#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 3.38 -0.61 7.83 0.01 -1.26 -4.99 113.70 118.06 2akk s SER 2 Ca 0.00 -2.00 0.03 0.00 1.31 0.00 0.00 55.95 55.29 2akk s SER 2 Cb 0.00 -0.58 0.38 0.00 0.21 0.00 0.00 66.02 66.03 2akk s SER 2 CO 0.00 -0.35 1.34 2.30 0.41 0.00 0.00 173.24 176.94 2akk n ILE 3 N 4.33 3.15 -1.73 1.44 -5.35 -1.26 -5.02 119.36 114.92 2akk n ILE 3 Ca 0.05 -5.05 -0.37 0.00 -0.27 0.00 0.00 62.75 57.12 2akk n ILE 3 Cb 0.38 -1.32 -0.03 0.00 -1.74 0.00 0.00 39.64 36.93 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 -3.72 2.29 -0.22 6.28 2.02 -1.26 -4.73 118.70 119.35 2akk s GLU 4 Ca 0.48 1.13 -0.24 0.00 0.02 0.00 0.00 54.97 56.37 2akk s GLU 4 Cb 0.36 -4.52 -0.01 0.00 0.10 0.00 0.00 34.13 30.07 2akk s GLU 4 CO -0.22 -3.09 0.78 0.08 0.02 0.00 0.00 175.26 172.83 2akk s VAL 5 N 11.10 4.89 0.14 2.63 1.01 -1.26 -4.94 120.40 133.98 2akk s VAL 5 Ca 0.87 1.48 0.08 0.00 0.00 0.00 0.00 61.98 64.41 2akk s VAL 5 Cb -0.16 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 2akk s VAL 5 CO 0.24 -0.01 -0.19 -0.13 0.00 0.00 0.00 175.10 175.00 2akk s ARG 6 N 2.52 1.22 0.51 2.72 0.52 -1.26 -0.47 118.95 124.72 2akk s ARG 6 Ca 0.34 -1.32 -0.09 0.00 -0.52 0.00 0.00 55.73 54.14 2akk s ARG 6 Cb -0.16 -1.37 0.13 0.00 0.52 0.00 0.00 34.95 34.07 2akk s ARG 6 CO 0.09 0.29 0.48 -0.40 0.02 0.00 0.00 175.30 175.78 2akk n ASP 7 N 0.60 -1.33 0.04 0.23 5.75 -0.34 -4.81 116.55 116.69 2akk n ASP 7 Ca -0.16 -0.82 0.16 0.00 -0.01 0.00 0.00 54.79 53.97 2akk n ASP 7 Cb 0.56 -0.43 0.65 0.00 -1.03 0.00 0.00 41.12 40.86 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 0.08 0.00 0.00 0.00 2.35 -1.90 -3.49 115.58 112.61 2akk h ASN 9 Ca 0.21 -0.27 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 2akk h ASN 9 Cb 0.72 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.09 2akk h ASN 9 CO -0.02 0.79 0.00 0.61 -1.65 0.00 0.00 177.43 177.17 2akk n GLY 10 N 1.66 -0.05 3.74 2.83 0.00 -1.06 -5.14 105.19 107.17 2akk n GLY 10 Ca -0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 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 0.00 3.34 0.16 4.61 0.00 -1.26 -4.71 121.76 123.90 2akk s ALA 11 Ca 0.00 0.39 -0.30 0.00 0.00 0.00 0.00 51.96 52.05 2akk s ALA 11 Cb 0.00 -3.08 -0.07 0.00 0.00 0.00 0.00 23.12 19.97 2akk s ALA 11 CO 0.00 0.08 1.04 -0.51 0.00 0.00 0.00 175.76 176.37 2akk s LEU 12 N -0.25 4.50 0.36 0.00 1.43 -1.26 -1.20 118.68 122.27 2akk s LEU 12 Ca 0.41 1.98 0.08 0.00 -1.03 0.00 0.00 54.13 55.57 2akk s LEU 12 Cb -0.22 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.36 2akk s LEU 12 CO 0.26 -0.14 0.17 -0.76 0.23 0.00 0.00 176.35 176.10 