#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2akk s SER 2 N 0.00 3.47 -0.40 7.83 0.01 -1.26 -5.01 113.70 118.35 2akk s SER 2 Ca 0.00 -1.03 0.09 0.00 1.31 0.00 0.00 55.95 56.32 2akk s SER 2 Cb 0.00 -0.95 0.27 0.00 0.21 0.00 0.00 66.02 65.54 2akk s SER 2 CO 0.00 -0.26 0.57 2.30 0.41 0.00 0.00 173.24 176.26 2akk n ILE 3 N 4.82 -0.44 -2.46 1.44 -5.35 -1.26 -5.00 119.36 111.12 2akk n ILE 3 Ca -0.11 -4.17 -0.41 0.00 -0.27 0.00 0.00 62.75 57.78 2akk n ILE 3 Cb 0.45 -1.68 -0.03 0.00 -1.74 0.00 0.00 39.64 36.64 2akk n ILE 3 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2akk s GLU 4 N -1.47 3.24 -0.12 6.28 2.02 -1.26 -4.83 118.70 122.56 2akk s GLU 4 Ca 0.36 0.17 -0.18 0.00 0.02 0.00 0.00 54.97 55.34 2akk s GLU 4 Cb 0.20 -4.15 -0.04 0.00 0.10 0.00 0.00 34.13 30.24 2akk s GLU 4 CO -0.10 -2.04 0.49 0.08 0.02 0.00 0.00 175.26 173.71 2akk s VAL 5 N 6.00 5.18 0.28 2.63 1.01 -1.26 -4.84 120.40 129.40 2akk s VAL 5 Ca 0.45 0.97 0.02 0.00 0.00 0.00 0.00 61.98 63.42 2akk s VAL 5 Cb -0.09 -3.83 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 2akk s VAL 5 CO 0.21 0.32 0.11 -0.13 0.00 0.00 0.00 175.10 175.60 2akk s ARG 6 N 0.66 1.48 0.00 2.72 3.00 -1.26 -0.05 118.95 125.51 2akk s ARG 6 Ca 0.26 -1.82 0.00 0.00 0.00 0.00 0.00 55.73 54.18 2akk s ARG 6 Cb -0.15 -0.30 0.00 0.00 0.00 0.00 0.00 34.95 34.50 2akk s ARG 6 CO 0.11 -0.32 0.00 -0.40 0.00 0.00 0.00 175.30 174.68 2akk n ASP 7 N -0.60 0.00 0.22 0.23 5.75 -0.32 -4.84 116.55 116.99 2akk n ASP 7 Ca -0.00 -0.97 0.07 0.00 -0.01 0.00 0.00 54.79 53.87 2akk n ASP 7 Cb 0.66 0.00 0.51 0.00 -1.03 0.00 0.00 41.12 41.26 2akk n ASP 7 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2akk h ASN 9 N 0.00 0.00 0.00 0.00 2.35 -1.92 -3.49 115.58 112.53 2akk h ASN 9 Ca -0.00 -0.79 0.00 0.00 -0.55 0.00 0.00 56.30 54.96 2akk h ASN 9 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 2akk h ASN 9 CO 0.03 1.07 0.00 0.61 -1.65 0.00 0.00 177.43 177.49 2akk n GLY 10 N 1.58 0.09 3.65 2.83 0.00 -1.18 -5.13 105.19 107.03 2akk n GLY 10 Ca -0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 2akk n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2akk s ALA 11 N -0.09 3.57 0.48 4.61 0.00 -1.26 -4.81 121.76 124.26 2akk s ALA 11 Ca 0.00 -0.73 -0.24 0.00 0.00 0.00 0.00 51.96 50.99 2akk s ALA 11 Cb 0.00 -2.55 -0.07 0.00 0.00 0.00 0.00 23.12 20.50 2akk s ALA 11 CO 