#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 6.91 -0.40 7.83 1.04 -1.26 -4.92 113.70 122.90 2akk s SER 2 Ca 0.00 1.05 0.09 0.00 0.48 0.00 0.00 55.95 57.57 2akk s SER 2 Cb 0.00 -2.50 0.27 0.00 0.10 0.00 0.00 66.02 63.88 2akk s SER 2 CO 0.00 -0.74 0.58 2.30 0.98 0.00 0.00 173.24 176.36 2akk n ILE 3 N 5.60 -0.40 -2.60 -1.02 -5.35 -1.26 -4.98 119.36 109.36 2akk n ILE 3 Ca 0.10 -4.20 -0.41 0.00 -0.27 0.00 0.00 62.75 57.96 2akk n ILE 3 Cb 0.47 -1.65 -0.03 0.00 -1.74 0.00 0.00 39.64 36.69 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 -1.51 3.48 -0.09 6.28 2.02 -1.26 -4.82 118.70 122.80 2akk s GLU 4 Ca 0.36 -0.95 -0.22 0.00 0.02 0.00 0.00 54.97 54.17 2akk s GLU 4 Cb 0.20 -5.01 -0.03 0.00 0.10 0.00 0.00 34.13 29.39 2akk s GLU 4 CO -0.10 -2.15 0.66 0.08 0.02 0.00 0.00 175.26 173.78 2akk s VAL 5 N 4.94 5.06 0.13 2.63 1.01 -1.26 -4.85 120.40 128.06 2akk s VAL 5 Ca 0.42 1.35 0.04 0.00 0.00 0.00 0.00 61.98 63.78 2akk s VAL 5 Cb -0.03 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 2akk s VAL 5 CO -0.03 0.24 -0.10 -0.13 0.00 0.00 0.00 175.10 175.07 2akk s ARG 6 N 0.97 0.99 0.19 2.72 3.00 -1.26 -0.09 118.95 125.46 2akk s ARG 6 Ca 0.35 -1.37 -0.03 0.00 0.00 0.00 0.00 55.73 54.67 2akk s ARG 6 Cb -0.17 -0.57 0.04 0.00 0.00 0.00 0.00 34.95 34.26 2akk s ARG 6 CO 0.16 0.07 0.24 -0.40 0.00 0.00 0.00 175.30 175.36 2akk n ASP 7 N -0.01 -0.16 0.19 0.23 5.75 -0.15 -4.76 116.55 117.64 2akk n ASP 7 Ca -0.12 -1.02 0.12 0.00 -0.01 0.00 0.00 54.79 53.76 2akk n ASP 7 Cb 0.60 -0.19 0.67 0.00 -1.03 0.00 0.00 41.12 41.17 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 0.49 0.00 0.00 -0.26 -1.92 -3.49 115.58 110.41 2akk h ASN 9 Ca 0.07 -0.90 0.00 0.00 -0.56 0.00 0.00 56.30 54.91 2akk h ASN 9 Cb 0.28 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 37.38 2akk h ASN 9 CO -0.00 1.61 0.00 0.61 -1.06 0.00 0.00 177.43 178.59 2akk n GLY 10 N 1.75 0.75 3.69 2.83 0.00 -0.84 -5.12 105.19 108.24 2akk n GLY 10 Ca -0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.98 3.36 0.19 4.61 0.00 -1.26 -4.66 121.76 123.01 2akk s ALA 11 Ca 0.00 0.40 -0.31 0.00 0.00 0.00 0.00 51.96 52.05 2akk s ALA 11 Cb 0.00 -3.42 -0.10 0.00 0.00 0.00 0.00 23.12 19.60 2akk s ALA 11 CO 0.00 -0.54 1.52 -0.51 0.00 0.00 0.00 175.76 176.23 2akk s LEU 12 N 1.83 4.37 0.34 0.00 