#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 0.96 -0.04 7.83 0.15 -1.26 -4.97 113.70 116.37 2akk s SER 2 Ca 0.00 -0.91 0.20 0.00 0.70 0.00 0.00 55.95 55.94 2akk s SER 2 Cb 0.00 0.78 0.37 0.00 -1.71 0.00 0.00 66.02 65.46 2akk s SER 2 CO 0.00 -0.33 1.16 2.30 1.20 0.00 0.00 173.24 177.57 2akk n ILE 3 N 4.94 0.44 -1.49 6.45 -5.35 -1.26 -5.02 119.36 118.08 2akk n ILE 3 Ca 0.04 -1.31 -0.53 0.00 -0.27 0.00 0.00 62.75 60.68 2akk n ILE 3 Cb 0.47 0.68 -0.08 0.00 -1.74 0.00 0.00 39.64 38.98 2akk n ILE 3 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2akk n GLU 4 N 0.10 1.02 -3.57 6.28 4.71 -1.26 -4.43 120.64 123.49 2akk n GLU 4 Ca 0.08 0.31 -0.37 0.00 -0.01 0.00 0.00 57.16 57.17 2akk n GLU 4 Cb 1.00 -2.28 -0.07 0.00 -1.01 0.00 0.00 31.44 29.08 2akk n GLU 4 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 2akk s VAL 5 N 6.21 5.26 0.24 2.62 1.01 -1.26 -4.89 120.40 129.59 2akk s VAL 5 Ca 1.08 0.59 0.03 0.00 0.00 0.00 0.00 61.98 63.68 2akk s VAL 5 Cb -0.97 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 31.73 2akk s VAL 5 CO 0.55 0.47 0.00 -0.13 0.00 0.00 0.00 175.10 175.99 2akk s ARG 6 N -0.12 1.36 0.47 2.72 3.00 -1.26 -0.28 118.95 124.84 2akk s ARG 6 Ca 0.19 -1.70 -0.07 0.00 0.00 0.00 0.00 55.73 54.14 2akk s ARG 6 Cb -0.14 -0.62 0.11 0.00 0.00 0.00 0.00 34.95 34.30 2akk s ARG 6 CO 0.07 -0.11 0.64 -0.40 0.00 0.00 0.00 175.30 175.49 2akk n ASP 7 N -0.44 0.11 -0.09 0.23 5.75 -0.19 -4.82 116.55 117.09 2akk n ASP 7 Ca -0.05 -1.27 0.09 0.00 -0.01 0.00 0.00 54.79 53.56 2akk n ASP 7 Cb 0.64 -0.48 0.44 0.00 -1.03 0.00 0.00 41.12 40.69 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 0.53 0.59 0.00 0.00 2.35 -1.91 -3.48 115.58 113.66 2akk h ASN 9 Ca 0.26 -0.91 0.00 0.00 -0.55 0.00 0.00 56.30 55.10 2akk h ASN 9 Cb 0.34 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.52 2akk h ASN 9 CO -0.08 1.46 0.00 0.61 -1.65 0.00 0.00 177.43 177.77 2akk n GLY 10 N 1.57 0.80 3.70 2.83 0.00 -1.00 -5.12 105.19 107.96 2akk n GLY 10 Ca -0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.92 3.39 0.40 4.61 0.00 -1.26 -4.74 121.76 123.23 2akk s ALA 11 Ca 0.00 0.07 -0.26 0.00 0.00 0.00 0.00 51.96 51.77 2akk s ALA 11 Cb 0.00 -3.00 -0.09 0.00 0.00 0.00 0.00 23.12 20.03 2akk s ALA 11 CO 0.00 -0.24 1.31 -0.51 0.00 0.00 0.00 175.76 176.32 2akk s LEU 12 N 1.13 4.22 0.44 0.00 1.43 -1.26 -1.03 118.68 123.62 2akk s LEU 12 Ca 0.37 2.67 0.07 0.00 -1.03 0.00 0.00 54.13 56.21 2akk s LEU 12 Cb -0.17 -3.89 -0.02 0.00 0.03 0.00 0.00 46.19 42.14 2akk s LEU 12 CO 0.16 -0.85 0.30 -0.76 0.23 0.00 0.00 176.35 175.44 2akk s LEU 13 N -2.40 3.13 0.37 1.79 1.43 0.61 -4.89 118.68 118.71 