0.00 -0.36 1.42 -0.51 0.00 0.00 0.00 175.76 176.31 2akk s LEU 12 N 1.42 4.04 0.43 0.00 1.43 -1.26 -1.18 118.68 123.56 2akk s LEU 12 Ca 0.14 2.90 0.07 0.00 -1.03 0.00 0.00 54.13 56.21 2akk s LEU 12 Cb -0.15 -4.03 -0.03 0.00 0.03 0.00 0.00 46.19 42.01 2akk s LEU 12 CO 0.07 -1.30 0.26 -0.76 0.23 0.00 0.00 176.35 174.85 2akk s LEU 13 N -2.96 3.16 0.32 1.79 1.43 0.93 -4.88 118.68 118.47 2akk s LEU 13 Ca 0.64 -0.99 -0.18 0.00 -1.03 0.00 0.00 54.13 52.57 2akk s LEU 13 Cb -0.43 -1.61 0.06 0.00 0.03 0.00 0.00 46.19 44.24 2akk s LEU 13 CO 0.54 -0.63 0.86 0.00 0.23 0.00 0.00 176.35 177.35 2akk s ALA 14 N -2.58 -1.03 0.04 4.21 0.00 -1.26 -4.73 121.76 116.41 2akk s ALA 14 Ca 0.42 -0.59 -0.30 0.00 0.00 0.00 0.00 51.96 51.49 2akk s ALA 14 Cb 0.01 0.71 -0.08 0.00 0.00 0.00 0.00 23.12 23.75 2akk s ALA 14 CO 0.24 -1.01 1.80 0.34 0.00 0.00 0.00 175.76 177.13 2akk s ASP 15 N -3.15 6.53 0.00 0.00 2.15 -1.26 -1.83 116.67 119.10 2akk s ASP 15 Ca 0.17 2.54 0.00 0.00 0.43 0.00 0.00 52.55 55.69 2akk s ASP 15 Cb -0.04 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.03 2akk s ASP 15 CO 0.09 -0.98 0.00 0.61 -0.17 0.00 0.00 175.17 174.72 2akk n GLY 16 N 4.27 0.74 3.87 2.66 0.00 0.17 -4.98 105.19 111.93 2akk n GLY 16 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 2akk n GLY 16 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2akk s ASP 17 N -2.58 3.67 0.06 1.61 -1.08 -0.76 -4.31 116.67 113.28 2akk s ASP 17 Ca 0.00 0.64 0.08 0.00 -0.52 0.00 0.00 52.55 52.74 2akk s ASP 17 Cb 0.00 -0.98 -0.03 0.00 -1.46 0.00 0.00 42.92 40.45 2akk s ASP 17 CO 0.00 -2.42 -0.21 0.20 0.52 0.00 0.00 175.17 173.26 2akk s ASN 18 N -4.55 2.54 0.22 -0.34 0.02 -1.26 -0.50 114.94 111.07 2akk s ASN 18 Ca 0.67 -0.57 -0.03 0.00 -1.02 0.00 0.00 52.86 51.90 2akk s ASN 18 Cb -0.09 -0.19 -0.03 0.00 0.02 0.00 0.00 41.25 40.96 2akk s ASN 18 CO 0.51 0.14 0.22 0.68 0.02 0.00 0.00 177.10 178.67 2akk s VAL 19 N -0.90 0.00 0.10 1.60 -7.23 -0.17 -1.16 120.40 112.64 2akk s VAL 19 Ca 0.07 -1.87 -0.16 0.00 -1.81 0.00 0.00 61.98 58.21 2akk s VAL 19 Cb -0.09 -2.45 0.03 0.00 0.56 0.00 0.00 36.38 34.43 2akk s VAL 19 CO 0.03 0.00 0.39 -0.44 -0.31 0.00 0.00 175.10 174.77 2akk s SER 20 N -3.15 -0.23 0.23 4.85 0.01 0.10 -0.06 113.70 115.45 2akk s SER 20 Ca 0.36 -0.25 -0.30 0.00 1.31 0.00 0.00 55.95 57.06 2akk s SER 20 Cb 0.05 0.45 -0.09 0.00 0.21 0.00 0.00 66.02 