2akk s LEU 13 N -0.30 3.22 0.39 1.79 1.43 0.38 -4.97 118.68 120.63 2akk s LEU 13 Ca 0.48 -0.86 -0.14 0.00 -1.03 0.00 0.00 54.13 52.58 2akk s LEU 13 Cb -0.27 -1.67 0.05 0.00 0.03 0.00 0.00 46.19 44.33 2akk s LEU 13 CO 0.33 -0.39 0.77 0.00 0.23 0.00 0.00 176.35 177.29 2akk s ALA 14 N -2.48 -0.56 -0.07 4.21 0.00 -1.26 -4.60 121.76 117.01 2akk s ALA 14 Ca 0.39 -0.86 -0.30 0.00 0.00 0.00 0.00 51.96 51.20 2akk s ALA 14 Cb -0.01 0.71 -0.06 0.00 0.00 0.00 0.00 23.12 23.76 2akk s ALA 14 CO 0.23 -0.97 1.79 0.34 0.00 0.00 0.00 175.76 177.16 2akk s ASP 15 N -3.10 6.45 0.00 0.00 -1.08 -1.26 -1.91 116.67 115.78 2akk s ASP 15 Ca 0.17 2.25 0.00 0.00 -0.52 0.00 0.00 52.55 54.45 2akk s ASP 15 Cb -0.05 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.88 2akk s ASP 15 CO 0.13 -1.11 0.00 0.61 0.52 0.00 0.00 175.17 175.32 2akk n GLY 16 N 4.48 0.93 3.96 2.66 0.00 0.16 -4.97 105.19 112.42 2akk n GLY 16 Ca 0.19 0.00 -0.24 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 -2.14 4.49 -0.01 1.61 -1.08 -0.80 -4.52 116.67 114.22 2akk s ASP 17 Ca 0.00 0.01 0.02 0.00 -0.52 0.00 0.00 52.55 52.06 2akk s ASP 17 Cb 0.00 -0.51 -0.01 0.00 -1.46 0.00 0.00 42.92 40.94 2akk s ASP 17 CO 0.00 -1.77 -0.08 0.54 0.52 0.00 0.00 175.17 174.38 2akk s ASN 18 N -4.64 0.96 0.35 -0.34 2.20 -1.26 0.23 114.94 112.44 2akk s ASN 18 Ca 0.64 -0.15 0.03 0.00 -0.94 0.00 0.00 52.86 52.45 2akk s ASN 18 Cb -0.08 -0.12 -0.04 0.00 -2.00 0.00 0.00 41.25 39.02 2akk s ASN 18 CO 0.44 0.10 0.12 0.68 -2.94 0.00 0.00 177.10 175.50 2akk s VAL 19 N -0.15 0.62 -0.04 3.54 -7.23 0.54 -0.50 120.40 117.18 2akk s VAL 19 Ca 0.03 -2.00 -0.18 0.00 -1.81 0.00 0.00 61.98 58.02 2akk s VAL 19 Cb -0.04 -2.51 0.03 0.00 0.56 0.00 0.00 36.38 34.43 2akk s VAL 19 CO -0.00 0.00 0.40 -0.44 -0.31 0.00 0.00 175.10 174.74 2akk s SER 20 N -3.49 -0.31 0.20 4.85 0.01 0.13 -0.07 113.70 115.03 2akk s SER 20 Ca 0.31 0.30 -0.32 0.00 1.31 0.00 0.00 55.95 57.55 2akk s SER 20 Cb 0.05 0.42 -0.12 0.00 0.21 0.00 0.00 66.02 66.58 2akk s SER 20 CO 0.16 -0.45 1.70 -0.76 0.41 0.00 0.00 173.24 174.30 2akk s LEU 21 N -1.13 4.37 0.02 2.44 2.01 0.10 -0.03 118.68 126.47 2akk s LEU 21 Ca -0.12 2.84 0.24 0.00 0.01 0.00 0.00 54.13 57.10 2akk s LEU 21 Cb -0.04 -3.60 0.36 0.00 0.01 0.00 0.00 46.19 42.92 2akk s LEU 21 CO 0.05 -0.95 1.31 2.30 1.01 0.00 0.00 176.35 180.06 2akk n ILE 22 N 3.97 0.07 -3.89 -0.59 -5.35 -0.71 -1.50 119.36 111.37 2akk n ILE 22 Ca 0.16 -0.07 -0.10 0.00 -0.27 0.00 0.00 62.75 62.46 2akk n ILE 22 Cb 0.36 0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.51 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 2.13 -0.23 6.28 -2.85 -1.26 -4.90 119.74 115.85 2akk s LYS 23 Ca 0.09 -1.51 -0.19 0.00 -1.00 0.00 0.00 55.97 53.36 2akk s LYS 23 Cb 0.16 0.57 -0.03 0.00 -2.06 0.00 0.00 37.83 36.48 2akk s LYS 23 CO 0.73 -0.97 0.54 -0.51 0.10 0.00 0.00 175.35 175.25 2akk s ASP 24 N -3.11 6.52 -0.15 0.03 1.01 -1.26 -3.06 116.67 116.65 2akk s ASP 24 Ca 0.20 0.63 0.01 0.00 0.71 0.00 0.00 52.55 54.10 2akk s ASP 24 Cb -0.04 -2.30 0.00 0.00 1.01 0.00 0.00 42.92 41.59 2akk s ASP 24 CO 0.14 -0.26 -0.17 -0.76 0.21 0.00 0.00 175.17 174.33 2akk s LEU 25 N 2.05 2.38 -0.13 1.23 2.01 -0.19 -4.94 118.68 121.09 2akk s LEU 25 Ca 0.24 -0.51 -0.07 0.00 0.01 0.00 0.00 54.13 53.80 2akk s LEU 25 Cb -0.16 -1.53 -0.04 0.00 0.01 0.00 0.00 46.19 44.47 2akk s LEU 25 CO 0.09 0.08 0.12 -0.75 1.01 0.00 0.00 176.35 176.90 2akk s LYS 26 N 0.82 3.52 0.09 1.70 2.36 -1.26 -0.20 119.74 126.77 2akk s LYS 26 Ca -0.06 -0.19 0.05 0.00 -2.55 0.00 0.00 55.97 53.23 2akk s LYS 26 Cb -0.15 -3.18 -0.04 0.00 -1.05 0.00 0.00 37.83 33.41 2akk s LYS 26 CO -0.01 0.67 -0.01 -0.51 1.55 0.00 0.00 175.35 177.04 2akk s LEU 27 N -0.74 3.41 0.21 5.43 2.01 0.23 -4.95 118.68 124.28 2akk s LEU 27 Ca 0.13 -0.20 0.02 0.00 0.01 0.00 0.00 54.13 54.10 2akk s LEU 27 Cb -0.12 -2.13 0.17 0.00 0.01 0.00 0.00 46.19 44.12 2akk s LEU 27 CO 0.03 0.18 1.51 0.11 1.01 0.00 0.00 176.35 179.19 2akk h LYS 28 N 3.52 0.31 -5.78 1.70 1.57 -1.96 -0.73 116.57 115.20 2akk h LYS 28 Ca -0.48 -0.23 -0.56 0.00 -1.87 0.00 0.00 60.65 57.52 2akk h LYS 28 Cb 1.17 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 2akk h LYS 28 CO 0.59 0.85 1.55 0.41 -0.57 0.00 0.00 179.45 182.27 2akk n GLY 29 N 0.37 0.49 2.55 3.86 0.00 -1.26 -1.26 105.19 109.94 2akk n GLY 29 Ca -0.03 0.80 -0.20 0.00 0.00 0.00 0.00 46.02 46.59 2akk n GLY 29 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2akk n SER 30 N 12.65 -5.41 -3.13 1.61 7.64 -1.26 -2.68 113.62 123.04 2akk n SER 30 Ca 0.38 0.46 -0.08 0.00 1.01 0.00 0.00 58.87 60.64 2akk n SER 30 Cb 0.40 -4.76 0.01 0.00 -1.01 0.00 0.00 64.21 58.84 2akk n SER 30 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2akk n SER 31 N -1.37 -7.28 -4.33 6.43 2.88 -0.39 -4.96 113.62 104.59 2akk n SER 31 Ca -0.21 -0.03 -0.44 0.00 -1.33 0.00 0.00 58.87 56.86 2akk n SER 31 Cb 0.67 -4.58 -0.07 0.00 -0.75 0.00 0.00 64.21 59.48 2akk n SER 31 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2akk s THR 32 N -2.78 5.00 -0.54 2.46 2.01 -0.28 -4.96 115.64 116.55 2akk s THR 32 Ca 0.10 -1.30 -0.18 0.00 0.31 0.00 0.00 61.69 60.62 2akk s THR 32 Cb -0.02 -4.09 0.10 0.00 0.01 0.00 0.00 72.50 68.50 2akk s THR 32 CO 0.78 -0.67 0.59 -0.69 -0.69 0.00 0.00 174.62 173.94 2akk s