#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 6.37 -0.51 7.83 0.01 -1.26 -4.98 113.70 121.16 2akk s SER 2 Ca 0.00 0.44 0.07 0.00 1.31 0.00 0.00 55.95 57.77 2akk s SER 2 Cb 0.00 -2.26 0.30 0.00 0.21 0.00 0.00 66.02 64.28 2akk s SER 2 CO 0.00 -0.25 0.77 2.30 0.41 0.00 0.00 173.24 176.47 2akk n ILE 3 N 5.14 1.49 -1.97 1.44 -5.35 -1.26 -5.06 119.36 113.78 2akk n ILE 3 Ca -0.06 -4.99 -0.42 0.00 -0.27 0.00 0.00 62.75 57.02 2akk n ILE 3 Cb 0.50 -1.42 -0.03 0.00 -1.74 0.00 0.00 39.64 36.95 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 -2.57 3.15 -0.30 6.28 2.02 -1.26 -4.76 118.70 121.26 2akk s GLU 4 Ca 0.42 1.31 -0.20 0.00 0.02 0.00 0.00 54.97 56.51 2akk s GLU 4 Cb 0.24 -4.25 -0.01 0.00 0.10 0.00 0.00 34.13 30.21 2akk s GLU 4 CO -0.09 -2.09 0.63 0.08 0.02 0.00 0.00 175.26 173.82 2akk s VAL 5 N 7.57 4.94 0.07 2.63 1.01 -1.26 -4.86 120.40 130.51 2akk s VAL 5 Ca 0.79 0.90 0.06 0.00 0.00 0.00 0.00 61.98 63.74 2akk s VAL 5 Cb -0.21 -3.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 2akk s VAL 5 CO 0.31 -0.11 -0.17 -0.13 0.00 0.00 0.00 175.10 175.00 2akk s ARG 6 N 2.59 1.00 0.00 2.72 0.52 -1.25 -0.72 118.95 123.80 2akk s ARG 6 Ca 0.25 -0.98 0.00 0.00 -0.52 0.00 0.00 55.73 54.49 2akk s ARG 6 Cb -0.15 -1.09 0.00 0.00 0.52 0.00 0.00 34.95 34.23 2akk s ARG 6 CO 0.11 0.26 0.00 -0.40 0.02 0.00 0.00 175.30 175.29 2akk n ASP 7 N 1.41 0.00 0.28 0.23 5.75 -0.68 -4.77 116.55 118.77 2akk n ASP 7 Ca -0.20 -0.98 0.16 0.00 -0.01 0.00 0.00 54.79 53.76 2akk n ASP 7 Cb 0.54 0.00 0.82 0.00 -1.03 0.00 0.00 41.12 41.45 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 0.16 0.00 0.00 -1.24 -1.90 -3.47 115.58 109.13 2akk h ASN 9 Ca -0.00 -0.13 0.00 0.00 0.71 0.00 0.00 56.30 56.88 2akk h ASN 9 Cb 0.31 -0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.31 2akk h ASN 9 CO 0.01 0.94 0.00 0.61 -1.29 0.00 0.00 177.43 177.70 2akk n GLY 10 N 0.85 1.10 3.80 1.57 0.00 -0.29 -5.09 105.19 107.14 2akk n GLY 10 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.00 3.61 0.32 4.61 0.00 -1.26 -4.73 121.76 122.30 2akk s ALA 11 Ca 0.00 -0.10 -0.28 0.00 0.00 0.00 0.00 51.96 51.58 2akk s ALA 11 Cb 0.00 -2.55 -0.10 0.00 0.00 0.00 0.00 23.12 20.48 2akk s ALA 11 CO 0.00 0.35 1.17 -0.51 0.00 0.00 0.00 175.76 176.77 2akk s LEU 12 N -0.74 4.43 0.52 0.00 1.43 -1.26 -1.69 118.68 121.38 2akk s LEU 12 Ca 0.27 2.39 0.06 0.00 -1.03 0.00 0.00 54.13 55.82 2akk s LEU 12 Cb -0.18 -3.73 0.03 0.00 0.03 0.00 0.00 46.19 42.35 2akk s LEU 12 CO 0.15 -0.36 0.43 -0.76 0.23 0.00 0.00 176.35 176.04 2akk s LEU 13 N -1.79 2.87 0.19 1.79 