1.43 -1.26 -0.97 118.68 124.42 2akk s LEU 12 Ca 0.49 2.61 0.05 0.00 -1.03 0.00 0.00 54.13 56.25 2akk s LEU 12 Cb -0.19 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.42 2akk s LEU 12 CO 0.20 -0.78 0.49 -0.76 0.23 0.00 0.00 176.35 175.73 2akk s LEU 13 N 0.66 3.97 0.37 1.79 1.43 0.86 -4.93 118.68 122.83 2akk s LEU 13 Ca 0.66 -0.04 -0.11 0.00 -1.03 0.00 0.00 54.13 53.61 2akk s LEU 13 Cb -0.43 -2.86 0.04 0.00 0.03 0.00 0.00 46.19 42.97 2akk s LEU 13 CO 0.35 -0.42 0.68 0.00 0.23 0.00 0.00 176.35 177.19 2akk s ALA 14 N -2.22 -0.22 -0.17 4.21 0.00 -1.26 -4.70 121.76 117.40 2akk s ALA 14 Ca 0.44 -1.01 -0.29 0.00 0.00 0.00 0.00 51.96 51.09 2akk s ALA 14 Cb -0.10 0.85 -0.04 0.00 0.00 0.00 0.00 23.12 23.83 2akk s ALA 14 CO 0.32 -0.92 1.74 0.34 0.00 0.00 0.00 175.76 177.24 2akk s ASP 15 N -3.13 6.29 0.00 0.00 2.15 -1.26 -2.28 116.67 118.44 2akk s ASP 15 Ca 0.21 1.84 0.00 0.00 0.43 0.00 0.00 52.55 55.03 2akk s ASP 15 Cb -0.03 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.06 2akk s ASP 15 CO 0.14 -1.30 0.00 0.61 -0.17 0.00 0.00 175.17 174.46 2akk n GLY 16 N 4.74 1.13 3.98 2.66 0.00 0.10 -4.98 105.19 112.82 2akk n GLY 16 Ca 0.20 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 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 4.73 -0.02 1.61 -1.08 -0.97 -4.70 116.67 114.25 2akk s ASP 17 Ca 0.00 -0.15 0.02 0.00 -0.52 0.00 0.00 52.55 51.90 2akk s ASP 17 Cb 0.00 -0.44 0.00 0.00 -1.46 0.00 0.00 42.92 41.02 2akk s ASP 17 CO 0.00 -1.58 -0.07 0.54 0.52 0.00 0.00 175.17 174.59 2akk s ASN 18 N -4.60 0.89 0.42 -0.34 4.22 -1.26 0.01 114.94 114.28 2akk s ASN 18 Ca 0.62 -0.13 0.03 0.00 -2.14 0.00 0.00 52.86 51.24 2akk s ASN 18 Cb -0.08 -0.20 -0.03 0.00 1.28 0.00 0.00 41.25 42.22 2akk s ASN 18 CO 0.42 0.05 0.08 0.68 -2.04 0.00 0.00 177.10 176.29 2akk s VAL 19 N 0.12 0.95 0.07 3.54 -7.23 0.32 -0.25 120.40 117.93 2akk s VAL 19 Ca -0.01 -2.00 -0.17 0.00 -1.81 0.00 0.00 61.98 57.98 2akk s VAL 19 Cb -0.06 -2.43 0.04 0.00 0.56 0.00 0.00 36.38 34.48 2akk s VAL 19 CO -0.00 0.00 0.40 -0.44 -0.31 0.00 0.00 175.10 174.75 2akk s SER 20 N -3.66 -0.26 0.09 4.85 0.01 0.66 0.13 113.70 115.53 2akk s SER 20 Ca 0.22 -0.12 -0.31 0.00 1.31 0.00 0.00 55.95 57.05 2akk s SER 20 Cb 0.04 0.44 -0.08 0.00 0.21 0.00 0.00 66.02 66.63 2akk s SER 20 CO 0.12 -0.73 1.51 -0.76 0.41 0.00 0.00 173.24 173.79 2akk s LEU 21 N -2.30 4.36 0.00 2.44 2.01 0.60 -0.06 118.68 125.73 2akk s LEU 21 Ca -0.02 2.40 0.24 0.00 0.01 0.00 0.00 54.13 56.76 2akk s LEU 21 Cb 0.00 -3.58 0.29 0.00 0.01 0.00 0.00 46.19 42.92 2akk s LEU 21 CO -0.06 -0.78 1.26 2.30 1.01 0.00 0.00 176.35 180.09 2akk n ILE 22 N 4.33 0.00 -4.05 -0.59 -5.35 -0.88 -1.50 119.36 111.32 2akk n ILE 22 Ca 0.14 -0.00 -0.08 0.00 -0.27 0.00 0.00 62.75 62.54 2akk n ILE 22 Cb 0.41 0.47 -0.03 0.00 -1.74 0.00 0.00 39.64 38.75 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 -1.50 0.19 -3.28 6.28 5.02 -1.26 -4.89 118.16 118.72 2akk n LYS 23 Ca 0.05 -1.33 -0.46 0.00 -2.02 0.00 0.00 58.31 54.55 2akk n LYS 23 Cb 0.33 1.13 -0.03 0.00 -0.02 0.00 0.00 35.03 36.44 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 -1.95 6.51 -0.37 4.39 1.01 -1.26 -2.05 116.67 122.95 2akk s ASP 24 Ca 0.16 -2.24 -0.12 0.00 0.71 0.00 0.00 52.55 51.06 2akk s ASP 24 Cb 0.01 -2.23 0.02 0.00 1.01 0.00 0.00 42.92 41.72 2akk s ASP 24 CO 0.11 -0.75 0.23 -0.76 0.21 0.00 0.00 175.17 174.21 2akk s LEU 25 N 1.02 4.73 0.01 1.23 2.01 0.13 -4.88 118.68 122.93 2akk s LEU 25 Ca 0.13 -0.88 -0.21 0.00 0.01 0.00 0.00 54.13 53.18 2akk s LEU 25 Cb -0.18 -2.06 -0.05 0.00 0.01 0.00 0.00 46.19 43.91 2akk s LEU 25 CO -0.04 -0.37 0.63 -0.75 1.01 0.00 0.00 176.35 176.83 2akk s LYS 26 N 1.60 4.35 -0.05 1.70 2.36 -1.26 -0.31 119.74 128.14 2akk s LYS 26 Ca 0.03 0.80 -0.02 0.00 -2.55 0.00 0.00 55.97 54.23 2akk s LYS 26 Cb -0.19 -3.35 -0.04 0.00 -1.05 0.00 0.00 37.83 33.21 2akk s LYS 26 CO 0.08 0.35 0.08 -0.51 1.55 0.00 0.00 175.35 176.90 2akk s LEU 27 N -0.17 3.96 0.22 5.43 1.43 0.30 -4.92 118.68 124.93 2akk s LEU 27 Ca 0.33 0.23 0.03 0.00 -1.03 0.00 0.00 54.13 53.69 2akk s LEU 27 Cb -0.19 -2.15 0.18 0.00 0.03 0.00 0.00 46.19 44.06 2akk s LEU 27 CO 0.18 0.33 1.51 0.50 0.23 0.00 0.00 176.35 179.10 2akk h LYS 28 N 4.51 0.25 -6.23 1.70 3.64 -1.93 -1.94 116.57 116.56 2akk h LYS 28 Ca -0.51 -0.19 -0.57 0.00 -1.27 0.00 0.00 60.65 58.12 2akk h LYS 28 Cb 1.20 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.04 2akk h LYS 28 CO 0.60 0.82 1.24 0.20 -2.27 0.00 0.00 179.45 180.04 2akk s GLY 29 N -4.36 1.06 -0.62 5.01 0.00 -1.26 -2.05 107.32 105.10 2akk s GLY 29 Ca -0.04 0.64 0.00 0.00 0.00 0.00 0.00 44.72 45.32 2akk