#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d9n s ALA 2 N 0.00 3.26 0.70 -5.12 0.00 -1.26 -5.07 121.76 114.27 1d9n s ALA 2 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.39 1d9n s ALA 2 Cb 0.00 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 20.03 1d9n s ALA 2 CO 0.00 0.21 0.00 0.39 0.00 0.00 0.00 175.76 176.36 1d9n n GLU 3 N 0.60 1.87 -2.00 0.00 -0.58 -1.26 -4.96 120.64 114.31 1d9n n GLU 3 Ca 0.01 0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.36 1d9n n GLU 3 Cb 0.50 0.00 0.03 0.00 -0.57 0.00 0.00 31.44 31.41 1d9n n GLU 3 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1d9n n ASP 4 N 0.00 7.19 -4.55 1.62 2.03 -1.26 -4.97 116.55 116.61 1d9n n ASP 4 Ca 0.00 -3.82 -0.35 0.00 0.52 0.00 0.00 54.79 51.14 1d9n n ASP 4 Cb 0.00 -1.00 -0.03 0.00 -0.72 0.00 0.00 41.12 39.37 1d9n n ASP 4 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 1d9n s TRP 5 N -4.02 1.19 0.04 -0.67 0.52 -1.26 -4.28 118.94 110.46 1d9n s TRP 5 Ca 0.51 1.45 0.06 0.00 0.02 0.00 0.00 56.10 58.14 1d9n s TRP 5 Cb 0.43 -3.67 -0.03 0.00 -1.15 0.00 0.00 33.47 29.05 1d9n s TRP 5 CO -0.39 -2.41 -0.12 -0.51 0.02 0.00 0.00 176.95 173.54 1d9n s LEU 6 N 11.83 2.90 -0.01 2.99 1.43 -0.95 -4.91 118.68 131.97 1d9n s LEU 6 Ca 0.91 -0.32 -0.39 0.00 -1.03 0.00 0.00 54.13 53.30 1d9n s LEU 6 Cb -0.16 -1.69 -0.19 0.00 0.03 0.00 0.00 46.19 44.18 1d9n s LEU 6 CO 0.23 0.25 1.22 -0.67 0.23 0.00 0.00 176.35 177.61 1d9n n ASP 7 N 1.36 0.74 -4.62 2.29 2.03 -1.26 -1.76 116.55 115.32 1d9n n ASP 7 Ca -0.15 1.14 -0.43 0.00 0.52 0.00 0.00 54.79 55.87 1d9n n ASP 7 Cb 0.52 -1.02 -0.02 0.00 -0.72 0.00 0.00 41.12 39.88 1d9n n ASP 7 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1d9n h PRO 9 N 8.66 0.00 -1.48 0.00 0.13 -1.88 0.31 132.00 137.74 1d9n h PRO 9 Ca -0.22 0.00 0.46 0.00 -0.87 0.00 0.00 66.00 65.37 1d9n h PRO 9 Cb 1.06 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.09 1d9n h PRO 9 CO 1.07 0.65 1.01 0.00 -0.23 0.00 0.00 178.00 180.51 1d9n h ALA 10 N -0.36 3.10 0.00 -0.56 0.00 -1.91 -3.06 119.26 116.47 1d9n h ALA 10 Ca -0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1d9n h ALA 10 Cb 0.65 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1d9n h ALA 10 CO -0.00 -1.67 -0.44 1.28 0.00 0.00 0.00 179.25 178.42 1d9n n LEU 11 N -4.40 1.06 0.00 0.00 4.77 -1.25 -4.97 117.00 112.22 1d9n n LEU 11 Ca 0.37 0.17 0.00 0.00 -0.03 0.00 0.00 56.01 56.52 1d9n n LEU 11 Cb 1.56 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 42.13 1d9n n LEU 11 CO 0.31 -0.45 0.00 0.61 -1.33 0.00 0.00 177.39 176.53 1d9n n GLY 12 N 2.07 0.34 3.83 -0.72 0.00 0.11 -5.03 105.19 105.79 