VAL 33 N 1.58 5.00 0.40 3.82 1.01 -1.26 0.77 120.40 131.71 2akk s VAL 33 Ca 0.04 -1.04 -0.23 0.00 0.00 0.00 0.00 61.98 60.74 2akk s VAL 33 Cb -0.26 -4.36 -0.10 0.00 0.00 0.00 0.00 36.38 31.67 2akk s VAL 33 CO 0.04 -0.91 0.99 -0.76 0.00 0.00 0.00 175.10 174.46 2akk s LEU 34 N 2.22 4.08 0.27 3.92 1.02 0.72 -4.93 118.68 125.97 2akk s LEU 34 Ca 0.09 1.86 0.08 0.00 0.02 0.00 0.00 54.13 56.18 2akk s LEU 34 Cb -0.25 -4.32 -0.04 0.00 0.02 0.00 0.00 46.19 41.60 2akk s LEU 34 CO 0.06 -0.39 0.10 -0.54 0.02 0.00 0.00 176.35 175.60 2akk s LYS 35 N -2.73 2.55 0.35 1.70 -0.14 -1.26 -1.02 119.74 119.19 2akk s LYS 35 Ca 0.59 -1.30 -0.29 0.00 -1.36 0.00 0.00 55.97 53.61 2akk s LYS 35 Cb -0.16 -2.32 -0.11 0.00 -1.68 0.00 0.00 37.83 33.56 2akk s LYS 35 CO 0.21 0.33 1.48 0.50 -0.76 0.00 0.00 175.35 177.11 2akk s ARG 36 N -3.77 4.15 0.00 1.68 3.52 -1.17 -2.60 118.95 120.76 2akk s ARG 36 Ca 0.33 2.51 0.00 0.00 -0.13 0.00 0.00 55.73 58.44 2akk s ARG 36 Cb -0.06 -3.00 0.00 0.00 -1.56 0.00 0.00 34.95 30.33 2akk s ARG 36 CO 0.22 -0.50 0.00 0.41 -0.81 0.00 0.00 175.30 174.62 2akk n GLY 37 N 0.93 1.26 3.66 8.12 0.00 -0.56 -4.97 105.19 113.63 2akk n GLY 37 Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.61 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 0.71 -3.07 2.61 -1.04 -1.07 -4.65 114.28 105.76 2akk n THR 38 Ca 0.00 -0.15 -0.40 0.00 -2.04 0.00 0.00 64.05 61.46 2akk n THR 38 Cb 0.00 -2.23 -0.05 0.00 -1.82 0.00 0.00 70.33 66.22 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 4.51 4.26 -0.58 -2.82 1.75 -1.26 -0.72 119.30 124.43 2akk s MET 39 Ca 0.91 0.73 -0.01 0.00 -1.25 0.00 0.00 55.69 56.06 2akk s MET 39 Cb -0.49 -3.55 0.15 0.00 2.84 0.00 0.00 34.83 33.78 2akk s MET 39 CO 0.44 -0.20 0.38 0.42 -0.65 0.00 0.00 175.02 175.41 2akk s ILE 40 N 1.75 3.38 0.08 10.11 1.01 0.91 -4.65 121.20 133.79 2akk s ILE 40 Ca 0.32 -3.00 0.04 0.00 0.00 0.00 0.00 60.65 58.01 2akk s ILE 40 Cb -0.16 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 39.02 2akk s ILE 40 CO 0.12 -0.84 0.00 0.00 0.00 0.00 0.00 174.94 174.22 2akk s ARG 41 N -0.05 2.58 0.00 2.79 1.04 -1.20 -0.34 118.95 123.77 2akk s ARG 41 Ca 0.16 -0.81 0.00 0.00 -1.04 0.00 0.00 55.73 54.04 2akk s ARG 41 Cb -0.22 -2.56 0.00 0.00 -2.04 0.00 0.00 34.95 30.14 2akk s ARG 41 CO -0.03 0.55 0.00 0.41 -0.04 0.00 0.00 175.30 176.19 2akk n GLY 42 N 0.63 0.84 3.93 3.88 0.00 0.64 -4.14 105.19 110.97 2akk n GLY 42 Ca -0.11 -0.43 -0.25 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.60 4.99 0.07 -0.61 -5.25 0.14 -4.30 121.20 113.63 2akk s ILE 43 Ca 0.00 -0.22 -0.02 0.00 -0.99 0.00 0.00 60.65 59.42 2akk s ILE 43 Cb 0.00 -3.85 -0.03 0.00 2.95 0.00 0.00 42.46 41.53 2akk s ILE 43 CO 0.00 -0.66 0.02 0.00 -1.79 0.00 0.00 174.94 172.51 2akk s ARG 44 N -4.49 0.70 0.51 0.37 1.70 0.12 0.37 118.95 118.24 2akk s ARG 44 Ca 0.43 -1.22 -0.17 0.00 -0.47 0.00 0.00 55.73 54.30 2akk s ARG 44 Cb -0.10 0.24 -0.08 0.00 -0.57 0.00 0.00 34.95 34.44 2akk s ARG 44 CO 0.39 -0.16 0.98 -0.51 -1.08 0.00 0.00 175.30 174.93 2akk s LEU 45 N -2.93 3.65 0.00 -1.89 1.43 -1.26 -0.79 118.68 116.88 2akk s LEU 45 Ca 0.10 1.59 0.00 0.00 -1.03 0.00 0.00 54.13 54.78 2akk s LEU 45 Cb 0.07 -4.51 0.00 0.00 0.03 0.00 0.00 46.19 41.78 2akk s LEU 45 CO -0.08 -0.58 0.00 0.35 0.23 0.00 0.00 176.35 176.27 2akk n THR 46 N -1.51 0.00 0.44 5.49 -2.24 -1.25 -4.80 114.28 110.41 2akk n THR 46 Ca 0.07 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.96 2akk n THR 46 Cb 0.54 0.00 0.47 0.00 -2.10 0.00 0.00 70.33 69.24 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 0.62 -4.89 3.42 8.00 -1.26 -4.76 116.55 117.69 2akk n ASP 47 Ca 0.00 0.64 -0.32 0.00 0.71 0.00 0.00 54.79 55.82 2akk n ASP 47 Cb 0.00 -0.78 -0.05 0.00 -0.02 0.00 0.00 41.12 40.28 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 -4.15 6.21 0.09 -2.24 0.01 -1.26 -4.97 113.70 107.38 2akk s SER 48 Ca 0.05 0.25 0.23 0.00 1.31 0.00 0.00 55.95 57.79 2akk s SER 48 Cb 0.10 -1.89 0.06 0.00 0.21 0.00 0.00 66.02 64.50 2akk s SER 48 CO 0.41 0.21 1.04 -0.62 0.41 0.00 0.00 173.24 174.69 2akk n GLU 49 N 0.60 0.40 0.02 12.44 1.02 -1.26 -4.04 120.64 129.81 2akk n GLU 49 Ca -0.08 0.03 0.11 0.00 -0.02 0.00 0.00 57.16 57.20 2akk n GLU 49 Cb 0.52 -1.66 -0.02 0.00 -0.02 0.00 0.00 31.44 30.26 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 -2.19 0.58 -4.26 1.62 9.92 -1.26 -4.29 116.55 116.67 2akk n ASP 50 Ca 0.01 -0.25 -0.24 0.00 -0.53 0.00 0.00 54.79 53.78 2akk n ASP 50 Cb 0.48 0.96 -0.13 0.00 -0.64 0.00 0.00 41.12 41.79 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 -3.22 1.15 0.15 -1.24 8.01 -1.26 -0.15 118.70 122.14 2akk s GLU 51 Ca 0.03 -1.08 0.04 0.00 0.01 0.00 0.00 54.97 53.96 2akk s GLU 51 Cb 0.14 -1.35 -0.04 0.00 -4.31 0.00 0.00 34.13 28.57 2akk s GLU 51 CO 0.82 0.32 -0.08 0.96 0.01 0.00 0.00 175.26 177.29 2akk s ILE 52 N -1.08 1.04 -0.18 -1.63 -5.25 0.75 -3.94 121.20 110.91 2akk s ILE 52 Ca 0.06 -2.03 -0.01 0.00 -0.99 0.00 0.00 60.65 57.67 2akk s ILE 52 Cb -0.10 -1.89 0.00 0.00 2.95 0.00 0.00 42.46 43.42 2akk s ILE 52 CO 0.03 -0.70 -0.13 -0.70 -1.79 0.00 0.00 174.94 171.66 2akk s GLU 53 N -3.79 3.23 0.00 0.37 2.12 0.03 0.18 118.70 120.84 2akk s GLU 53 Ca 0.18 -0.72 0.00 0.00 0.36 0.00 0.00 54.97 54.79 2akk s GLU 53 Cb 0.04 -2.74 0.00 0.00 0.26 