66.64 2akk s SER 20 CO 0.13 -0.80 1.36 -0.76 0.41 0.00 0.00 173.24 173.58 2akk s LEU 21 N -2.60 4.41 0.01 2.44 2.01 0.32 0.27 118.68 125.52 2akk s LEU 21 Ca 0.01 2.53 0.22 0.00 0.01 0.00 0.00 54.13 56.91 2akk s LEU 21 Cb 0.01 -3.62 -0.00 0.00 0.01 0.00 0.00 46.19 42.59 2akk s LEU 21 CO -0.10 -0.60 1.03 2.30 1.01 0.00 0.00 176.35 180.00 2akk n ILE 22 N 2.35 0.02 -3.92 -0.59 -5.35 -0.93 -1.76 119.36 109.18 2akk n ILE 22 Ca 0.06 -0.05 -0.10 0.00 -0.27 0.00 0.00 62.75 62.39 2akk n ILE 22 Cb 0.42 0.66 -0.02 0.00 -1.74 0.00 0.00 39.64 38.96 2akk n ILE 22 CO 0.00 0.00 0.00 -1.59 -1.76 0.00 0.00 176.55 173.20 2akk s LYS 23 N -3.05 1.92 -0.51 6.28 -2.85 -1.26 -4.91 119.74 115.36 2akk s LYS 23 Ca 0.08 -1.36 -0.24 0.00 -1.00 0.00 0.00 55.97 53.45 2akk s LYS 23 Cb 0.16 0.55 0.04 0.00 -2.06 0.00 0.00 37.83 36.52 2akk s LYS 23 CO 0.82 -0.86 0.90 -0.51 0.10 0.00 0.00 175.35 175.80 2akk s ASP 24 N -3.06 6.39 -0.33 0.03 1.01 -1.26 -3.36 116.67 116.09 2akk s ASP 24 Ca 0.19 -0.20 -0.12 0.00 0.71 0.00 0.00 52.55 53.13 2akk s ASP 24 Cb -0.03 -2.43 -0.02 0.00 1.01 0.00 0.00 42.92 41.45 2akk s ASP 24 CO 0.12 -1.12 0.22 -0.76 0.21 0.00 0.00 175.17 173.83 2akk s LEU 25 N 3.76 4.39 -0.16 1.23 2.01 0.25 -4.89 118.68 125.27 2akk s LEU 25 Ca 0.32 -0.43 -0.10 0.00 0.01 0.00 0.00 54.13 53.93 2akk s LEU 25 Cb -0.12 -2.10 -0.05 0.00 0.01 0.00 0.00 46.19 43.93 2akk s LEU 25 CO 0.22 -0.22 0.18 -0.75 1.01 0.00 0.00 176.35 176.79 2akk s LYS 26 N 1.70 4.03 0.20 1.70 2.36 -1.26 0.10 119.74 128.56 2akk s LYS 26 Ca 0.06 -0.10 0.05 0.00 -2.55 0.00 0.00 55.97 53.43 2akk s LYS 26 Cb -0.17 -3.36 -0.04 0.00 -1.05 0.00 0.00 37.83 33.21 2akk s LYS 26 CO 0.09 0.41 0.20 -0.51 1.55 0.00 0.00 175.35 177.10 2akk s LEU 27 N 0.01 3.94 0.43 5.43 1.43 0.24 -4.96 118.68 125.19 2akk s LEU 27 Ca 0.12 -0.11 -0.22 0.00 -1.03 0.00 0.00 54.13 52.89 2akk s LEU 27 Cb -0.12 -2.50 -0.10 0.00 0.03 0.00 0.00 46.19 43.50 2akk s LEU 27 CO 0.01 0.01 1.00 -0.75 0.23 0.00 0.00 176.35 176.85 2akk s LYS 28 N -3.49 4.13 0.00 1.70 2.20 -1.26 -2.70 119.74 120.32 2akk s LYS 28 Ca 0.32 1.31 0.00 0.00 -0.36 0.00 0.00 55.97 57.25 2akk s LYS 28 Cb -0.09 -2.32 0.00 0.00 -1.51 0.00 0.00 37.83 33.91 2akk s LYS 28 CO 0.25 -0.14 0.00 0.41 -0.36 0.00 0.00 175.35 175.52 2akk n GLY 29 N -0.13 0.52 1.10 5.54 0.00 -1.26 -4.73 105.19 106.23 2akk n GLY 29 Ca 0.07 -0.86 -0.01 0.00 0.00 