1d9n n GLY 12 Ca -0.06 -1.36 -0.32 0.00 0.00 0.00 0.00 46.02 44.28 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 3.66 0.00 1.61 0.04 -1.26 -3.68 135.00 133.37 1d9n s PRO 13 Ca 0.00 1.04 0.00 0.00 0.04 0.00 0.00 61.00 62.08 1d9n s PRO 13 Cb 0.00 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.45 1d9n s PRO 13 CO 0.00 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 176.93 1d9n n GLY 14 N -1.43 2.54 3.64 0.56 0.00 -1.26 -4.98 105.19 104.26 1d9n n GLY 14 Ca 0.07 -0.17 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 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 -1.21 3.31 -0.26 1.61 -0.11 -1.24 -3.09 118.94 117.95 1d9n s TRP 15 Ca 0.00 0.53 -0.13 0.00 1.22 0.00 0.00 56.10 57.71 1d9n s TRP 15 Cb 0.00 -2.55 -0.04 0.00 -1.50 0.00 0.00 33.47 29.38 1d9n s TRP 15 CO 0.00 -0.11 0.28 0.15 -4.62 0.00 0.00 176.95 172.65 1d9n s LYS 16 N 1.67 4.02 -0.54 5.86 3.01 -0.99 -1.97 119.74 130.80 1d9n s LYS 16 Ca 0.17 -0.10 -0.21 0.00 -1.01 0.00 0.00 55.97 54.81 1d9n s LYS 16 Cb -0.15 -3.62 0.05 0.00 -1.01 0.00 0.00 37.83 33.10 1d9n s LYS 16 CO 0.09 -0.16 0.78 0.50 0.51 0.00 0.00 175.35 177.07 1d9n s ARG 17 N 1.71 3.20 -0.02 1.68 3.52 -0.72 -2.24 118.95 126.08 1d9n s ARG 17 Ca 0.12 -0.65 -0.07 0.00 -0.13 0.00 0.00 55.73 54.99 1d9n s ARG 17 Cb -0.15 -4.10 -0.05 0.00 -1.56 0.00 0.00 34.95 29.09 1d9n s ARG 17 CO 0.09 -1.39 0.26 0.50 -0.81 0.00 0.00 175.30 173.95 1d9n s ARG 18 N 3.28 3.59 0.00 5.12 3.00 0.82 -2.24 118.95 132.53 1d9n s ARG 18 Ca 0.22 -0.04 0.01 0.00 -1.00 0.00 0.00 55.73 54.92 1d9n s ARG 18 Cb -0.17 -3.11 -0.01 0.00 0.00 0.00 0.00 34.95 31.67 1d9n s ARG 18 CO 0.14 0.68 -0.04 -1.83 0.00 0.00 0.00 175.30 174.25 1d9n s GLU 19 N -1.56 0.31 0.44 5.12 -1.05 -1.26 -1.41 118.70 119.29 1d9n s GLU 19 Ca 0.25 -0.24 0.03 0.00 -0.15 0.00 0.00 54.97 54.86 1d9n s GLU 19 Cb -0.13 -0.25 -0.02 0.00 -0.44 0.00 0.00 34.13 33.29 1d9n s GLU 19 CO 0.14 0.06 0.10 0.08 0.95 0.00 0.00 175.26 176.59 1d9n s VAL 20 N -0.34 0.74 -0.52 1.83 1.01 -0.74 -4.36 120.40 118.01 1d9n s VAL 20 Ca -0.01 -2.00 0.05 0.00 0.00 0.00 0.00 61.98 60.01 1d9n s VAL 20 Cb -0.03 -2.27 0.07 0.00 0.00 0.00 0.00 36.38 34.15 1d9n s VAL 20 CO -0.00 0.00 0.81 0.33 0.00 0.00 0.00 175.10 176.24 1d9n n PHE 21 N -1.03 0.07 0.00 5.22 -0.00 -1.26 -3.96 117.46 116.50 1d9n n PHE 21 Ca -0.10 -0.18 0.00 0.00 -0.00 0.00 0.00 57.45 57.17 1d9n n PHE 21 Cb 0.65 -0.01 0.00 0.00 -0.00 0.00 0.00 39.48 40.12 1d9n n PHE 21 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63 1d9n n ARG 22 N 0.14 0.00 0.00 -4.13 0.00 -1.26 -3.60 116.66 107.81 1d9n n ARG 22 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.89 