s GLY 29 CO 0.81 3.27 0.00 -1.26 0.00 0.00 0.00 173.10 175.92 2akk n SER 30 N 9.20 -5.00 -3.26 1.64 2.88 -1.26 -2.40 113.62 115.42 2akk n SER 30 Ca 0.22 0.14 -0.23 0.00 -1.33 0.00 0.00 58.87 57.67 2akk n SER 30 Cb 0.45 -3.01 0.02 0.00 -0.75 0.00 0.00 64.21 60.91 2akk n SER 30 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2akk n SER 31 N -0.59 -5.00 -4.57 -3.46 7.64 -0.87 -4.86 113.62 101.91 2akk n SER 31 Ca -0.06 -0.38 -0.40 0.00 1.01 0.00 0.00 58.87 59.04 2akk n SER 31 Cb 0.41 -4.06 -0.03 0.00 -1.01 0.00 0.00 64.21 59.51 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 -3.09 3.49 -0.57 0.44 2.01 -0.73 -4.77 115.64 112.42 2akk s THR 32 Ca 0.38 0.38 -0.21 0.00 0.31 0.00 0.00 61.69 62.56 2akk s THR 32 Cb -0.19 -4.00 0.07 0.00 0.01 0.00 0.00 72.50 68.39 2akk s THR 32 CO 0.47 -0.86 0.78 -0.69 -0.69 0.00 0.00 174.62 173.63 2akk s VAL 33 N 7.81 4.65 -0.92 3.82 1.01 -1.26 0.11 120.40 135.63 2akk s VAL 33 Ca 0.66 -0.47 -0.21 0.00 0.00 0.00 0.00 61.98 61.96 2akk s VAL 33 Cb -0.14 -4.48 0.09 0.00 0.00 0.00 0.00 36.38 31.84 2akk s VAL 33 CO 0.25 -1.10 1.24 -0.76 0.00 0.00 0.00 175.10 174.73 2akk s LEU 34 N 3.20 4.25 0.82 3.92 1.43 0.58 -4.91 118.68 127.98 2akk s LEU 34 Ca 0.18 -1.57 -0.11 0.00 -1.03 0.00 0.00 54.13 51.60 2akk s LEU 34 Cb -0.19 -2.48 0.09 0.00 0.03 0.00 0.00 46.19 43.64 2akk s LEU 34 CO 0.11 -1.34 1.13 -0.54 0.23 0.00 0.00 176.35 175.95 2akk s LYS 35 N 3.94 1.72 0.21 1.70 -0.14 -1.26 0.18 119.74 126.09 2akk s LYS 35 Ca 0.37 1.43 -0.32 0.00 -1.36 0.00 0.00 55.97 56.08 2akk s LYS 35 Cb -0.05 -1.82 -0.12 0.00 -1.68 0.00 0.00 37.83 34.17 2akk s LYS 35 CO -0.05 -2.08 1.73 -2.13 -0.76 0.00 0.00 175.35 172.05 2akk n ARG 36 N -3.67 2.78 0.00 1.68 0.63 -0.87 -1.93 116.66 115.28 2akk n ARG 36 Ca 0.11 1.00 0.00 0.00 -0.92 0.00 0.00 57.85 58.04 2akk n ARG 36 Cb 0.52 -2.85 0.00 0.00 0.45 0.00 0.00 32.46 30.58 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 3.98 0.28 3.61 5.14 0.00 -0.56 -4.98 105.19 112.66 2akk n GLY 37 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.80 0.43 -3.07 2.61 -1.04 -0.81 -4.70 114.28 105.90 2akk n THR 38 Ca 0.00 -0.40 -0.41 0.00 -2.04 0.00 0.00 64.05 61.20 2akk n THR 38 Cb 0.00 -2.52 -0.06 0.00 -1.82 0.00 0.00 70.33 65.92 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 5.99 3.94 -0.66 -2.82 1.75 -1.26 -0.29 119.30 125.94 2akk s MET 39 Ca 0.98 0.40 -0.09 0.00 -1.25 0.00 0.00 55.69 55.74 2akk s MET 39 Cb -0.35 -3.72 0.17 0.00 2.84 0.00 0.00 34.83 33.77 2akk s MET 39 CO 0.37 -0.58 0.54 0.42 -0.65 0.00 0.00 175.02 175.11 2akk s ILE 40 N 2.69 4.56 -0.10 10.11 1.01 0.12 -4.78 121.20 134.81 2akk s ILE 40 Ca 0.27 -2.47 -0.04 0.00 0.00 0.00 0.00 60.65 58.41 2akk s ILE 40 Cb -0.15 -3.91 -0.04 0.00 0.01 0.00 0.00 42.46 38.37 2akk s ILE 40 CO 0.12 -0.91 0.07 0.00 0.00 0.00 0.00 174.94 174.21 2akk s ARG 41 N 0.40 3.19 0.00 2.79 1.04 -1.22 -0.52 118.95 124.62 2akk s ARG 41 Ca 0.14 -0.29 0.00 0.00 -1.04 0.00 0.00 55.73 54.54 2akk s ARG 41 Cb -0.18 -2.97 0.00 0.00 -2.04 0.00 0.00 34.95 29.76 2akk s ARG 41 CO -0.05 0.73 0.00 0.41 -0.04 0.00 0.00 175.30 176.36 2akk n GLY 42 N 2.02 0.50 3.98 3.88 0.00 0.08 -4.45 105.19 111.20 2akk n GLY 42 Ca -0.19 -0.16 -0.20 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.69 2.77 0.06 -0.61 -5.25 0.10 -4.16 121.20 112.42 2akk s ILE 43 Ca 0.00 -0.73 -0.11 0.00 -0.99 0.00 0.00 60.65 58.81 2akk s ILE 43 Cb 0.00 -3.01 0.01 0.00 2.95 0.00 0.00 42.46 42.41 2akk s ILE 43 CO 0.00 -0.01 0.25 0.00 -1.79 0.00 0.00 174.94 173.39 2akk s ARG 44 N -4.67 0.80 0.16 0.37 1.70 0.11 0.02 118.95 117.44 2akk s ARG 44 Ca 0.57 -0.65 -0.30 0.00 -0.47 0.00 0.00 55.73 54.88 2akk s ARG 44 Cb -0.10 0.34 -0.07 0.00 -0.57 0.00 0.00 34.95 34.54 2akk s ARG 44 CO 0.37 -0.25 1.06 -0.51 -1.08 0.00 0.00 175.30 174.89 2akk s LEU 45 N -2.28 4.49 0.00 -1.89 1.43 -1.26 -1.66 118.68 117.51 2akk s LEU 45 Ca -0.02 2.00 0.00 0.00 -1.03 0.00 0.00 54.13 55.08 2akk s LEU 45 Cb 0.00 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.63 2akk s LEU 45 CO -0.06 -0.18 0.00 0.35 0.23 0.00 0.00 176.35 176.70 2akk n THR 46 N 2.51 0.00 0.00 5.49 -2.24 -1.26 -4.89 114.28 113.89 2akk n THR 46 Ca 0.03 0.45 0.00 0.00 -2.27 0.00 0.00 64.05 62.26 2akk n THR 46 Cb 0.47 -1.39 0.00 0.00 -2.10 0.00 0.00 70.33 67.31 2akk n THR 46 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2akk n ASP 47 N -2.06 0.00 -4.78 3.42 2.03 -1.26 -5.11 116.55 108.79 2akk n ASP 47 Ca 0.00 0.00 -0.37 0.00 0.52 0.00 0.00 54.79 54.94 2akk n ASP 47 Cb 0.00 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.37 2akk n ASP 47 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2akk