2akk s LEU 13 Ca 0.57 -0.99 -0.08 0.00 -1.03 0.00 0.00 54.13 52.59 2akk s LEU 13 Cb -0.38 -1.62 0.03 0.00 0.03 0.00 0.00 46.19 44.24 2akk s LEU 13 CO 0.50 -0.70 0.62 0.00 0.23 0.00 0.00 176.35 177.00 2akk s ALA 14 N -2.59 0.10 -0.39 4.21 0.00 -1.26 -4.68 121.76 117.15 2akk s ALA 14 Ca 0.42 -1.18 -0.29 0.00 0.00 0.00 0.00 51.96 50.91 2akk s ALA 14 Cb -0.00 0.93 0.01 0.00 0.00 0.00 0.00 23.12 24.06 2akk s ALA 14 CO 0.24 -0.88 1.37 0.34 0.00 0.00 0.00 175.76 176.83 2akk s ASP 15 N -3.17 6.42 0.00 0.00 -1.08 -1.26 -2.49 116.67 115.09 2akk s ASP 15 Ca 0.24 0.88 0.00 0.00 -0.52 0.00 0.00 52.55 53.15 2akk s ASP 15 Cb -0.03 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.89 2akk s ASP 15 CO 0.17 -1.35 0.00 0.61 0.52 0.00 0.00 175.17 175.11 2akk n GLY 16 N 4.92 1.35 4.01 2.66 0.00 0.14 -4.97 105.19 113.31 2akk n GLY 16 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.00 4.88 -0.00 1.61 2.15 -0.42 -4.68 116.67 118.21 2akk s ASP 17 Ca 0.00 -0.54 0.02 0.00 0.43 0.00 0.00 52.55 52.46 2akk s ASP 17 Cb 0.00 -0.02 -0.01 0.00 -0.30 0.00 0.00 42.92 42.59 2akk s ASP 17 CO 0.00 -1.47 -0.07 0.54 -0.17 0.00 0.00 175.17 174.01 2akk s ASN 18 N -4.64 0.77 0.33 -0.34 2.20 -1.26 0.39 114.94 112.39 2akk s ASN 18 Ca 0.62 -0.14 0.04 0.00 -0.94 0.00 0.00 52.86 52.45 2akk s ASN 18 Cb -0.06 -0.08 -0.03 0.00 -2.00 0.00 0.00 41.25 39.07 2akk s ASN 18 CO 0.40 0.07 0.18 0.68 -2.94 0.00 0.00 177.10 175.49 2akk s VAL 19 N -0.21 0.30 0.07 3.54 -7.23 0.40 -0.71 120.40 116.57 2akk s VAL 19 Ca 0.02 -2.00 -0.13 0.00 -1.81 0.00 0.00 61.98 58.06 2akk s VAL 19 Cb -0.03 -2.48 0.02 0.00 0.56 0.00 0.00 36.38 34.45 2akk s VAL 19 CO -0.00 0.00 0.29 -0.44 -0.31 0.00 0.00 175.10 174.63 2akk s SER 20 N -3.42 -0.07 0.05 4.85 0.01 0.11 -0.08 113.70 115.16 2akk s SER 20 Ca 0.34 -0.35 -0.31 0.00 1.31 0.00 0.00 55.95 56.95 2akk s SER 20 Cb 0.04 0.37 -0.07 0.00 0.21 0.00 0.00 66.02 66.58 2akk s SER 20 CO 0.19 -0.69 1.41 -0.76 0.41 0.00 0.00 173.24 173.80 2akk s LEU 21 N -2.43 4.34 0.00 2.44 2.01 0.82 -0.16 118.68 125.71 2akk s LEU 21 Ca -0.01 2.22 0.24 0.00 0.01 0.00 0.00 54.13 56.59 2akk s LEU 21 Cb 0.01 -3.57 0.38 0.00 0.01 0.00 0.00 46.19 43.02 2akk s LEU 21 CO -0.07 -0.69 1.32 2.30 1.01 0.00 0.00 176.35 180.22 2akk n ILE 22 N 4.36 0.00 -4.21 -0.59 -5.35 -0.72 -1.20 119.36 111.65 2akk n ILE 22 Ca 0.12 -0.02 -0.18 0.00 -0.27 0.00 0.00 62.75 62.40 2akk n ILE 22 Cb 0.43 0.44 -0.06 0.00 -1.74 0.00 0.00 39.64 38.71 2akk n ILE 22 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2akk n LYS 23 N -1.35 0.52 -3.25 6.28 5.02 -1.26 -4.90 118.16 119.21 2akk n LYS 23 Ca 0.06 -3.16 -0.46 0.00 -2.02 0.00 0.00 58.31 