -3.14 -0.03 0.00 -1.56 0.00 0.00 34.95 30.07 1d9n s ARG 42 CO 0.08 0.03 -0.17 0.42 -0.81 0.00 0.00 175.30 174.84 1d9n s ILE 43 N 0.99 1.40 0.00 4.11 1.09 -0.64 -5.03 121.20 123.12 1d9n s ILE 43 Ca 0.02 -1.45 0.00 0.00 -1.10 0.00 0.00 60.65 58.12 1d9n s ILE 43 Cb -0.14 -1.33 0.00 0.00 -1.06 0.00 0.00 42.46 39.93 1d9n s ILE 43 CO 0.02 -0.17 0.36 0.54 -0.10 0.00 0.00 174.94 175.60 1d9n n ARG 44 N 1.12 0.00 -0.48 2.79 1.74 -1.26 -2.56 116.66 118.01 1d9n n ARG 44 Ca -0.20 -0.36 0.10 0.00 -0.77 0.00 0.00 57.85 56.61 1d9n n ARG 44 Cb 0.54 -0.38 0.32 0.00 -1.02 0.00 0.00 32.46 31.93 1d9n n ARG 44 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1d9n n SER 45 N 0.00 4.14 0.00 0.55 7.64 -1.26 -4.99 113.62 119.70 1d9n n SER 45 Ca 0.00 -2.23 0.00 0.00 1.01 0.00 0.00 58.87 57.65 1d9n n SER 45 Cb 0.49 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 63.17 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 1.27 0.00 0.26 1.43 4.81 -1.26 -3.01 118.16 121.65 1d9n n LYS 46 Ca 0.24 0.00 0.18 0.00 -0.87 0.00 0.00 58.31 57.86 1d9n n LYS 46 Cb 0.73 0.00 0.88 0.00 0.02 0.00 0.00 35.03 36.66 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 0.19 -0.17 3.15 2.07 -1.94 -0.39 116.25 119.15 1d9n h VAL 47 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1d9n h VAL 47 Cb 0.00 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1d9n h VAL 47 CO 0.00 0.00 0.06 -0.33 0.02 0.00 0.00 177.57 177.32 1d9n h GLU 48 N 0.00 0.26 0.00 1.57 5.08 -1.94 0.16 114.58 119.71 1d9n h GLU 48 Ca 0.05 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1d9n h GLU 48 Cb 0.57 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1d9n h GLU 48 CO -0.00 0.35 -0.19 1.37 -1.00 0.00 0.00 179.01 179.55 1d9n h LEU 49 N 0.11 0.00 0.49 1.33 8.10 -1.38 -2.32 115.31 121.65 1d9n h LEU 49 Ca 0.06 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 58.02 1d9n h LEU 49 Cb 0.20 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.42 1d9n h LEU 49 CO -0.00 0.19 -0.24 0.74 -4.11 0.00 0.00 178.44 175.02 1d9n h THR 50 N 0.00 0.00 -0.12 0.15 2.02 -0.76 0.18 112.91 114.38 1d9n h THR 50 Ca -0.00 -0.26 0.04 0.00 0.77 0.00 0.00 66.41 66.96 1d9n h THR 50 Cb 0.52 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.93 1d9n h THR 50 CO 0.02 0.00 0.41 0.08 0.37 0.00 0.00 175.52 176.40 1d9n h ARG 51 N -0.92 0.00 0.08 6.66 0.11 -0.93 -1.79 114.38 117.59 1d9n h ARG 51 Ca -0.07 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.01 1d9n h ARG 51 Cb 0.51 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.59 1d9n h ARG 51 CO 0.11 0.00 -0.04 -0.92 0.10 0.00 0.00 179.97 179.22 1d9n h TYR 52 N 0.00 -0.10 -0.31 4.08 3.20 -0.92 -3.37 116.97 119.55 1d9n h TYR 52 Ca 0.06 