s SER 48 N 0.00 6.65 0.18 1.67 0.01 -1.26 -4.94 113.70 116.01 2akk s SER 48 Ca 0.00 2.14 0.23 0.00 1.31 0.00 0.00 55.95 59.63 2akk s SER 48 Cb 0.00 -2.59 0.12 0.00 0.21 0.00 0.00 66.02 63.75 2akk s SER 48 CO 0.00 -0.57 1.15 -0.33 0.41 0.00 0.00 173.24 173.89 2akk h GLU 49 N 2.50 0.00 0.00 12.44 5.08 -1.89 -3.34 114.58 129.38 2akk h GLU 49 Ca -0.48 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.87 2akk h GLU 49 Cb 1.22 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.47 2akk h GLU 49 CO 0.62 0.00 -1.06 -0.25 -1.00 0.00 0.00 179.01 177.32 2akk n ASP 50 N -2.49 0.82 -4.28 1.42 8.00 -1.26 -4.12 116.55 114.63 2akk n ASP 50 Ca 0.01 0.32 -0.20 0.00 0.71 0.00 0.00 54.79 55.63 2akk n ASP 50 Cb 0.51 0.49 -0.11 0.00 -0.02 0.00 0.00 41.12 41.99 2akk n ASP 50 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2akk s GLU 51 N -3.35 1.14 0.35 -1.24 8.01 -1.25 -1.19 118.70 121.16 2akk s GLU 51 Ca -0.01 -1.30 0.04 0.00 0.01 0.00 0.00 54.97 53.71 2akk s GLU 51 Cb 0.10 -1.12 -0.03 0.00 -4.31 0.00 0.00 34.13 28.77 2akk s GLU 51 CO 0.80 0.22 0.17 0.96 0.01 0.00 0.00 175.26 177.42 2akk s ILE 52 N -2.03 0.38 -0.01 -1.63 -4.36 0.23 -4.33 121.20 109.43 2akk s ILE 52 Ca 0.12 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 58.56 2akk s ILE 52 Cb -0.06 -2.45 -0.01 0.00 1.25 0.00 0.00 42.46 41.19 2akk s ILE 52 CO 0.05 0.00 -0.19 -0.70 0.24 0.00 0.00 174.94 174.34 2akk s GLU 53 N -3.70 1.54 0.00 0.37 2.12 -0.66 0.32 118.70 118.69 2akk s GLU 53 Ca 0.32 -0.68 0.00 0.00 0.36 0.00 0.00 54.97 54.97 2akk s GLU 53 Cb 0.04 -1.49 0.00 0.00 0.26 0.00 0.00 34.13 32.94 2akk s GLU 53 CO 0.18 0.41 0.00 0.41 -0.54 0.00 0.00 175.26 175.72 2akk n GLY 54 N 2.61 3.86 3.14 -1.50 0.00 -0.09 0.06 105.19 113.27 2akk n GLY 54 Ca -0.15 -1.39 -0.13 0.00 0.00 0.00 0.00 46.02 44.36 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 -0.90 0.30 0.26 1.61 1.70 -1.26 -0.99 118.95 119.67 2akk s ARG 55 Ca 0.00 0.38 0.03 0.00 -0.47 0.00 0.00 55.73 55.67 2akk s ARG 55 Cb 0.00 0.13 -0.01 0.00 -0.57 0.00 0.00 34.95 34.50 2akk s ARG 55 CO 0.00 -0.05 0.10 -2.37 -1.08 0.00 0.00 175.30 171.90 2akk n THR 56 N 3.05 0.00 0.04 4.99 5.66 0.11 -3.42 114.28 124.71 2akk n THR 56 Ca -0.14 -1.54 -0.03 0.00 -3.05 0.00 0.00 64.05 59.30 2akk n THR 56 Cb 0.58 0.57 0.22 0.00 -1.55 0.00 