1.43 0.10 -4.95 118.68 118.32 2akk s LEU 13 Ca 0.49 -1.12 -0.23 0.00 -1.03 0.00 0.00 54.13 52.23 2akk s LEU 13 Cb -0.33 -1.38 0.06 0.00 0.03 0.00 0.00 46.19 44.57 2akk s LEU 13 CO 0.43 -1.03 0.96 0.00 0.23 0.00 0.00 176.35 176.94 2akk s ALA 14 N -2.71 -1.54 -0.01 4.21 0.00 -1.26 -4.81 121.76 115.64 2akk s ALA 14 Ca 0.39 -0.09 -0.30 0.00 0.00 0.00 0.00 51.96 51.97 2akk s ALA 14 Cb -0.02 0.68 -0.07 0.00 0.00 0.00 0.00 23.12 23.71 2akk s ALA 14 CO 0.24 -1.05 1.70 0.34 0.00 0.00 0.00 175.76 177.00 2akk s ASP 15 N -3.07 6.62 0.00 0.00 2.15 -1.26 -2.03 116.67 119.07 2akk s ASP 15 Ca 0.15 2.37 0.00 0.00 0.43 0.00 0.00 52.55 55.50 2akk s ASP 15 Cb -0.02 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.06 2akk s ASP 15 CO 0.04 -0.93 0.00 0.61 -0.17 0.00 0.00 175.17 174.72 2akk n GLY 16 N 4.16 0.95 3.96 2.66 0.00 0.12 -4.97 105.19 112.07 2akk n GLY 16 Ca 0.17 -0.01 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.01 4.33 -0.01 1.61 -1.08 -0.86 -4.59 116.67 114.06 2akk s ASP 17 Ca 0.00 0.02 0.00 0.00 -0.52 0.00 0.00 52.55 52.06 2akk s ASP 17 Cb 0.00 -0.47 0.01 0.00 -1.46 0.00 0.00 42.92 41.00 2akk s ASP 17 CO 0.00 -1.88 -0.00 0.54 0.52 0.00 0.00 175.17 174.35 2akk s ASN 18 N -4.67 0.16 0.41 -0.34 2.20 -1.26 -0.17 114.94 111.26 2akk s ASN 18 Ca 0.65 -0.01 0.03 0.00 -0.94 0.00 0.00 52.86 52.60 2akk s ASN 18 Cb -0.07 -0.06 -0.03 0.00 -2.00 0.00 0.00 41.25 39.09 2akk s ASN 18 CO 0.45 -0.04 0.10 0.68 -2.94 0.00 0.00 177.10 175.36 2akk s VAL 19 N 0.39 0.75 -0.03 3.54 -7.23 0.36 -0.26 120.40 117.92 2akk s VAL 19 Ca -0.03 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 57.97 2akk s VAL 19 Cb -0.05 -2.40 0.03 0.00 0.56 0.00 0.00 36.38 34.52 2akk s VAL 19 CO -0.01 0.00 0.35 -0.44 -0.31 0.00 0.00 175.10 174.69 2akk s SER 20 N -3.62 -0.25 0.26 4.85 0.01 0.13 -0.35 113.70 114.73 2akk s SER 20 Ca 0.24 0.20 -0.31 0.00 1.31 0.00 0.00 55.95 57.39 2akk s SER 20 Cb 0.03 0.37 -0.11 0.00 0.21 0.00 0.00 66.02 66.52 2akk s SER 20 CO 0.13 -0.44 1.61 -0.76 0.41 0.00 0.00 173.24 174.20 2akk s LEU 21 N -1.20 4.36 0.01 2.44 2.01 0.87 0.31 118.68 127.49 2akk s LEU 21 Ca -0.12 2.88 0.23 0.00 0.01 0.00 0.00 54.13 57.12 2akk s LEU 21 Cb -0.05 -3.62 0.11 0.00 0.01 0.00 0.00 46.19 42.64 2akk s LEU 21 CO 0.05 -0.90 1.11 2.30 1.01 0.00 0.00 176.35 179.91 2akk n ILE 22 N 2.81 0.05 -3.86 -0.59 -5.35 -0.75 -1.50 119.36 110.18 2akk n ILE 22 Ca 0.11 -0.08 -0.09 0.00 -0.27 0.00 0.00 62.75 62.41 2akk n ILE 22 Cb 0.37 0.48 0.00 0.00 -1.74 0.00 0.00 39.64 38.76 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 -3.07 2.06 -0.08 