52.73 2akk n LYS 23 Cb 0.34 2.74 -0.03 0.00 -0.02 0.00 0.00 35.03 38.05 2akk n LYS 23 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2akk s ASP 24 N -3.28 6.47 -0.44 4.39 1.01 -1.26 -2.02 116.67 121.54 2akk s ASP 24 Ca 0.36 -2.14 -0.18 0.00 0.71 0.00 0.00 52.55 51.30 2akk s ASP 24 Cb 0.01 -2.24 0.03 0.00 1.01 0.00 0.00 42.92 41.73 2akk s ASP 24 CO 0.26 -0.79 0.48 -0.76 0.21 0.00 0.00 175.17 174.56 2akk s LEU 25 N 1.25 4.94 -0.12 1.23 2.01 0.95 -4.88 118.68 124.06 2akk s LEU 25 Ca 0.13 -0.77 -0.20 0.00 0.01 0.00 0.00 54.13 53.30 2akk s LEU 25 Cb -0.18 -2.40 -0.04 0.00 0.01 0.00 0.00 46.19 43.58 2akk s LEU 25 CO -0.03 -0.66 0.57 -0.75 1.01 0.00 0.00 176.35 176.49 2akk s LYS 26 N 2.22 4.34 0.29 1.70 2.36 -1.26 -1.00 119.74 128.39 2akk s LYS 26 Ca 0.12 0.60 -0.30 0.00 -2.55 0.00 0.00 55.97 53.85 2akk s LYS 26 Cb -0.18 -3.47 -0.11 0.00 -1.05 0.00 0.00 37.83 33.02 2akk s LYS 26 CO 0.13 0.05 1.47 -1.17 1.55 0.00 0.00 175.35 177.38 2akk s LEU 27 N 0.95 4.37 -0.37 5.43 0.20 0.34 -4.93 118.68 124.66 2akk s LEU 27 Ca 0.30 2.80 -0.27 0.00 0.69 0.00 0.00 54.13 57.65 2akk s LEU 27 Cb -0.16 -3.64 0.02 0.00 -0.43 0.00 0.00 46.19 41.98 2akk s LEU 27 CO 0.12 -0.76 0.97 -1.59 -0.29 0.00 0.00 176.35 174.81 2akk s LYS 28 N -0.81 3.86 0.00 1.98 -2.85 -1.26 -3.10 119.74 117.56 2akk s LYS 28 Ca 0.58 0.66 0.00 0.00 -1.00 0.00 0.00 55.97 56.21 2akk s LYS 28 Cb -0.44 -3.80 0.00 0.00 -2.06 0.00 0.00 37.83 31.53 2akk s LYS 28 CO 0.48 -0.98 0.00 0.41 0.10 0.00 0.00 175.35 175.36 2akk n GLY 29 N 4.34 0.85 3.27 0.59 0.00 -1.26 -5.07 105.19 107.91 2akk n GLY 29 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 2akk n GLY 29 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2akk s SER 30 N -2.29 -0.16 -0.03 1.61 0.01 -1.18 -5.04 113.70 106.63 2akk s SER 30 Ca 0.00 -0.13 0.03 0.00 1.31 0.00 0.00 55.95 57.16 2akk s SER 30 Cb 0.00 0.37 0.13 0.00 0.21 0.00 0.00 66.02 66.73 2akk s SER 30 CO 0.00 -0.61 0.84 -1.54 0.41 0.00 0.00 173.24 172.33 2akk n SER 31 N 0.61 1.46 -4.57 2.44 3.41 -1.26 -4.33 113.62 111.38 2akk n SER 31 Ca -0.19 -2.11 -0.42 0.00 -0.26 0.00 0.00 58.87 55.89 2akk n SER 31 Cb 0.59 -0.39 -0.03 0.00 -0.26 0.00 0.00 64.21 64.13 2akk n SER 31 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2akk s THR 32 N -1.47 3.98 -0.53 6.66 2.01 -1.26 -4.97 115.64 120.06 2akk s THR 32 Ca 0.09 0.70 -0.19 0.00 0.31 0.00 0.00 61.69 62.60 2akk s THR 32 Cb 0.06 -4.76 0.07 0.00 0.01 0.00 0.00 72.50 67.88 2akk s THR 32 CO 0.04 -1.46 0.65 -0.69 -0.69 0.00 0.00 174.62 172.47 2akk s VAL 33 N 5.05 4.85 -1.00 3.82 1.01 -1.26 -0.51 120.40 132.36 2akk s VAL 33 Ca 0.39 -0.59 -0.23 0.00 0.00 0.00 