0.00 0.00 46.02 45.22 2akk n GLY 29 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2akk n SER 30 N 0.00 2.79 -2.59 1.61 3.41 -1.26 -4.87 113.62 112.70 2akk n SER 30 Ca 0.00 -2.38 -0.06 0.00 -0.26 0.00 0.00 58.87 56.17 2akk n SER 30 Cb 0.00 -0.58 0.01 0.00 -0.26 0.00 0.00 64.21 63.38 2akk n SER 30 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2akk n SER 31 N 0.13 -6.80 -4.35 4.04 7.64 -1.26 -4.99 113.62 108.03 2akk n SER 31 Ca 0.13 0.41 -0.44 0.00 1.01 0.00 0.00 58.87 59.98 2akk n SER 31 Cb 0.67 -4.54 -0.07 0.00 -1.01 0.00 0.00 64.21 59.25 2akk n SER 31 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2akk s THR 32 N -2.33 5.07 -0.32 0.44 2.01 -1.10 -4.96 115.64 114.45 2akk s THR 32 Ca 0.19 -1.21 -0.13 0.00 0.31 0.00 0.00 61.69 60.85 2akk s THR 32 Cb -0.05 -4.09 -0.03 0.00 0.01 0.00 0.00 72.50 68.34 2akk s THR 32 CO 0.62 -0.63 0.24 -0.69 -0.69 0.00 0.00 174.62 173.47 2akk s VAL 33 N 1.60 5.28 0.00 3.82 1.01 -1.26 0.80 120.40 131.65 2akk s VAL 33 Ca 0.04 -0.06 -0.02 0.00 0.00 0.00 0.00 61.98 61.93 2akk s VAL 33 Cb -0.25 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 2akk s VAL 33 CO 0.05 0.05 0.18 -0.76 0.00 0.00 0.00 175.10 174.62 2akk s LEU 34 N 1.77 4.32 0.28 3.92 1.02 0.11 -4.95 118.68 125.16 2akk s LEU 34 Ca 0.07 0.31 0.07 0.00 0.02 0.00 0.00 54.13 54.61 2akk s LEU 34 Cb -0.17 -2.64 -0.03 0.00 0.02 0.00 0.00 46.19 43.36 2akk s LEU 34 CO 0.11 0.25 0.20 -0.54 0.02 0.00 0.00 176.35 176.38 2akk s LYS 35 N -2.03 2.80 0.36 1.70 -0.14 -1.26 -0.58 119.74 120.59 2akk s LYS 35 Ca 0.28 -1.16 -0.28 0.00 -1.36 0.00 0.00 55.97 53.45 2akk s LYS 35 Cb -0.13 -2.49 -0.11 0.00 -1.68 0.00 0.00 37.83 33.42 2akk s LYS 35 CO 0.20 0.31 1.47 0.50 -0.76 0.00 0.00 175.35 177.07 2akk s ARG 36 N -3.86 4.15 0.00 1.68 3.52 -1.21 -2.73 118.95 120.49 2akk s ARG 36 Ca 0.35 2.52 0.00 0.00 -0.13 0.00 0.00 55.73 58.47 2akk s ARG 36 Cb -0.07 -2.99 0.00 0.00 -1.56 0.00 0.00 34.95 30.33 2akk s ARG 36 CO 0.25 -0.49 0.00 0.41 -0.81 0.00 0.00 175.30 174.66 2akk n GLY 37 N 0.66 0.64 3.67 8.12 0.00 -0.72 -4.96 105.19 112.59 2akk n GLY 37 Ca 0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.59 2akk n GLY 37 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2akk n THR 38 N -2.00 0.61 -3.20 2.61 -1.04 -1.10 -4.63 114.28 105.52 2akk n THR 38 Ca 0.00 -0.11 -0.41 0.00 -2.04 0.00 0.00 64.05 61.49 2akk n THR 