1d9n n ARG 22 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.65 1d9n n ARG 22 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 1d9n n LYS 23 N 0.00 0.00 -4.02 -0.14 3.00 -1.26 -5.08 118.16 110.66 1d9n n LYS 23 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.18 1d9n n LYS 23 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.00 1d9n n LYS 23 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1d9n s SER 24 N 0.00 0.65 0.00 3.14 0.01 -1.24 -5.13 113.70 111.13 1d9n s SER 24 Ca 0.00 -1.37 0.00 0.00 1.31 0.00 0.00 55.95 55.89 1d9n s SER 24 Cb 0.00 0.70 0.00 0.00 0.21 0.00 0.00 66.02 66.93 1d9n s SER 24 CO 0.00 -1.38 0.00 0.61 0.41 0.00 0.00 173.24 172.88 1d9n n GLY 25 N -0.55 -1.89 0.00 3.44 0.00 -1.26 -4.77 105.19 100.16 1d9n n GLY 25 Ca -0.01 0.94 0.00 0.00 0.00 0.00 0.00 46.02 46.94 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 0.00 0.00 0.01 4.61 0.00 -1.26 -4.63 120.51 119.24 1d9n n ALA 26 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 1d9n n ALA 26 Cb 0.00 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.53 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 -0.22 0.71 -2.79 0.00 -1.04 -1.26 -4.66 114.28 105.02 1d9n n THR 27 Ca 0.00 -0.85 -0.11 0.00 -2.04 0.00 0.00 64.05 61.05 1d9n n THR 27 Cb 0.00 0.69 0.03 0.00 -1.82 0.00 0.00 70.33 69.23 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 -0.02 1.48 0.00 0.00 0.00 -1.26 -4.92 105.19 100.47 1d9n n GLY 29 Ca 0.11 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 44.00 1d9n n GLY 29 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1d9n n ARG 30 N -2.09 0.00 -1.06 1.61 -4.01 -1.26 -5.06 116.66 104.78 1d9n n ARG 30 Ca 0.12 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.93 1d9n n ARG 30 Cb 0.44 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.86 1d9n n ARG 30 CO 0.00 0.00 0.00 -1.13 -3.04 0.00 0.00 177.63 173.46 1d9n n SER 31 N -0.83 -6.19 -4.67 2.89 3.41 -1.26 -4.87 113.62 102.10 1d9n n SER 31 Ca 0.00 0.78 -0.40 0.00 -0.26 0.00 0.00 58.87 58.99 1d9n n SER 31 Cb 0.00 -2.55 -0.05 0.00 -0.26 0.00 0.00 64.21 61.35 1d9n n SER 31 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1d9n s ASP 32 N -1.92 6.78 -0.07 4.04 1.11 -1.25 -4.87 116.67 120.49 1d9n s ASP 32 Ca 0.00 0.95 0.02 0.00 0.18 0.00 0.00 52.55 53.71 1d9n s ASP 32 Cb 0.00 -2.38 -0.02 0.00 1.07 0.00 0.00 42.92 41.59 1d9n s ASP 32 CO 0.00 -0.27 -0.13 -0.89 1.18 0.00 0.00 175.17 175.06 1d9n s THR 33 N 1.78 3.20 0.08 -1.27 2.01 -1.26 -1.79 115.64 118.38 1d9n s THR 33 Ca 0.32 -0.66 0.05 0.00 0.31 0.00 0.00 61.69 61.71 1d9n s THR 33 Cb -0.16 -2.28 -0.03 0.00 0.01 0.00 0.00 72.50 70.04 1d9n s THR 33 CO 0.12 0.58 -0.13 -0.31 -0.69 0.00 0.00 174.62 174.18 1d9n s TYR 34 N -0.56 1.19 -0.06 4.92 1.51 -0.50 -4.79 117.35 119.05 1d9n s TYR 34 Ca 0.08 -0.50 0.05 0.00 -1.01 0.00 0.00 57.07 55.69 1d9n s TYR 34 Cb -0.12 -0.66 -0.01 0.00 -0.11 0.00 0.00 41.96 41.07 1d9n s TYR 34 CO 0.01 0.05 -0.22 0.71 -1.11 0.00 0.00 175.55 175.00 1d9n s TYR 35 N -1.52 2.20 -0.16 2.71 2.02 -0.78 -0.13 117.35 121.69 1d9n s TYR 35 Ca -0.00 -0.71 -0.00 0.00 -0.37 0.00 0.00 57.07 55.98 1d9n s TYR 35 Cb -0.09 -1.47 -0.00 0.00 -0.40 0.00 0.00 41.96 40.01 1d9n s TYR 35 CO 0.02 -0.25 -0.14 -1.14 -1.57 0.00 0.00 175.55 172.47 1d9n s GLN 36 N 0.04 3.24 1.02 -0.62 0.74 -0.95 -2.24 119.66 120.88 1d9n s GLN 36 Ca -0.07 -0.73 -0.16 0.00 0.05 0.00 0.00 55.36 54.44 1d9n s GLN 36 Cb -0.14 -2.67 0.21 0.00 1.10 0.00 0.00 33.01 31.51 1d9n s GLN 36 CO 0.04 -0.01 1.20 -1.12 -0.55 0.00 0.00 175.29 174.86 1d9n s SER 37 N 0.89 2.56 0.00 6.67 0.01 -0.32 -2.35 113.70 121.16 1d9n s SER 37 Ca -0.03 0.57 0.27 0.00 1.31 0.00 0.00 55.95 58.07 1d9n s SER 37 Cb -0.15 -0.83 1.40 0.00 0.21 0.00 0.00 66.02 66.65 1d9n s SER 37 CO -0.01 -3.10 1.93 -0.81 0.41 0.00 0.00 173.24 171.65 1d9n n PRO 38 N -4.07 0.46 0.00 12.44 -0.04 -1.18 -2.80 135.00 139.82 1d9n n PRO 38 Ca 0.12 0.03 0.11 0.00 -0.04 0.00 0.00 63.50 63.72 1d9n n PRO 38 Cb 0.59 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.64 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 -1.24 0.00 -0.25 0.52 5.66 -1.26 -4.93 114.28 112.79 1d9n n THR 39 Ca 0.14 -0.48 0.00 0.00 -3.05 0.00 0.00 64.05 60.66 1d9n n THR 39 Cb 0.19 1.43 0.00 0.00 -1.55 0.00 0.00 70.33 70.41 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 1.24 0.85 3.63 1.09 0.00 -1.12 -5.04 105.19 105.82 1d9n n GLY 40 Ca 0.12 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.24 6.78 -0.40 1.61 1.01 -1.26 -4.87 116.67 117.29 1d9n s ASP 41 Ca 0.00 0.87 -0.10 0.00 0.71 0.00 0.00 52.55 54.03 1d9n s ASP 41 Cb 0.00 -2.44 0.06 0.00 1.01 0.00 0.00 42.92 41.54 1d9n s ASP 41 CO 0.00 -0.63 0.24 -0.13 0.21 0.00 0.00 175.17 174.86 1d9n s ARG 42 N 3.04 2.71 0.18 8.23 0.52 -1.26 -1.17 118.95 131.20 1d9n s ARG 42 Ca 0.36 -1.30 0.11 0.00 -0.52 0.00 0.00 55.73 54.38 1d9n s ARG 42 Cb -0.14 -3.77 -0.04 0.00 0.52 0.00 0.00 34.95 31.52 1d9n s ARG 42 CO 0.11 -0.85 -0.24 0.42 0.02 0.00 0.00 175.30 174.76 1d9n s ILE 43 N 1.48 2.28 0.00 1.52 1.09 -0.95 -5.01 121.20 121.61 1d9n s ILE 43 Ca 0.02 -1.97 0.00 0.00 -1.10 0.00 0.00 60.65 57.60 1d9n s ILE 43 Cb -0.22 -2.07 0.00 0.00 -1.06 0.00 0.00 42.46 39.11 1d9n s ILE 43 CO 0.04 -0.10 0.00 -2.11 -0.10 