0.00 61.98 61.56 2akk s VAL 33 Cb -0.08 -4.35 0.05 0.00 0.00 0.00 0.00 36.38 32.00 2akk s VAL 33 CO 0.22 -0.89 1.42 -0.76 0.00 0.00 0.00 175.10 175.09 2akk s LEU 34 N 2.69 3.55 0.77 3.92 1.43 -0.17 -4.93 118.68 125.94 2akk s LEU 34 Ca 0.15 -1.41 -0.11 0.00 -1.03 0.00 0.00 54.13 51.73 2akk s LEU 34 Cb -0.20 -2.56 0.06 0.00 0.03 0.00 0.00 46.19 43.51 2akk s LEU 34 CO 0.11 -1.51 1.08 -0.54 0.23 0.00 0.00 176.35 175.72 2akk s LYS 35 N 4.93 2.27 0.25 1.70 -0.14 -1.26 -0.03 119.74 127.45 2akk s LYS 35 Ca 0.45 1.05 -0.31 0.00 -1.36 0.00 0.00 55.97 55.80 2akk s LYS 35 Cb -0.01 -1.91 -0.13 0.00 -1.68 0.00 0.00 37.83 34.11 2akk s LYS 35 CO -0.08 -1.60 1.53 -2.13 -0.76 0.00 0.00 175.35 172.30 2akk n ARG 36 N -3.48 2.37 -0.00 1.68 0.63 -0.85 -1.98 116.66 115.03 2akk n ARG 36 Ca 0.08 0.85 0.00 0.00 -0.92 0.00 0.00 57.85 57.86 2akk n ARG 36 Cb 0.54 -2.58 0.00 0.00 0.45 0.00 0.00 32.46 30.86 2akk n ARG 36 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2akk n GLY 37 N 2.44 0.15 3.66 5.14 0.00 -0.34 -4.99 105.19 111.25 2akk n GLY 37 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2akk n GLY 37 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2akk s THR 38 N -2.04 3.05 -0.21 2.61 2.01 -0.84 -4.67 115.64 115.54 2akk s THR 38 Ca 0.00 0.06 -0.22 0.00 0.31 0.00 0.00 61.69 61.84 2akk s THR 38 Cb 0.00 -3.04 -0.02 0.00 0.01 0.00 0.00 72.50 69.45 2akk s THR 38 CO 0.00 -0.01 0.68 -0.32 -0.69 0.00 0.00 174.62 174.28 2akk s MET 39 N 4.49 4.19 -0.58 4.92 1.75 -1.26 -0.13 119.30 132.68 2akk s MET 39 Ca 0.88 0.69 -0.02 0.00 -1.25 0.00 0.00 55.69 55.98 2akk s MET 39 Cb -0.42 -3.60 0.15 0.00 2.84 0.00 0.00 34.83 33.80 2akk s MET 39 CO 0.41 -0.32 0.39 0.42 -0.65 0.00 0.00 175.02 175.26 2akk s ILE 40 N 2.19 3.55 -0.10 10.11 1.01 0.88 -4.67 121.20 134.18 2akk s ILE 40 Ca 0.30 -2.86 -0.00 0.00 0.00 0.00 0.00 60.65 58.09 2akk s ILE 40 Cb -0.16 -3.34 -0.03 0.00 0.01 0.00 0.00 42.46 38.94 2akk s ILE 40 CO 0.10 -0.84 -0.08 0.00 0.00 0.00 0.00 174.94 174.12 2akk s ARG 41 N 0.09 3.08 0.00 2.79 1.04 -1.19 -0.46 118.95 124.31 2akk s ARG 41 Ca 0.16 -0.57 0.00 0.00 -1.04 0.00 0.00 55.73 54.27 2akk s ARG 41 Cb -0.21 -2.67 0.00 0.00 -2.04 0.00 0.00 34.95 30.03 2akk s ARG 41 CO -0.03 0.48 0.00 0.41 -0.04 0.00 0.00 175.30 176.11 2akk n GLY 42 N 2.79 0.85 3.95 3.88 0.00 0.54 -4.46 105.19 112.74 2akk n GLY 42 Ca -0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.56 5.24 0.08 -0.61 -5.25 0.16 -3.82 121.20 115.44 2akk s ILE 43 Ca 0.00 -0.73 0.02 0.00 -0.99 0.00 0.00 60.65 58.95 2akk s ILE 43 Cb 0.00 -3.82 -0.04 0.00 2.95 0.00 0.00 42.46 41.56 2akk s ILE 43 CO 0.00 -0.29 -0.08 0.00 -1.79 0.00 