38 Cb 0.00 -2.11 -0.07 0.00 -1.82 0.00 0.00 70.33 66.32 2akk n THR 38 CO 0.00 0.00 0.00 -0.32 -0.64 0.00 0.00 175.07 174.11 2akk s MET 39 N 3.89 3.83 -0.62 -2.82 1.75 -1.26 -0.52 119.30 123.54 2akk s MET 39 Ca 0.89 0.11 -0.11 0.00 -1.25 0.00 0.00 55.69 55.32 2akk s MET 39 Cb -0.53 -3.74 0.16 0.00 2.84 0.00 0.00 34.83 33.55 2akk s MET 39 CO 0.44 -0.55 0.53 0.42 -0.65 0.00 0.00 175.02 175.21 2akk s ILE 40 N 2.45 4.80 -0.12 10.11 1.01 0.91 -4.75 121.20 135.60 2akk s ILE 40 Ca 0.21 -2.13 -0.04 0.00 0.00 0.00 0.00 60.65 58.70 2akk s ILE 40 Cb -0.15 -4.06 -0.03 0.00 0.01 0.00 0.00 42.46 38.22 2akk s ILE 40 CO 0.12 -0.89 0.01 0.00 0.00 0.00 0.00 174.94 174.18 2akk s ARG 41 N 0.80 3.36 0.00 2.79 1.04 -1.19 -1.00 118.95 124.76 2akk s ARG 41 Ca 0.11 -0.40 0.00 0.00 -1.04 0.00 0.00 55.73 54.40 2akk s ARG 41 Cb -0.21 -2.93 0.00 0.00 -2.04 0.00 0.00 34.95 29.77 2akk s ARG 41 CO -0.03 0.52 0.00 0.41 -0.04 0.00 0.00 175.30 176.16 2akk n GLY 42 N 2.72 0.55 3.94 3.88 0.00 -0.00 -4.21 105.19 112.07 2akk n GLY 42 Ca -0.18 -0.08 -0.24 0.00 0.00 0.00 0.00 46.02 45.52 2akk n GLY 42 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2akk s ILE 43 N -1.43 4.87 0.06 -0.61 -5.25 0.35 -3.46 121.20 115.73 2akk s ILE 43 Ca 0.00 -0.48 -0.00 0.00 -0.99 0.00 0.00 60.65 59.18 2akk s ILE 43 Cb 0.00 -3.78 -0.04 0.00 2.95 0.00 0.00 42.46 41.59 2akk s ILE 43 CO 0.00 -0.51 -0.04 0.00 -1.79 0.00 0.00 174.94 172.60 2akk s ARG 44 N -4.36 0.66 0.10 0.37 1.70 0.15 0.45 118.95 118.02 2akk s ARG 44 Ca 0.42 -1.24 -0.23 0.00 -0.47 0.00 0.00 55.73 54.20 2akk s ARG 44 Cb -0.10 0.10 -0.07 0.00 -0.57 0.00 0.00 34.95 34.32 2akk s ARG 44 CO 0.36 -0.09 0.71 -0.51 -1.08 0.00 0.00 175.30 174.70 2akk s LEU 45 N -2.93 4.53 0.00 -1.89 1.43 -1.26 -2.07 118.68 116.49 2akk s LEU 45 Ca 0.08 1.47 0.00 0.00 -1.03 0.00 0.00 54.13 54.65 2akk s LEU 45 Cb 0.07 -3.15 0.00 0.00 0.03 0.00 0.00 46.19 43.14 2akk s LEU 45 CO -0.09 0.17 0.00 0.35 0.23 0.00 0.00 176.35 177.01 2akk n THR 46 N 2.01 0.00 1.38 5.49 -2.24 -1.26 -4.92 114.28 114.75 2akk n THR 46 Ca -0.06 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.85 2akk n THR 46 Cb 0.50 -0.74 0.46 0.00 -2.10 0.00 0.00 70.33 68.45 2akk n THR 46 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2akk n ASP 47 N 0.00 1.33 -4.91 3.42 8.00 -1.26 -4.86 116.55 118.27 2akk n ASP 47 Ca 0.00 -1.26 -0.32 0.00 0.71 