0.00 0.00 174.94 172.67 1d9n n ARG 44 N 0.39 2.45 -2.93 2.79 1.85 -1.26 -1.87 116.66 118.07 1d9n n ARG 44 Ca -0.14 0.00 -0.40 0.00 -1.00 0.00 0.00 57.85 56.32 1d9n n ARG 44 Cb 0.56 -0.95 -0.06 0.00 -1.05 0.00 0.00 32.46 30.96 1d9n n ARG 44 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1d9n s SER 45 N -2.41 7.45 0.01 2.89 0.15 -1.26 -4.85 113.70 115.67 1d9n s SER 45 Ca 0.00 1.71 -0.25 0.00 0.70 0.00 0.00 55.95 58.11 1d9n s SER 45 Cb 0.00 -2.52 -0.18 0.00 -1.71 0.00 0.00 66.02 61.61 1d9n s SER 45 CO 0.00 0.20 1.33 0.07 1.20 0.00 0.00 173.24 176.03 1d9n h LYS 46 N 4.31 -0.17 0.00 5.44 2.10 -1.93 -2.51 116.57 123.80 1d9n h LYS 46 Ca -0.47 0.01 -0.05 0.00 -2.00 0.00 0.00 60.65 58.15 1d9n h LYS 46 Cb 1.20 0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 32.57 1d9n h LYS 46 CO 0.66 0.16 -0.24 0.28 -2.00 0.00 0.00 179.45 178.31 1d9n h VAL 47 N -0.53 0.50 0.04 0.07 2.07 -1.94 -0.65 116.25 115.81 1d9n h VAL 47 Ca -0.02 -1.34 -0.00 0.00 0.82 0.00 0.00 66.70 66.16 1d9n h VAL 47 Cb 0.41 1.95 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1d9n h VAL 47 CO 0.03 0.24 -0.02 -0.33 0.02 0.00 0.00 177.57 177.51 1d9n h GLU 48 N 0.00 -0.05 -0.12 1.57 5.08 -1.95 0.14 114.58 119.25 1d9n h GLU 48 Ca -0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 1d9n h GLU 48 Cb 0.93 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 1d9n h GLU 48 CO 0.03 0.22 -0.66 1.37 -1.00 0.00 0.00 179.01 178.97 1d9n h LEU 49 N -0.31 0.56 -1.04 1.33 8.10 -1.44 -2.22 115.31 120.29 1d9n h LEU 49 Ca -0.01 -0.34 0.02 0.00 0.11 0.00 0.00 57.88 57.67 1d9n h LEU 49 Cb 0.29 -0.16 -0.05 0.00 -0.44 0.00 0.00 40.66 40.29 1d9n h LEU 49 CO 0.01 1.07 0.64 0.00 -4.11 0.00 0.00 178.44 176.06 1d9n h THR 50 N 0.35 1.21 0.00 0.15 1.03 -0.97 0.28 112.91 114.95 1d9n h THR 50 Ca -0.02 -0.44 -0.05 0.00 -0.01 0.00 0.00 66.41 65.89 1d9n h THR 50 Cb 1.23 -0.18 -0.01 0.00 -1.07 0.00 0.00 68.15 68.12 1d9n h THR 50 CO 0.12 0.23 -0.24 0.03 -0.01 0.00 0.00 175.52 175.65 1d9n h ARG 51 N 1.28 0.00 0.34 0.00 2.47 -0.50 0.66 114.38 118.63 1d9n h ARG 51 Ca 0.37 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 59.08 1d9n h ARG 51 Cb -0.07 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.26 1d9n h ARG 51 CO -0.10 0.24 -0.16 -0.92 0.56 0.00 0.00 179.97 179.59 1d9n h TYR 52 N 0.00 -0.42 -0.62 3.04 3.20 0.10 -3.29 116.97 118.98 1d9n h TYR 52 Ca -0.00 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.77 1d9n h TYR 52 Cb 0.65 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 39.04 1d9n h TYR 52 CO 0.00 -0.13 0.03 -0.07 -1.64 0.00 0.00 178.16 176.35 1d9n h LEU 53 N -1.02 1.05 0.00 