6.28 -2.85 -1.26 -4.87 119.74 115.95 2akk s LYS 23 Ca 0.07 -1.35 -0.27 0.00 -1.00 0.00 0.00 55.97 53.43 2akk s LYS 23 Cb 0.16 0.60 -0.03 0.00 -2.06 0.00 0.00 37.83 36.50 2akk s LYS 23 CO 0.79 -0.95 0.86 -0.51 0.10 0.00 0.00 175.35 175.65 2akk s ASP 24 N -3.05 7.13 0.12 0.03 1.01 -1.26 -3.09 116.67 117.56 2akk s ASP 24 Ca 0.16 1.37 0.09 0.00 0.71 0.00 0.00 52.55 54.88 2akk s ASP 24 Cb -0.05 -2.49 -0.04 0.00 1.01 0.00 0.00 42.92 41.36 2akk s ASP 24 CO 0.11 -0.28 -0.22 -0.76 0.21 0.00 0.00 175.17 174.23 2akk s LEU 25 N 1.40 2.33 0.13 1.23 2.01 -0.40 -4.92 118.68 120.45 2akk s LEU 25 Ca 0.43 -0.73 0.10 0.00 0.01 0.00 0.00 54.13 53.94 2akk s LEU 25 Cb -0.18 -0.96 -0.04 0.00 0.01 0.00 0.00 46.19 45.02 2akk s LEU 25 CO 0.19 0.07 -0.25 -0.54 1.01 0.00 0.00 176.35 176.84 2akk s LYS 26 N -2.11 1.34 0.12 1.70 3.01 -1.26 -0.08 119.74 122.46 2akk s LYS 26 Ca 0.10 -1.32 0.10 0.00 -1.01 0.00 0.00 55.97 53.84 2akk s LYS 26 Cb -0.09 -1.75 -0.04 0.00 -1.01 0.00 0.00 37.83 34.94 2akk s LYS 26 CO 0.05 0.41 -0.25 -0.51 0.51 0.00 0.00 175.35 175.56 2akk s LEU 27 N -2.10 2.38 0.00 3.17 2.01 0.22 -4.61 118.68 119.76 2akk s LEU 27 Ca 0.13 -0.69 0.00 0.00 0.01 0.00 0.00 54.13 53.57 2akk s LEU 27 Cb -0.10 -1.29 0.00 0.00 0.01 0.00 0.00 46.19 44.81 2akk s LEU 27 CO 0.06 0.19 0.00 0.29 1.01 0.00 0.00 176.35 177.90 2akk n LYS 28 N 0.98 -0.36 0.00 1.70 5.02 -1.26 -2.00 118.16 122.24 2akk n LYS 28 Ca -0.17 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 2akk n LYS 28 Cb 0.53 -3.97 0.00 0.00 -0.02 0.00 0.00 35.03 31.57 2akk n LYS 28 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2akk n GLY 29 N -1.55 2.35 0.04 0.72 0.00 -1.26 -4.50 105.19 100.99 2akk n GLY 29 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 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 0.85 0.00 0.00 1.61 3.41 -1.24 -4.79 113.62 113.45 2akk n SER 30 Ca 0.00 -1.07 0.00 0.00 -0.26 0.00 0.00 58.87 57.54 2akk n SER 30 Cb 0.00 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 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 0.00 0.00 -4.47 4.04 7.64 -1.16 -4.59 113.62 115.09 2akk n SER 31 Ca 0.00 0.67 -0.43 0.00 1.01 0.00 0.00 58.87 60.12 2akk n SER 31 Cb 0.51 -0.48 -0.05 0.00 -1.01 0.00 0.00 64.21 63.18 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 -1.71 4.61 -0.25 0.44 2.01 -0.85 -4.96 115.64 114.94 2akk s THR 32 Ca 0.00 -0.23 -0.08 0.00 0.31 0.00 0.00 61.69 61.70 2akk s THR 32 Cb 0.00 -4.46 -0.03 0.00 0.01 0.00 0.00 72.50 68.02 2akk s THR 32 CO 0.00 -1.04 0.08 -0.69 -0.69 0.00 0.00 174.62 172.28 2akk s VAL 33 N 3.33 4.46 -0.01 3.82 1.01 -1.26 0.70 120.40 132.45 2akk s VAL 33 Ca 0.21 -0.12 -0.02 0.00 0.00 0.00 0.00 61.98 62.06 2akk s VAL 33 Cb -0.17 -3.