0.00 0.00 54.79 53.93 2akk n ASP 47 Cb 0.00 0.06 -0.04 0.00 -0.02 0.00 0.00 41.12 41.11 2akk n ASP 47 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2akk s SER 48 N -2.21 6.42 0.04 -2.24 0.01 -1.26 -4.99 113.70 109.47 2akk s SER 48 Ca 0.32 0.41 0.23 0.00 1.31 0.00 0.00 55.95 58.22 2akk s SER 48 Cb 0.20 -2.02 -0.00 0.00 0.21 0.00 0.00 66.02 64.41 2akk s SER 48 CO 0.41 0.15 0.97 -0.62 0.41 0.00 0.00 173.24 174.56 2akk n GLU 49 N 0.37 0.31 0.00 12.44 1.02 -1.26 -4.07 120.64 129.44 2akk n GLU 49 Ca -0.05 -0.02 0.07 0.00 -0.02 0.00 0.00 57.16 57.14 2akk n GLU 49 Cb 0.52 -1.59 0.02 0.00 -0.02 0.00 0.00 31.44 30.37 2akk n GLU 49 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2akk n ASP 50 N -1.98 1.70 -4.16 1.62 9.92 -1.26 -4.03 116.55 118.36 2akk n ASP 50 Ca 0.01 -1.35 -0.20 0.00 -0.53 0.00 0.00 54.79 52.73 2akk n ASP 50 Cb 0.44 0.29 -0.13 0.00 -0.64 0.00 0.00 41.12 41.09 2akk n ASP 50 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2akk s GLU 51 N -1.46 0.90 0.33 -1.24 8.01 -1.26 -0.96 118.70 123.02 2akk s GLU 51 Ca 0.13 -0.85 0.04 0.00 0.01 0.00 0.00 54.97 54.29 2akk s GLU 51 Cb 0.11 -0.92 -0.03 0.00 -4.31 0.00 0.00 34.13 28.97 2akk s GLU 51 CO 0.27 0.22 0.17 0.96 0.01 0.00 0.00 175.26 176.89 2akk s ILE 52 N -1.03 0.34 -0.03 -1.63 -4.36 0.14 -4.07 121.20 110.56 2akk s ILE 52 Ca 0.00 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.42 2akk s ILE 52 Cb -0.09 -2.48 0.00 0.00 1.25 0.00 0.00 42.46 41.14 2akk s ILE 52 CO 0.02 0.00 -0.11 -0.70 0.24 0.00 0.00 174.94 174.39 2akk s GLU 53 N -3.74 1.17 0.26 0.37 2.12 -0.88 0.13 118.70 118.13 2akk s GLU 53 Ca 0.34 -0.37 0.06 0.00 0.36 0.00 0.00 54.97 55.36 2akk s GLU 53 Cb 0.04 -1.06 -0.02 0.00 0.26 0.00 0.00 34.13 33.34 2akk s GLU 53 CO 0.18 0.13 0.22 0.41 -0.54 0.00 0.00 175.26 175.66 2akk n GLY 54 N 3.30 3.17 3.06 -1.50 0.00 -0.31 0.32 105.19 113.23 2akk n GLY 54 Ca -0.19 -1.85 -0.22 0.00 0.00 0.00 0.00 46.02 43.76 2akk n GLY 54 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2akk s ARG 55 N -3.06 1.19 0.09 1.61 1.70 -1.22 -0.88 118.95 118.37 2akk s ARG 55 Ca 0.31 -0.43 0.01 0.00 -0.47 0.00 0.00 55.73 55.15 2akk s ARG 55 Cb 0.01 -1.09 0.01 0.00 -0.57 0.00 0.00 34.95 33.31 2akk s ARG 55 CO 0.22 0.20 0.10 0.25 -1.08 0.00 0.00 175.30 174.98 2akk n THR 56 N 3.08 0.00 0.23 4.99 -2.24 0.12 -3.15 114.28 117.31 2akk n THR 56 Ca -0.17 -0.32 0.11 0.00 -2.27 0.00 0.00 64.05 61.40 2akk n THR 56 Cb 0.54 -0.70 0.49 0.00 -2.10 0.00 0.00 70.33 68.57 2akk n THR 56 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2akk h ASP 57 N 0.06 0.00 0.00 3.42 3.32 -1.96 -3.40 116.42 117.85 2akk h ASP 57 Ca -0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.00 2akk h ASP 57 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2akk h ASP 57 CO 0.07 0.20 0.00 0.29 -1.72 0.00 0.00 179.24 178.08 2akk n LYS 58 N -3.38 0.00 -2.75 3.56 5.02 -1.26 -4.98 118.16 114.38 2akk n LYS 58 Ca 0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 2akk n LYS 58 Cb 0.41 -0.17 -0.03 0.00 -0.02 0.00 0.00 35.03 35.21 2akk n LYS 58 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2akk s ILE 59 N -0.61 4.63 -0.12 -0.18 -1.09 -1.26 -5.03 121.20 117.54 2akk s ILE 59 Ca 0.00 1.60 -0.03 0.00 -2.23 0.00 0.00 60.65 59.98 2akk s ILE 59 Cb 0.00 -4.31 -0.03 0.00 -1.58 0.00 0.00 42.46 36.54 2akk s ILE 59 CO 0.00 -0.36 -0.00 -1.59 -1.23 0.00 0.00 174.94 171.76 2akk s LYS 60 N 3.35 3.37 0.00 2.79 -2.85 -1.26 0.14 119.74 125.28 2akk s LYS 60 Ca 0.41 -0.44 0.00 0.00 -1.00 0.00 0.00 55.97 54.94 2akk s LYS 60 Cb -0.13 -2.90 0.00 0.00 -2.06 0.00 0.00 37.83 32.74 2akk s LYS 60 CO 0.13 0.48 0.00 0.41 0.10 0.00 0.00 175.35 176.47 2akk n GLY 61 N 2.83 0.48 3.50 0.59 0.00 -0.06 -4.95 105.19 107.58 2akk n GLY 61 Ca -0.18 -0.48 -0.34 0.00 0.00 0.00 0.00 46.02 45.03 2akk n GLY 61 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2akk s LEU 62 N -1.87 3.07 -0.19 0.99 2.34 -0.22 -4.88 118.68 117.91 2akk s LEU 62 Ca 0.00 -0.13 -0.18 0.00 0.06 0.00 0.00 54.13 53.87 2akk s LEU 62 Cb 0.00 -1.69 -0.03 0.00 -0.56 0.00 0.00 46.19 43.90 2akk s LEU 62 CO 0.00 0.26 0.51 -0.69 -1.06 0.00 0.00 176.35 175.37 2akk s VAL 63 N -0.18 5.12 0.02 1.48 1.01 -1.26 -1.16 120.40 125.43 2akk s VAL 63 Ca 0.02 0.95 0.01 0.00 0.00 0.00 0.00 61.98 62.96 2akk s VAL 63 Cb -0.13 -3.84 -0.01 0.00 0.00 0.00 0.00 36.38 32.40 2akk s VAL 63 CO 0.03 0.20 -0.05 -0.76 0.00 0.00 0.00 175.10 174.52 2akk s LEU 64 N 1.48 2.15 0.19 3.92 1.43 0.12 -4.97 118.68 122.99 2akk s LEU 64 Ca 0.24 -0.33 -0.32 0.00 -1.03 0.00 0.00 54.13 52.69 2akk s LEU 64 Cb -0.15 -0.12 -0.11 0.00 0.03 0.00 0.00 46.19 45.84 2akk s LEU 64 CO 0.10 -0.12 1.61 0.00 0.23 0.00 0.00 176.35 178.17 2akk s ARG 65 N -0.92 4.19 -0.06 1.70 1.70 -1.26 -0.68 118.95 