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.96 1d9n h TYR 52 Cb 0.87 0.03 -0.06 0.00 1.54 0.00 0.00 36.73 39.12 1d9n h TYR 52 CO 0.00 -0.06 -0.36 -0.07 -1.64 0.00 0.00 178.16 176.03 1d9n h LEU 53 N -0.58 -1.22 0.00 2.82 3.38 0.14 -3.48 115.31 116.38 1d9n h LEU 53 Ca -0.01 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1d9n h LEU 53 Cb 0.08 0.50 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1d9n h LEU 53 CO 0.02 -0.24 0.00 0.61 0.09 0.00 0.00 178.44 178.91 1d9n n GLY 54 N -1.23 0.64 0.00 0.83 0.00 -0.75 -4.84 105.19 99.85 1d9n n GLY 54 Ca -0.02 -1.75 0.13 0.00 0.00 0.00 0.00 46.02 44.38 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 0.03 1.61 -0.04 -1.26 -2.99 135.00 132.59 1d9n n PRO 55 Ca 0.00 0.04 0.13 0.00 -0.04 0.00 0.00 63.50 63.63 1d9n n PRO 55 Cb 0.00 -1.50 0.55 0.00 -0.04 0.00 0.00 33.50 32.51 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 2.28 -2.85 0.55 0.00 -1.26 -4.80 120.51 113.06 1d9n n ALA 56 Ca 0.10 -0.07 -0.12 0.00 0.00 0.00 0.00 53.44 53.35 1d9n n ALA 56 Cb 0.25 -1.46 -0.11 0.00 0.00 0.00 0.00 19.45 18.13 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 -1.62 0.40 0.00 0.00 -4.77 -1.26 -4.67 116.67 104.75 1d9n s ASP 58 Ca -0.10 -0.81 0.00 0.00 -3.30 0.00 0.00 52.55 48.34 1d9n s ASP 58 Cb -0.09 0.16 0.00 0.00 -1.09 0.00 0.00 42.92 41.90 1d9n s ASP 58 CO -0.00 -0.48 0.50 0.18 0.70 0.00 0.00 175.17 176.07 1d9n n LEU 59 N 0.68 0.00 -0.33 2.11 4.32 -1.26 -4.79 117.00 117.73 1d9n n LEU 59 Ca -0.18 -0.67 0.17 0.00 -0.02 0.00 0.00 56.01 55.31 1d9n n LEU 59 Cb 0.59 0.00 0.38 0.00 -1.62 0.00 0.00 43.42 42.77 1d9n n LEU 59 CO 0.25 0.48 1.11 0.74 -1.22 0.00 0.00 177.39 178.75 1d9n h THR 60 N 4.60 0.45 -0.01 -5.08 2.02 -1.95 -0.04 112.91 112.90 1d9n h THR 60 Ca 0.00 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.03 1d9n h THR 60 Cb 1.10 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 1d9n h THR 60 CO 0.00 0.08 -0.25 0.18 0.37 0.00 0.00 175.52 175.90 1d9n n LEU 61 N -4.99 1.36 -4.71 2.58 7.99 -1.26 -5.00 117.00 112.98 1d9n n LEU 61 Ca 0.26 -0.77 -0.43 0.00 -0.01 0.00 0.00 56.01 55.06 1d9n n LEU 61 Cb 0.77 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 44.06 1d9n n LEU 61 CO 0.13 0.27 1.07 0.33 -1.51 0.00 0.00 177.39 177.68 1d9n n PHE 62 N -0.20 2.48 -2.97 -1.77 7.35 -0.03 -4.12 117.46 118.20 1d9n n PHE 62 Ca 0.05 0.40 -0.40 0.00 -0.76 0.00 0.00 57.45 56.74 1d9n n PHE 62 Cb 0.26 -2.50 -0.04 0.00 0.35 0.00 0.00 39.48 37.54 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 0.19 7.05 -0.83 -2.13 1.01 0.29 -4.92 116.67 117.33 1d9n s ASP 63 Ca 0.63 1.27 -0.07 0.00 0.71 0.00 0.00 52.55 55.09 1d9n s ASP 63 Cb -0.57 -2.45 -0.07 0.00 1.01 0.00 