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 2akk s VAL 33 CO 0.14 0.34 0.12 -0.76 0.00 0.00 0.00 175.10 174.94 2akk s LEU 34 N 1.55 4.10 0.26 3.92 1.02 0.89 -5.01 118.68 125.42 2akk s LEU 34 Ca 0.06 0.24 0.08 0.00 0.02 0.00 0.00 54.13 54.53 2akk s LEU 34 Cb -0.15 -2.41 -0.04 0.00 0.02 0.00 0.00 46.19 43.61 2akk s LEU 34 CO 0.04 0.27 0.10 -0.54 0.02 0.00 0.00 176.35 176.24 2akk s LYS 35 N -1.80 2.59 0.22 1.70 -0.14 -1.26 -1.28 119.74 119.77 2akk s LYS 35 Ca 0.24 -1.26 -0.32 0.00 -1.36 0.00 0.00 55.97 53.28 2akk s LYS 35 Cb -0.12 -2.35 -0.13 0.00 -1.68 0.00 0.00 37.83 33.55 2akk s LYS 35 CO 0.16 0.37 1.53 -2.13 -0.76 0.00 0.00 175.35 174.51 2akk n ARG 36 N -1.04 2.25 0.00 1.68 0.63 -1.18 -2.17 116.66 116.83 2akk n ARG 36 Ca -0.07 0.81 0.00 0.00 -0.92 0.00 0.00 57.85 57.67 2akk n ARG 36 Cb 0.59 -2.54 0.00 0.00 0.45 0.00 0.00 32.46 30.96 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 2.75 0.66 3.69 5.14 0.00 -0.56 -4.95 105.19 111.93 2akk n GLY 37 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.68 0.32 -3.18 2.61 -1.04 -0.92 -4.60 114.28 105.78 2akk n THR 38 Ca 0.00 -0.06 -0.40 0.00 -2.04 0.00 0.00 64.05 61.55 2akk n THR 38 Cb 0.00 -2.08 -0.07 0.00 -1.82 0.00 0.00 70.33 66.37 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 2.56 4.16 -0.64 -2.82 1.75 -1.26 -0.09 119.30 122.96 2akk s MET 39 Ca 0.82 0.48 -0.04 0.00 -1.25 0.00 0.00 55.69 55.70 2akk s MET 39 Cb -0.50 -3.60 0.16 0.00 2.84 0.00 0.00 34.83 33.74 2akk s MET 39 CO 0.37 -0.25 0.46 0.42 -0.65 0.00 0.00 175.02 175.37 2akk s ILE 40 N 1.97 3.84 0.14 10.11 1.01 0.53 -4.79 121.20 134.01 2akk s ILE 40 Ca 0.25 -2.92 0.03 0.00 0.00 0.00 0.00 60.65 58.01 2akk s ILE 40 Cb -0.16 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.78 2akk s ILE 40 CO 0.10 -0.89 0.24 0.00 0.00 0.00 0.00 174.94 174.38 2akk s ARG 41 N -0.04 3.30 0.00 2.79 1.70 -1.25 -0.49 118.95 124.95 2akk s ARG 41 Ca 0.17 -0.65 0.00 0.00 -0.47 0.00 0.00 55.73 54.78 2akk s ARG 41 Cb -0.20 -2.89 0.00 0.00 -0.57 0.00 0.00 34.95 31.29 2akk s ARG 41 CO -0.04 0.52 0.00 0.41 -1.08 0.00 0.00 175.30 175.12 2akk n GLY 42 N -0.39 0.66 3.94 3.88 0.00 0.76 -4.03 105.19 110.01 2akk n GLY 42 Ca -0.07 -0.51 -0.24 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.84 5.00 0.05 -0.61 -5.25 0.46 -4.23 121.20 113.78 2akk s ILE 43 Ca 0.00 -0.48 -0.01 0.00 -0.99 0.00 0.00 60.65 59.18 2akk s ILE 43 Cb 0.00 -3.82 -0.04 0.00 2.95 0.00 