0.00 0.00 34.13 31.69 2akk s GLU 53 CO 0.01 -0.09 0.00 0.41 -0.54 0.00 0.00 175.26 175.04 2akk n GLY 54 N 4.40 5.78 3.23 -1.50 0.00 -0.01 0.16 105.19 117.26 2akk n GLY 54 Ca -0.19 -1.52 -0.13 0.00 0.00 0.00 0.00 46.02 44.17 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 1.39 0.62 0.31 1.61 1.70 -1.26 -1.14 118.95 122.18 2akk s ARG 55 Ca 0.00 -0.08 0.01 0.00 -0.47 0.00 0.00 55.73 55.19 2akk s ARG 55 Cb 0.00 0.28 -0.00 0.00 -0.57 0.00 0.00 34.95 34.65 2akk s ARG 55 CO 0.00 -0.16 0.02 0.25 -1.08 0.00 0.00 175.30 174.33 2akk n THR 56 N 1.57 0.00 -0.17 4.99 -2.24 0.16 -3.25 114.28 115.34 2akk n THR 56 Ca -0.20 -1.51 -0.05 0.00 -2.27 0.00 0.00 64.05 60.02 2akk n THR 56 Cb 0.56 0.36 0.13 0.00 -2.10 0.00 0.00 70.33 69.28 2akk n THR 56 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 2akk h ASP 57 N 0.83 0.88 0.00 3.42 1.82 -2.00 -3.35 116.42 118.03 2akk h ASP 57 Ca -0.25 -0.19 -0.35 0.00 -0.39 0.00 0.00 57.03 55.85 2akk h ASP 57 Cb 0.80 -0.23 -0.06 0.00 0.68 0.00 0.00 39.33 40.51 2akk h ASP 57 CO 0.41 0.88 -2.33 1.17 -1.61 0.00 0.00 179.24 177.76 2akk n LYS 58 N -4.24 0.59 -3.86 0.28 4.81 -1.26 -4.88 118.16 109.61 2akk n LYS 58 Ca 0.04 0.13 -0.35 0.00 -0.87 0.00 0.00 58.31 57.26 2akk n LYS 58 Cb 0.27 -1.47 -0.13 0.00 0.02 0.00 0.00 35.03 33.72 2akk n LYS 58 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2akk s ILE 59 N -2.47 3.04 0.05 3.15 -1.09 -1.25 -5.09 121.20 117.53 2akk s ILE 59 Ca -0.31 -1.81 -0.01 0.00 -2.23 0.00 0.00 60.65 56.29 2akk s ILE 59 Cb 0.08 -2.96 -0.04 0.00 -1.58 0.00 0.00 42.46 37.96 2akk s ILE 59 CO 0.54 -0.43 0.20 -1.59 -1.23 0.00 0.00 174.94 172.43 2akk s LYS 60 N 1.16 3.42 -0.74 2.79 0.00 -1.26 0.37 119.74 125.49 2akk s LYS 60 Ca 0.03 -0.42 -0.00 0.00 0.00 0.00 0.00 55.97 55.58 2akk s LYS 60 Cb -0.21 -3.04 -0.00 0.00 0.00 0.00 0.00 37.83 34.57 2akk s LYS 60 CO -0.03 0.62 0.62 0.41 0.00 0.00 0.00 175.35 176.97 2akk n GLY 61 N 0.44 -0.07 3.40 0.59 0.00 -0.29 -4.93 105.19 104.32 2akk n GLY 61 Ca -0.06 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 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 -4.69 2.60 -0.23 0.99 2.34 -0.49 -4.92 118.68 114.28 2akk s LEU 62 Ca 0.02 -0.30 -0.18 0.00 0.06 0.00 0.00 54.13 53.73 2akk s LEU 62 Cb -0.00 -1.54 -0.03 0.00 -0.56 0.00 0.00 46.19 44.06 2akk s LEU 62 CO 0.45 0.26 0.49 -0.69 -1.06 0.00 0.00 176.35 175.80 2akk s VAL 63 N -0.22 5.11 0.04 1.48 1.01 -1.26 -0.83 120.40 125.72 2akk s VAL 63 Ca 0.00 0.86 0.03 0.00 0.00 0.00 0.00 61.98 62.87 2akk s VAL 63 Cb -0.13 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.42 2akk s VAL 63 CO 0.03 0.15 -0.09 -0.76 0.00 0.00 0.00 