123.61 2akk s ARG 65 Ca -0.06 2.44 0.02 0.00 -0.47 0.00 0.00 55.73 57.66 2akk s ARG 65 Cb -0.06 -3.12 0.15 0.00 -0.57 0.00 0.00 34.95 31.34 2akk s ARG 65 CO -0.00 -0.64 0.91 -2.37 -1.08 0.00 0.00 175.30 172.12 2akk n THR 66 N 3.81 0.89 0.55 4.99 5.66 -0.14 -3.73 114.28 126.31 2akk n THR 66 Ca 0.14 -0.31 0.12 0.00 -3.05 0.00 0.00 64.05 60.95 2akk n THR 66 Cb 0.38 -0.63 0.13 0.00 -1.55 0.00 0.00 70.33 68.66 2akk n THR 66 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 2akk h GLU 67 N 0.54 0.00 0.00 1.09 5.08 -1.89 -3.17 114.58 116.24 2akk h GLU 67 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2akk h GLU 67 Cb 1.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.26 2akk h GLU 67 CO 0.14 0.00 -0.03 1.97 -1.00 0.00 0.00 179.01 180.09 2akk n PHE 68 N -2.11 0.00 -4.41 4.33 1.16 -1.24 -4.66 117.46 110.52 2akk n PHE 68 Ca 0.03 -0.77 -0.31 0.00 -1.87 0.00 0.00 57.45 54.53 2akk n PHE 68 Cb 0.44 -0.11 -0.11 0.00 -1.61 0.00 0.00 39.48 38.09 2akk n PHE 68 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 2akk s LEU 69 N -2.10 2.93 -0.15 5.98 1.43 -1.22 -2.18 118.68 123.35 2akk s LEU 69 Ca 0.20 -0.35 0.01 0.00 -1.03 0.00 0.00 54.13 52.96 2akk s LEU 69 Cb 0.18 -1.72 0.00 0.00 0.03 0.00 0.00 46.19 44.68 2akk s LEU 69 CO 0.02 0.23 -0.17 -0.75 0.23 0.00 0.00 176.35 175.91 2akk s LYS 70 N -1.78 3.16 0.01 1.70 2.36 0.14 -1.26 119.74 124.07 2akk s LYS 70 Ca 0.18 -0.78 -0.30 0.00 -2.55 0.00 0.00 55.97 52.53 2akk s LYS 70 Cb -0.11 -2.59 -0.09 0.00 -1.05 0.00 0.00 37.83 34.00 2akk s LYS 70 CO 0.10 -0.01 2.01 1.17 1.55 0.00 0.00 175.35 180.16 2akk n LYS 71 N 4.12 2.77 -0.07 4.03 4.81 -1.26 0.02 118.16 132.58 2akk n LYS 71 Ca -0.19 1.00 -0.11 0.00 -0.87 0.00 0.00 58.31 58.13 2akk n LYS 71 Cb 0.52 -3.04 -0.05 0.00 0.02 0.00 0.00 35.03 32.48 2akk n LYS 71 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2akk h ALA 72 N 11.16 0.30 0.00 3.14 0.00 -1.41 -3.47 119.26 128.97 2akk h ALA 72 Ca -0.49 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2akk h ALA 72 Cb 1.24 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2akk h ALA 72 CO 0.94 -0.01 0.00 0.41 0.00 0.00 0.00 179.25 180.60 2akk n GLY 73 N -0.39 0.18 0.00 0.00 0.00 -1.26 -5.05 105.19 98.66 2akk n GLY 73 Ca -0.04 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2akk n GLY 73 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76