0.00 174.94 172.78 2akk s ARG 44 N -3.78 0.75 0.46 0.37 1.70 0.12 0.27 118.95 118.84 2akk s ARG 44 Ca 0.36 -1.13 -0.21 0.00 -0.47 0.00 0.00 55.73 54.27 2akk s ARG 44 Cb -0.10 -0.30 -0.09 0.00 -0.57 0.00 0.00 34.95 33.89 2akk s ARG 44 CO 0.30 0.02 1.03 -0.51 -1.08 0.00 0.00 175.30 175.06 2akk s LEU 45 N -2.50 3.93 0.00 -1.89 1.43 -1.26 -1.89 118.68 116.50 2akk s LEU 45 Ca 0.04 1.92 0.00 0.00 -1.03 0.00 0.00 54.13 55.06 2akk s LEU 45 Cb -0.01 -4.47 0.00 0.00 0.03 0.00 0.00 46.19 41.75 2akk s LEU 45 CO -0.02 -0.65 0.00 0.35 0.23 0.00 0.00 176.35 176.26 2akk n THR 46 N -0.70 0.00 1.26 5.49 -2.24 -1.26 -4.87 114.28 111.97 2akk n THR 46 Ca 0.08 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.98 2akk n THR 46 Cb 0.52 -0.06 0.64 0.00 -2.10 0.00 0.00 70.33 69.33 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 -0.89 0.00 -4.84 3.42 9.92 -1.26 -4.65 116.55 118.25 2akk n ASP 47 Ca 0.00 -0.32 -0.36 0.00 -0.53 0.00 0.00 54.79 53.57 2akk n ASP 47 Cb 0.00 -0.17 -0.07 0.00 -0.64 0.00 0.00 41.12 40.24 2akk n ASP 47 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2akk s SER 48 N -2.35 6.25 0.07 -2.24 0.01 -1.26 -4.99 113.70 109.20 2akk s SER 48 Ca 0.28 0.40 0.23 0.00 1.31 0.00 0.00 55.95 58.17 2akk s SER 48 Cb 0.16 -2.02 0.12 0.00 0.21 0.00 0.00 66.02 64.48 2akk s SER 48 CO 0.33 0.37 1.09 -0.62 0.41 0.00 0.00 173.24 174.81 2akk n GLU 49 N 2.26 0.31 0.00 12.44 4.71 -1.26 -3.82 120.64 135.28 2akk n GLU 49 Ca -0.19 0.02 0.08 0.00 -0.01 0.00 0.00 57.16 57.05 2akk n GLU 49 Cb 0.54 -1.63 -0.01 0.00 -1.01 0.00 0.00 31.44 29.34 2akk n GLU 49 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 2akk n ASP 50 N -2.04 1.49 -4.24 1.62 2.03 -1.26 -4.27 116.55 109.89 2akk n ASP 50 Ca 0.02 -1.25 -0.24 0.00 0.52 0.00 0.00 54.79 53.84 2akk n ASP 50 Cb 0.45 0.52 -0.13 0.00 -0.72 0.00 0.00 41.12 41.23 2akk n ASP 50 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2akk s GLU 51 N -1.90 1.22 0.32 -0.67 8.01 -1.25 -0.35 118.70 124.08 2akk s GLU 51 Ca 0.12 -0.97 0.03 0.00 0.01 0.00 0.00 54.97 54.16 2akk s GLU 51 Cb 0.12 -1.35 -0.05 0.00 -4.31 0.00 0.00 34.13 28.54 2akk s GLU 51 CO 0.41 0.33 0.10 0.96 0.01 0.00 0.00 175.26 177.07 2akk s ILE 52 N -0.92 0.76 -0.08 -1.63 -4.36 0.37 -4.07 121.20 111.28 2akk s ILE 52 Ca 0.06 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.48 2akk s ILE 52 Cb -0.09 -2.61 0.01 0.00 1.25 0.00 0.00 42.46 41.02 2akk s ILE 52 CO 0.02 0.00 -0.16 -0.70 0.24 0.00 0.00 174.94 174.35 2akk s GLU 53 N -3.88 2.11 0.00 0.37 2.12 -0.79 0.33 118.70 118.95 2akk s GLU 53 Ca 0.34 -0.55 0.00 0.00 0.36 0.00 0.00 54.97 55.12 2akk s GLU 53 Cb 0.07 -1.68 0.00 0.00 0.26 