175.10 174.42 2akk s LEU 64 N 1.90 2.19 0.15 3.92 1.43 0.13 -4.97 118.68 123.43 2akk s LEU 64 Ca 0.21 -0.44 -0.31 0.00 -1.03 0.00 0.00 54.13 52.56 2akk s LEU 64 Cb -0.15 -0.33 -0.09 0.00 0.03 0.00 0.00 46.19 45.65 2akk s LEU 64 CO 0.09 -0.08 1.48 0.00 0.23 0.00 0.00 176.35 178.07 2akk s ARG 65 N -1.20 4.26 -0.12 1.70 1.70 -1.26 -0.18 118.95 123.85 2akk s ARG 65 Ca -0.04 2.24 0.02 0.00 -0.47 0.00 0.00 55.73 57.48 2akk s ARG 65 Cb -0.08 -3.19 0.23 0.00 -0.57 0.00 0.00 34.95 31.34 2akk s ARG 65 CO 0.01 -0.52 1.14 -2.37 -1.08 0.00 0.00 175.30 172.48 2akk n THR 66 N 3.80 1.38 0.13 4.99 5.66 0.79 -3.87 114.28 127.16 2akk n THR 66 Ca 0.12 -0.54 0.07 0.00 -3.05 0.00 0.00 64.05 60.65 2akk n THR 66 Cb 0.40 -0.69 0.04 0.00 -1.55 0.00 0.00 70.33 68.54 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 0.00 -0.08 1.09 5.08 -1.88 -3.09 114.58 116.35 2akk h GLU 67 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2akk h GLU 67 Cb 1.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.61 2akk h GLU 67 CO 0.28 0.20 0.00 1.97 -1.00 0.00 0.00 179.01 180.46 2akk n PHE 68 N -3.00 0.27 -4.66 4.33 1.16 -1.25 -4.41 117.46 109.90 2akk n PHE 68 Ca -0.00 -0.94 -0.31 0.00 -1.87 0.00 0.00 57.45 54.34 2akk n PHE 68 Cb 0.65 -0.19 -0.13 0.00 -1.61 0.00 0.00 39.48 38.21 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 -2.76 2.56 -0.10 5.98 1.43 -1.22 -1.74 118.68 122.83 2akk s LEU 69 Ca 0.34 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.99 2akk s LEU 69 Cb 0.28 -1.49 -0.02 0.00 0.03 0.00 0.00 46.19 45.00 2akk s LEU 69 CO 0.05 0.25 -0.14 -0.75 0.23 0.00 0.00 176.35 175.99 2akk s LYS 70 N -1.48 3.08 0.04 1.70 2.36 0.96 -1.46 119.74 124.95 2akk s LYS 70 Ca 0.14 -0.70 -0.32 0.00 -2.55 0.00 0.00 55.97 52.55 2akk s LYS 70 Cb -0.10 -2.53 -0.11 0.00 -1.05 0.00 0.00 37.83 34.04 2akk s LYS 70 CO 0.05 0.35 1.89 1.17 1.55 0.00 0.00 175.35 180.36 2akk n LYS 71 N 3.12 2.64 -2.45 4.03 4.81 -1.26 0.17 118.16 129.23 2akk n LYS 71 Ca -0.18 0.97 -0.24 0.00 -0.87 0.00 0.00 58.31 57.99 2akk n LYS 71 Cb 0.53 -2.87 0.08 0.00 0.02 0.00 0.00 35.03 32.79 2akk n LYS 71 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2akk s ALA 72 N 3.61 3.51 0.00 3.14 0.00 0.34 -4.65 121.76 127.71 2akk s ALA 72 Ca 0.87 -1.34 0.00 0.00 0.00 0.00 0.00 51.96 51.49 2akk s ALA 72 Cb -0.52 -2.25 0.00 0.00 0.00 0.00 0.00 23.12 20.34 2akk s ALA 72 CO 0.43 -1.26 0.00 0.41 0.00 0.00 0.00 175.76 175.34 2akk n GLY 73 N -2.77 2.25 0.00 0.00 0.00 -1.26 -4.84 105.19 98.57 2akk n GLY 73 Ca 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2akk n GLY 73 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76