0.00 70.33 70.14 2akk n THR 56 CO 0.00 0.00 0.00 0.44 -3.05 0.00 0.00 175.07 172.46 2akk h ASP 57 N 1.07 0.42 0.00 1.09 3.32 -1.99 -3.21 116.42 117.11 2akk h ASP 57 Ca -0.20 -0.14 -0.08 0.00 0.02 0.00 0.00 57.03 56.62 2akk h ASP 57 Cb 0.78 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 2akk h ASP 57 CO 0.32 0.69 -0.44 0.50 -1.72 0.00 0.00 179.24 178.58 2akk h LYS 58 N 0.37 0.00 -4.41 3.56 3.64 -2.00 -3.47 116.57 114.26 2akk h LYS 58 Ca 0.05 0.00 -0.49 0.00 -1.27 0.00 0.00 60.65 58.94 2akk h LYS 58 Cb 0.68 0.00 -0.34 0.00 -0.41 0.00 0.00 32.23 32.16 2akk h LYS 58 CO 0.05 0.96 -0.80 0.42 -2.27 0.00 0.00 179.45 177.81 2akk s ILE 59 N -2.25 1.00 0.03 2.00 1.01 -1.21 -5.13 121.20 116.64 2akk s ILE 59 Ca -0.22 -0.39 0.03 0.00 0.00 0.00 0.00 60.65 60.08 2akk s ILE 59 Cb 0.00 -0.94 -0.04 0.00 0.01 0.00 0.00 42.46 41.50 2akk s ILE 59 CO 0.63 0.33 -0.03 -1.59 0.00 0.00 0.00 174.94 174.28 2akk s LYS 60 N 0.80 2.58 -0.51 2.79 -2.85 -1.26 0.04 119.74 121.34 2akk s LYS 60 Ca -0.12 -0.75 -0.01 0.00 -1.00 0.00 0.00 55.97 54.10 2akk s LYS 60 Cb -0.15 -2.54 0.00 0.00 -2.06 0.00 0.00 37.83 33.08 2akk s LYS 60 CO 0.02 0.59 0.43 0.41 0.10 0.00 0.00 175.35 176.89 2akk n GLY 61 N 1.19 0.15 3.43 0.59 0.00 -0.18 -4.95 105.19 105.41 2akk n GLY 61 Ca -0.14 -0.25 -0.33 0.00 0.00 0.00 0.00 46.02 45.31 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 -3.78 2.70 -0.21 0.99 2.34 -0.16 -4.91 118.68 115.65 2akk s LEU 62 Ca 0.04 -0.26 -0.17 0.00 0.06 0.00 0.00 54.13 53.80 2akk s LEU 62 Cb -0.02 -1.57 -0.03 0.00 -0.56 0.00 0.00 46.19 44.01 2akk s LEU 62 CO 0.30 0.27 0.47 -0.69 -1.06 0.00 0.00 176.35 175.65 2akk s VAL 63 N -0.30 5.13 0.01 1.48 1.01 -1.26 -0.92 120.40 125.56 2akk s VAL 63 Ca 0.02 0.85 0.02 0.00 0.00 0.00 0.00 61.98 62.87 2akk s VAL 63 Cb -0.13 -3.80 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 2akk s VAL 63 CO 0.03 0.19 -0.07 -0.76 0.00 0.00 0.00 175.10 174.49 2akk s LEU 64 N 1.63 2.09 0.28 3.92 1.43 0.15 -4.96 118.68 123.23 2akk s LEU 64 Ca 0.22 -0.25 -0.30 0.00 -1.03 0.00 0.00 54.13 52.77 2akk s LEU 64 Cb -0.15 -0.27 -0.12 0.00 0.03 0.00 0.00 46.19 45.68 2akk s LEU 64 CO 0.09 -0.01 1.63 0.00 0.23 0.00 0.00 176.35 178.29 2akk s ARG 65 N -0.60 4.11 -0.15 1.70 1.70 -1.26 -0.60 118.95 123.85 2akk s ARG 65 Ca -0.01 2.61 0.03 0.00 -0.47 