0.00 0.00 34.13 32.77 2akk s GLU 53 CO 0.15 0.06 0.00 0.41 -0.54 0.00 0.00 175.26 175.35 2akk n GLY 54 N 3.75 4.49 3.19 -1.50 0.00 0.02 0.13 105.19 115.27 2akk n GLY 54 Ca -0.22 -1.67 -0.13 0.00 0.00 0.00 0.00 46.02 44.01 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 -1.12 0.47 0.07 1.61 1.70 -1.25 -0.86 118.95 119.57 2akk s ARG 55 Ca 0.00 0.11 0.00 0.00 -0.47 0.00 0.00 55.73 55.37 2akk s ARG 55 Cb 0.00 0.21 0.00 0.00 -0.57 0.00 0.00 34.95 34.60 2akk s ARG 55 CO 0.00 -0.10 0.02 0.25 -1.08 0.00 0.00 175.30 174.40 2akk n THR 56 N 2.20 0.00 0.27 4.99 -2.24 0.13 -3.14 114.28 116.49 2akk n THR 56 Ca -0.17 -0.32 0.13 0.00 -2.27 0.00 0.00 64.05 61.41 2akk n THR 56 Cb 0.57 -0.14 0.78 0.00 -2.10 0.00 0.00 70.33 69.44 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 0.14 0.00 0.00 3.42 5.19 -1.97 -3.40 116.42 119.80 2akk h ASP 57 Ca -0.06 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 2akk h ASP 57 Cb 0.18 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.69 2akk h ASP 57 CO 0.09 0.07 0.00 0.29 -3.12 0.00 0.00 179.24 176.57 2akk n LYS 58 N -3.86 0.00 -2.31 3.56 5.02 -1.26 -4.98 118.16 114.33 2akk n LYS 58 Ca -0.02 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.84 2akk n LYS 58 Cb 0.16 -0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.15 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 -0.88 3.82 -0.08 -0.18 -1.09 -1.26 -5.00 121.20 116.53 2akk s ILE 59 Ca 0.00 0.82 -0.01 0.00 -2.23 0.00 0.00 60.65 59.23 2akk s ILE 59 Cb 0.00 -4.17 -0.03 0.00 -1.58 0.00 0.00 42.46 36.68 2akk s ILE 59 CO 0.00 -0.78 -0.04 -1.59 -1.23 0.00 0.00 174.94 171.30 2akk s LYS 60 N 5.16 2.95 -0.36 2.79 -2.85 -1.26 0.18 119.74 126.35 2akk s LYS 60 Ca 0.62 -0.49 -0.00 0.00 -1.00 0.00 0.00 55.97 55.10 2akk s LYS 60 Cb -0.14 -2.71 -0.00 0.00 -2.06 0.00 0.00 37.83 32.92 2akk s LYS 60 CO 0.31 0.63 0.30 0.41 0.10 0.00 0.00 175.35 177.11 2akk n GLY 61 N 2.33 0.21 3.45 0.59 0.00 -0.04 -4.96 105.19 106.77 2akk n GLY 61 Ca -0.18 -0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.25 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 -3.38 2.82 -0.27 0.99 2.34 -0.23 -4.91 118.68 116.04 2akk s LEU 62 Ca 0.02 -0.22 -0.14 0.00 0.06 0.00 0.00 54.13 53.85 2akk s LEU 62 Cb -0.00 -1.61 -0.04 0.00 -0.56 0.00 0.00 46.19 43.98 2akk s LEU 62 CO 0.22 0.27 0.35 -0.69 -1.06 0.00 0.00 176.35 175.44 2akk s VAL 63 N -0.25 5.19 -0.01 1.48 1.01 -1.26 -0.80 120.40 125.75 2akk s VAL 63 Ca 0.02 0.51 0.03 0.00 0.00 0.00 0.00 61.98 62.53 2akk s VAL 63 Cb -0.13 -3.68 -0.00 0.00 0.00 0.00 0.00 36.38 32.57 2akk s VAL 63 CO 0.03 0.17 -0.08 -0.76 0.00 0.00 0.00 175.10 174.45 2akk s LEU 