0.00 42.46 41.55 2akk s ILE 43 CO 0.00 -0.54 -0.03 0.00 -1.79 0.00 0.00 174.94 172.58 2akk s ARG 44 N -4.33 0.61 0.12 0.37 1.70 0.93 0.14 118.95 118.49 2akk s ARG 44 Ca 0.41 -1.18 -0.30 0.00 -0.47 0.00 0.00 55.73 54.19 2akk s ARG 44 Cb -0.10 0.15 -0.06 0.00 -0.57 0.00 0.00 34.95 34.37 2akk s ARG 44 CO 0.36 -0.09 1.00 -0.51 -1.08 0.00 0.00 175.30 174.98 2akk s LEU 45 N -2.80 4.49 0.00 -1.89 1.43 -1.26 -1.50 118.68 117.14 2akk s LEU 45 Ca 0.06 1.86 0.00 0.00 -1.03 0.00 0.00 54.13 55.02 2akk s LEU 45 Cb 0.06 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.69 2akk s LEU 45 CO -0.09 -0.12 0.00 0.35 0.23 0.00 0.00 176.35 176.73 2akk n THR 46 N 2.77 0.00 1.24 5.49 -2.24 -1.25 -4.88 114.28 115.41 2akk n THR 46 Ca 0.03 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.95 2akk n THR 46 Cb 0.48 -1.02 0.57 0.00 -2.10 0.00 0.00 70.33 68.26 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 0.32 -4.85 3.42 8.00 -1.26 -4.85 116.55 117.33 2akk n ASP 47 Ca 0.00 -0.22 -0.30 0.00 0.71 0.00 0.00 54.79 54.98 2akk n ASP 47 Cb 0.00 -0.14 -0.05 0.00 -0.02 0.00 0.00 41.12 40.91 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 -2.70 5.92 0.09 -2.24 0.01 -1.26 -5.01 113.70 108.50 2akk s SER 48 Ca 0.22 0.11 0.15 0.00 1.31 0.00 0.00 55.95 57.75 2akk s SER 48 Cb 0.19 -1.71 -0.12 0.00 0.21 0.00 0.00 66.02 64.60 2akk s SER 48 CO 0.52 0.16 0.93 -0.33 0.41 0.00 0.00 173.24 174.94 2akk h GLU 49 N 3.11 0.00 -0.01 12.44 5.08 -1.89 -3.34 114.58 129.97 2akk h GLU 49 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 2akk h GLU 49 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2akk h GLU 49 CO 0.70 0.40 -0.60 -0.25 -1.00 0.00 0.00 179.01 178.26 2akk n ASP 50 N -3.00 1.50 -4.26 1.42 9.92 -1.26 -3.86 116.55 117.01 2akk n ASP 50 Ca -0.08 -1.20 -0.26 0.00 -0.53 0.00 0.00 54.79 52.72 2akk n ASP 50 Cb 0.86 0.57 -0.14 0.00 -0.64 0.00 0.00 41.12 41.77 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 -2.67 1.39 0.23 -1.24 8.01 -1.25 0.33 118.70 123.51 2akk s GLU 51 Ca 0.16 -0.96 0.02 0.00 0.01 0.00 0.00 54.97 54.20 2akk s GLU 51 Cb 0.18 -1.52 -0.05 0.00 -4.31 0.00 0.00 34.13 28.42 2akk s GLU 51 CO 0.66 0.39 0.04 0.96 0.01 0.00 0.00 175.26 177.32 2akk s ILE 52 N -0.82 0.75 -0.11 -1.63 -5.25 0.55 -3.79 121.20 110.89 2akk s ILE 52 Ca 0.08 -2.00 0.03 0.00 -0.99 0.00 0.00 60.65 57.77 2akk s ILE 52 Cb -0.09 -2.44 0.00 0.00 2.95 0.00 0.00 42.46 42.89 2akk s ILE 52 CO 0.02 -0.21 -0.23 -0.70 -1.79 0.00 0.00 174.94 172.03 2akk s GLU 53 N -3.95 3.04 0.00 0.37 2.12 -0.56 0.29 118.70 120.01 2akk s GLU 53 Ca 0.32 -0.87 