0.00 42.92 40.85 1d9n s ASP 63 CO 0.53 -0.17 3.00 0.33 0.21 0.00 0.00 175.17 179.07 1d9n n PHE 64 N 3.97 1.56 0.00 4.23 7.35 -1.26 -3.13 117.46 130.18 1d9n n PHE 64 Ca 0.01 -2.32 0.00 0.00 -0.76 0.00 0.00 57.45 54.38 1d9n n PHE 64 Cb 0.51 -1.86 0.00 0.00 0.35 0.00 0.00 39.48 38.48 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 2.30 0.00 -0.00 -4.13 4.81 -1.26 -4.48 118.16 115.39 1d9n n LYS 65 Ca 0.58 0.00 -0.20 0.00 -0.87 0.00 0.00 58.31 57.83 1d9n n LYS 65 Cb 0.51 0.00 -0.14 0.00 0.02 0.00 0.00 35.03 35.42 1d9n n LYS 65 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 1d9n h GLN 66 N 0.00 0.20 0.00 1.64 4.20 -1.99 -3.48 115.11 115.68 1d9n h GLN 66 Ca 0.00 -0.34 0.00 0.00 0.06 0.00 0.00 58.65 58.37 1d9n h GLN 66 Cb 0.00 0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1d9n h GLN 66 CO 0.00 1.16 0.00 0.41 -0.67 0.00 0.00 178.83 179.73 1d9n n GLY 67 N 1.66 1.74 3.12 3.46 0.00 -1.18 -5.06 105.19 108.93 1d9n n GLY 67 Ca -0.19 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.75 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 0.17 0.13 -0.61 -5.25 -1.26 -3.85 121.20 108.52 1d9n s ILE 68 Ca 0.00 -1.81 -0.05 0.00 -0.99 0.00 0.00 60.65 57.80 1d9n s ILE 68 Cb 0.00 -1.72 -0.02 0.00 2.95 0.00 0.00 42.46 43.66 1d9n s ILE 68 CO 0.00 -0.76 0.15 -1.48 -1.79 0.00 0.00 174.94 171.06 1d9n s LEU 69 N -2.97 1.51 0.35 0.37 2.34 -1.26 0.11 118.68 119.12 1d9n s LEU 69 Ca 0.14 -1.00 -0.14 0.00 0.06 0.00 0.00 54.13 53.19 1d9n s LEU 69 Cb 0.08 0.70 0.04 0.00 -0.56 0.00 0.00 46.19 46.44 1d9n s LEU 69 CO -0.05 -0.78 0.70 0.00 -1.06 0.00 0.00 176.35 175.16 1d9n n TYR 71 N -0.51 0.00 -2.54 0.00 4.19 -1.26 -4.43 117.16 112.61 1d9n n TYR 71 Ca -0.06 0.00 -0.41 0.00 3.31 0.00 0.00 57.90 60.75 1d9n n TYR 71 Cb 0.60 0.00 -0.03 0.00 0.49 0.00 0.00 39.34 40.40 1d9n n TYR 71 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 1d9n s PRO 72 N 0.00 3.42 -0.26 2.98 0.04 -1.26 -4.91 135.00 135.01 1d9n s PRO 72 Ca 0.00 -0.78 -0.28 0.00 0.04 0.00 0.00 61.00 59.98 1d9n s PRO 72 Cb 0.00 -4.95 0.17 0.00 0.04 0.00 0.00 34.50 29.75 1d9n s PRO 72 CO 0.00 -2.23 1.24 0.00 0.04 0.00 0.00 177.00 176.05 1d9n s ALA 73 N 5.43 -2.08 -0.46 8.56 0.00 -1.26 -5.11 121.76 126.84 1d9n s ALA 73 Ca 0.43 1.76 -0.29 0.00 0.00 0.00 0.00 51.96 53.86 1d9n s ALA 73 Cb -0.03 -1.38 0.02 0.00 0.00 0.00 0.00 23.12 21.73 1d9n s ALA 73 CO -0.01 -0.22 1.23 -1.25 0.00 0.00 0.00 175.76 175.51 1d9n s PRO 74 N -0.56 3.67 0.00 0.00 0.04 -1.26 -5.28 135.00 131.61 1d9n s PRO 74 Ca 0.05 0.68 0.21 0.00 0.04 0.00 0.00 61.00 61.98 1d9n s PRO 74 Cb -0.03 -3.95 0.17 0.00 0.04 0.00 0.00 34.50 30.73 1d9n s PRO 74 CO -0.07 -1.45 1.18 1.63 0.04 0.00 0.00 177.00 178.32