64 N 2.03 1.95 0.25 3.92 1.43 0.15 -4.95 118.68 123.45 2akk s LEU 64 Ca 0.14 -0.16 -0.31 0.00 -1.03 0.00 0.00 54.13 52.77 2akk s LEU 64 Cb -0.16 -0.45 -0.13 0.00 0.03 0.00 0.00 46.19 45.48 2akk s LEU 64 CO 0.10 0.09 1.51 -2.11 0.23 0.00 0.00 176.35 176.17 2akk n ARG 65 N 2.99 2.31 -0.63 1.70 1.85 -1.26 -0.47 116.66 123.14 2akk n ARG 65 Ca -0.15 0.82 -0.12 0.00 -1.00 0.00 0.00 57.85 57.41 2akk n ARG 65 Cb 0.56 -2.54 0.07 0.00 -1.05 0.00 0.00 32.46 29.50 2akk n ARG 65 CO 0.00 0.00 0.00 -2.37 -0.01 0.00 0.00 177.63 175.25 2akk n THR 66 N 2.27 2.17 0.07 8.89 5.66 0.52 -4.03 114.28 129.82 2akk n THR 66 Ca 0.11 -1.03 -0.12 0.00 -3.05 0.00 0.00 64.05 59.96 2akk n THR 66 Cb 0.33 -0.87 -0.13 0.00 -1.55 0.00 0.00 70.33 68.11 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 0.66 0.15 -0.15 1.09 5.08 -1.89 -3.14 114.58 116.38 2akk h GLU 67 Ca 0.29 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2akk h GLU 67 Cb 1.69 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 31.03 2akk h GLU 67 CO 0.56 1.05 -0.01 1.97 -1.00 0.00 0.00 179.01 181.58 2akk n PHE 68 N -3.41 0.53 -4.75 4.33 1.16 -1.26 -4.33 117.46 109.73 2akk n PHE 68 Ca -0.08 -0.98 -0.31 0.00 -1.87 0.00 0.00 57.45 54.21 2akk n PHE 68 Cb 1.00 -0.25 -0.13 0.00 -1.61 0.00 0.00 39.48 38.49 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 -2.88 2.59 -0.11 5.98 1.43 -1.25 -1.75 118.68 122.69 2akk s LEU 69 Ca 0.38 -0.38 0.04 0.00 -1.03 0.00 0.00 54.13 53.13 2akk s LEU 69 Cb 0.32 -1.52 0.00 0.00 0.03 0.00 0.00 46.19 45.03 2akk s LEU 69 CO 0.06 0.28 -0.24 -0.75 0.23 0.00 0.00 176.35 175.93 2akk s LYS 70 N -1.24 3.04 0.14 1.70 2.36 0.78 -1.43 119.74 125.10 2akk s LYS 70 Ca 0.14 -0.87 -0.31 0.00 -2.55 0.00 0.00 55.97 52.37 2akk s LYS 70 Cb -0.10 -2.33 -0.11 0.00 -1.05 0.00 0.00 37.83 34.23 2akk s LYS 70 CO 0.04 0.14 1.81 1.17 1.55 0.00 0.00 175.35 180.06 2akk n LYS 71 N 3.64 2.78 0.00 4.03 4.81 -1.26 0.10 118.16 132.25 2akk n LYS 71 Ca -0.19 1.01 0.00 0.00 -0.87 0.00 0.00 58.31 58.26 2akk n LYS 71 Cb 0.53 -2.89 0.00 0.00 0.02 0.00 0.00 35.03 32.69 2akk n LYS 71 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2akk n ALA 72 N 5.22 0.00 -3.08 3.14 0.00 0.11 -4.86 120.51 121.05 2akk n ALA 72 Ca 0.18 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.50 2akk n ALA 72 Cb 0.36 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.70 2akk n ALA 72 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2akk s GLY 73 N 0.00 -0.04 0.00 0.00 0.00 -1.26 -4.94 107.32 101.08 2akk s GLY 73 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 44.72 44.87 2akk s GLY 73 CO 0.00 0.05 0.00 -1.14 0.00 0.00 0.00 173.10 172.01