0.00 0.00 55.73 57.89 2akk s ARG 65 Cb -0.05 -3.02 0.29 0.00 -0.57 0.00 0.00 34.95 31.60 2akk s ARG 65 CO 0.00 -0.67 1.23 -2.37 -1.08 0.00 0.00 175.30 172.41 2akk n THR 66 N 2.46 1.59 0.03 4.99 5.66 -0.34 -3.96 114.28 124.72 2akk n THR 66 Ca 0.10 -0.69 -0.09 0.00 -3.05 0.00 0.00 64.05 60.31 2akk n THR 66 Cb 0.37 -0.65 -0.13 0.00 -1.55 0.00 0.00 70.33 68.37 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 0.86 0.04 -0.17 1.09 5.08 -1.86 -3.31 114.58 116.31 2akk h GLU 67 Ca 0.16 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2akk h GLU 67 Cb 1.50 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.78 2akk h GLU 67 CO 0.35 0.83 0.00 1.97 -1.00 0.00 0.00 179.01 181.16 2akk n PHE 68 N -3.25 0.61 -4.54 4.33 -1.74 -1.25 -4.50 117.46 107.11 2akk n PHE 68 Ca -0.09 -0.91 -0.31 0.00 -0.56 0.00 0.00 57.45 55.58 2akk n PHE 68 Cb 1.00 -0.25 -0.12 0.00 1.52 0.00 0.00 39.48 41.63 2akk n PHE 68 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 2akk s LEU 69 N -2.80 2.83 -0.17 5.98 1.43 -1.25 -2.08 118.68 122.63 2akk s LEU 69 Ca 0.38 -0.34 -0.02 0.00 -1.03 0.00 0.00 54.13 53.12 2akk s LEU 69 Cb 0.31 -1.65 -0.01 0.00 0.03 0.00 0.00 46.19 44.88 2akk s LEU 69 CO 0.07 0.25 -0.10 -0.75 0.23 0.00 0.00 176.35 176.06 2akk s LYS 70 N -1.53 3.39 0.01 1.70 2.36 0.91 -0.56 119.74 126.01 2akk s LYS 70 Ca 0.16 -0.66 -0.30 0.00 -2.55 0.00 0.00 55.97 52.62 2akk s LYS 70 Cb -0.11 -2.78 -0.07 0.00 -1.05 0.00 0.00 37.83 33.82 2akk s LYS 70 CO 0.07 0.05 1.72 0.21 1.55 0.00 0.00 175.35 178.95 2akk s LYS 71 N 0.79 4.18 0.10 4.03 2.36 -1.26 -0.24 119.74 129.69 2akk s LYS 71 Ca -0.04 2.33 -0.22 0.00 -2.55 0.00 0.00 55.97 55.49 2akk s LYS 71 Cb -0.15 -3.87 -0.07 0.00 -1.05 0.00 0.00 37.83 32.69 2akk s LYS 71 CO 0.01 -0.83 0.67 0.00 1.55 0.00 0.00 175.35 176.76 2akk s ALA 72 N 3.59 3.51 0.00 3.13 0.00 0.66 -4.91 121.76 127.73 2akk s ALA 72 Ca 0.77 0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.91 2akk s ALA 72 Cb -0.38 -2.80 0.00 0.00 0.00 0.00 0.00 23.12 19.94 2akk s ALA 72 CO 0.33 0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.81 2akk n GLY 73 N 1.78 -3.07 0.00 0.00 0.00 -1.26 -4.74 105.19 97.90 2akk n GLY 73 Ca -0.08 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.02 2akk n GLY 73 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76