2.82 4.07 -1.14 -3.49 115.31 117.59 1d9n h LEU 53 Ca -0.05 -0.29 0.00 0.00 0.08 0.00 0.00 57.88 57.62 1d9n h LEU 53 Cb 0.48 -0.28 0.00 0.00 1.08 0.00 0.00 40.66 41.94 1d9n h LEU 53 CO 0.08 1.09 0.00 0.61 -1.08 0.00 0.00 178.44 179.13 1d9n n GLY 54 N -0.45 0.43 0.14 0.83 0.00 0.22 -4.73 105.19 101.63 1d9n n GLY 54 Ca 0.03 -2.10 -0.16 0.00 0.00 0.00 0.00 46.02 43.79 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 0.40 -1.01 1.61 0.13 -1.92 -3.26 132.00 127.95 1d9n h PRO 55 Ca 0.00 -0.52 0.32 0.00 -0.87 0.00 0.00 66.00 64.93 1d9n h PRO 55 Cb 0.00 0.17 -0.15 0.00 0.13 0.00 0.00 31.00 31.15 1d9n h PRO 55 CO 0.00 1.19 0.58 0.00 -0.23 0.00 0.00 178.00 179.54 1d9n h ALA 56 N 0.61 1.98 -3.05 -0.56 0.00 -1.93 -2.79 119.26 113.51 1d9n h ALA 56 Ca -0.12 0.18 -0.67 0.00 0.00 0.00 0.00 54.91 54.30 1d9n h ALA 56 Cb 1.77 0.15 -0.38 0.00 0.00 0.00 0.00 17.79 19.33 1d9n h ALA 56 CO 0.19 -0.58 -0.34 0.00 0.00 0.00 0.00 179.25 178.51 1d9n s ASP 58 N -0.28 5.16 0.00 0.00 1.01 -1.06 -4.57 116.67 116.93 1d9n s ASP 58 Ca 0.23 1.25 0.00 0.00 0.71 0.00 0.00 52.55 54.74 1d9n s ASP 58 Cb -0.12 -2.05 0.00 0.00 1.01 0.00 0.00 42.92 41.76 1d9n s ASP 58 CO -0.10 -1.54 0.66 0.18 0.21 0.00 0.00 175.17 174.59 1d9n n LEU 59 N -3.15 -0.32 -0.11 1.23 4.32 -1.26 -4.88 117.00 112.82 1d9n n LEU 59 Ca 0.07 -1.32 -0.05 0.00 -0.02 0.00 0.00 56.01 54.68 1d9n n LEU 59 Cb 0.56 0.00 0.02 0.00 -1.62 0.00 0.00 43.42 42.39 1d9n n LEU 59 CO 0.57 1.16 0.90 0.74 -1.22 0.00 0.00 177.39 179.54 1d9n h THR 60 N 5.00 0.80 -0.26 -5.08 2.02 -1.94 -2.49 112.91 110.96 1d9n h THR 60 Ca -0.18 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 66.93 1d9n h THR 60 Cb 1.13 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 68.14 1d9n h THR 60 CO -0.09 0.03 0.00 0.18 0.37 0.00 0.00 175.52 176.01 1d9n n LEU 61 N -5.10 3.01 -4.76 2.58 7.99 -1.26 -4.98 117.00 114.48 1d9n n LEU 61 Ca 0.02 -1.41 -0.41 0.00 -0.01 0.00 0.00 56.01 54.20 1d9n n LEU 61 Cb 0.17 -0.16 -0.02 0.00 -0.11 0.00 0.00 43.42 43.30 1d9n n LEU 61 CO 0.24 0.63 1.12 0.12 -1.51 0.00 0.00 177.39 177.99 1d9n s PHE 62 N -1.36 2.89 -0.35 -1.77 5.36 -0.94 -4.03 117.98 117.78 1d9n s PHE 62 Ca 0.30 1.06 -0.18 0.00 -0.96 0.00 0.00 56.93 57.15 1d9n s PHE 62 Cb 0.18 -3.89 -0.00 0.00 -0.34 0.00 0.00 43.02 38.97 1d9n s PHE 62 CO 0.25 -2.80 0.50 -0.51 -1.46 0.00 0.00 175.22 171.20 1d9n s ASP 63 N 0.16 6.31 -1.16 6.13 1.11 -0.18 -4.93 116.67 124.10 1d9n s ASP 63 Ca 0.57 -0.05 -0.10 0.00 0.18 0.00 0.00 52.55 53.16 1d9n s ASP 63 Cb -0.44 -2.26 -0.07 0.00 1.07 0.00 0.00 42.92 41.22 1d9n s ASP 63 CO 0.49 -0.47 2.35 0.33 1.18 0.00 0.00 175.17 179.06 1d9n n PHE 64 N 5.71 1.95 0.00 4.23 -0.00 -1.26 -2.51 117.46 125.58 1d9n n PHE 64 Ca -0.05 -2.38 0.00 0.00 -0.00 0.00 0.00 57.45 55.02 1d9n n PHE 64 Cb 0.49 -2.00 0.00 0.00 -0.00 0.00 0.00 39.48 37.96 1d9n n PHE 64 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.76 177.12 1d9n n LYS 65 N 4.57 0.00 0.05 -4.13 2.85 -1.26 -4.44 118.16 115.79 1d9n n LYS 65 Ca 0.56 0.00 0.11 0.00 -1.05 0.00 0.00 58.31 57.93 1d9n n LYS 65 Cb 0.22 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.55 1d9n n LYS 65 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1d9n n GLN 66 N 0.00 0.53 -2.75 -1.58 6.02 -1.17 -4.98 117.38 113.46 1d9n n GLN 66 Ca 0.00 -0.01 -0.07 0.00 -0.01 0.00 0.00 57.00 56.91 1d9n n GLN 66 Cb 0.00 -1.67 0.03 0.00 1.02 0.00 0.00 30.24 29.62 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 1.26 0.37 0.00 1.08 0.00 -1.04 -5.04 105.19 101.81 1d9n n GLY 67 Ca -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1d9n n GLY 67 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1d9n n ILE 68 N -2.94 0.00 0.00 -0.61 -6.64 -1.26 -4.25 119.36 103.66 1d9n n ILE 68 Ca -0.03 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.95 1d9n n ILE 68 Cb 0.53 0.00 0.00 0.00 -1.44 0.00 0.00 39.64 38.73 1d9n n ILE 68 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1d9n n LEU 69 N 0.00 0.00 -3.74 7.28 -0.00 -1.26 -1.01 117.00 118.27 1d9n n LEU 69 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 56.01 55.93 1d9n n LEU 69 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.40 1d9n n LEU 69 CO 0.00 0.00 0.47 0.00 -0.00 0.00 0.00 177.39 177.86 1d9n s TYR 71 N -3.83 2.55 -0.93 0.00 1.51 -1.26 -4.47 117.35 110.91 1d9n s TYR 71 Ca 0.08 -0.26 -0.08 0.00 -1.01 0.00 0.00 57.07 55.81 1d9n s TYR 71 Cb -0.04 -1.26 -0.14 0.00 -0.11 0.00 0.00 41.96 40.40 1d9n s TYR 71 CO 0.02 0.49 2.94 -0.35 -1.11 0.00 0.00 175.55 177.53 1d9n n PRO 72 N 0.22 2.75 -2.69 -1.71 -0.04 -1.26 -4.18 135.00 128.09 1d9n n PRO 72 Ca -0.12 -1.61 -0.06 0.00 -0.04 0.00 0.00 63.50 61.68 1d9n n PRO 72 Cb 0.55 -2.44 0.10 0.00 -0.04 0.00 0.00 33.50 31.67 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 3.32 -2.15 -1.77 0.55 0.00 -1.26 -5.14 120.51 114.06 1d9n n ALA 73 Ca 0.59 -0.87 -0.39 0.00 0.00 0.00 0.00 53.44 52.77 1d9n n ALA 73 Cb 0.42 -2.26 -0.06 0.00 0.00 0.00 0.00 19.45 17.56 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 0.17 4.64 0.00 0.00 0.04 -1.26 -5.27 135.00 133.32 1d9n s PRO 74 Ca 0.22 1.50 0.22 0.00 0.04 0.00 0.00 61.00 62.99 1d9n s PRO 74 Cb 0.28 -3.02 0.18 0.00 0.04 0.00 0.00 34.50 31.99 1d9n s PRO 74 CO -0.14 0.30 1.21 1.63 0.04 0.00 0.00 177.00 180.04