0.00 0.00 0.36 0.00 0.00 54.97 54.78 2akk s GLU 53 Cb 0.07 -2.35 0.00 0.00 0.26 0.00 0.00 34.13 32.11 2akk s GLU 53 CO 0.10 0.12 0.00 0.41 -0.54 0.00 0.00 175.26 175.35 2akk n GLY 54 N 3.70 5.27 3.05 -1.50 0.00 -0.40 -0.05 105.19 115.26 2akk n GLY 54 Ca -0.19 -1.42 -0.10 0.00 0.00 0.00 0.00 46.02 44.30 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 1.07 0.41 0.08 1.61 1.70 -1.26 -0.69 118.95 121.87 2akk s ARG 55 Ca 0.00 -0.49 0.00 0.00 -0.47 0.00 0.00 55.73 54.78 2akk s ARG 55 Cb 0.00 0.16 0.00 0.00 -0.57 0.00 0.00 34.95 34.54 2akk s ARG 55 CO 0.00 -0.09 0.03 0.25 -1.08 0.00 0.00 175.30 174.41 2akk n THR 56 N 1.52 0.00 0.22 4.99 -2.24 0.15 -3.83 114.28 115.09 2akk n THR 56 Ca -0.23 -0.34 0.09 0.00 -2.27 0.00 0.00 64.05 61.30 2akk n THR 56 Cb 0.55 -0.16 0.46 0.00 -2.10 0.00 0.00 70.33 69.08 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 3.32 -2.00 -3.40 116.42 117.90 2akk h ASP 57 Ca -0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.99 2akk h ASP 57 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2akk h ASP 57 CO 0.09 0.25 -0.07 0.29 -1.72 0.00 0.00 179.24 178.08 2akk n LYS 58 N -3.46 0.04 -2.45 3.56 5.02 -1.26 -4.95 118.16 114.66 2akk n LYS 58 Ca -0.00 0.02 -0.42 0.00 -2.02 0.00 0.00 58.31 55.88 2akk n LYS 58 Cb 0.43 -0.32 -0.02 0.00 -0.02 0.00 0.00 35.03 35.10 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 -1.26 3.93 -0.13 -0.18 1.09 -1.26 -5.00 121.20 118.38 2akk s ILE 59 Ca -0.02 0.87 -0.04 0.00 -1.10 0.00 0.00 60.65 60.36 2akk s ILE 59 Cb 0.00 -4.46 -0.03 0.00 -1.06 0.00 0.00 42.46 36.91 2akk s ILE 59 CO 0.03 -1.08 -0.00 -1.59 -0.10 0.00 0.00 174.94 172.21 2akk s LYS 60 N 5.09 3.42 0.00 2.79 -2.85 -1.26 0.34 119.74 127.27 2akk s LYS 60 Ca 0.52 -0.43 0.00 0.00 -1.00 0.00 0.00 55.97 55.06 2akk s LYS 60 Cb -0.10 -2.92 0.00 0.00 -2.06 0.00 0.00 37.83 32.75 2akk s LYS 60 CO 0.28 0.46 0.00 0.41 0.10 0.00 0.00 175.35 176.60 2akk n GLY 61 N 2.90 0.54 3.44 0.59 0.00 0.13 -4.96 105.19 107.84 2akk n GLY 61 Ca -0.18 -0.44 -0.33 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.21 2.71 -0.24 0.99 2.34 -0.25 -4.90 118.68 117.12 2akk s LEU 62 Ca 0.00 -0.24 -0.18 0.00 0.06 0.00 0.00 54.13 53.76 2akk s LEU 62 Cb 0.00 -1.56 -0.03 0.00 -0.56 0.00 0.00 46.19 44.04 2akk s LEU 62 CO 0.00 0.29 0.54 -0.69 -1.06 0.00 0.00 176.35 175.43 2akk s VAL 63 N -0.41 5.06 0.01 1.48 1.01 -1.26 -1.28 120.40 125.02 2akk s VAL 63 Ca 0.05 0.95 0.02 0.00 0.00 0.00 0.00 61.98 63.00 2akk s VAL 63 Cb -0.12 -3.85 -0.01 0.00 0.00 0.00 0.00 36.38 32.39 2akk s VAL 63 CO 0.02 0.10 -0.07 -0.76 0.00 0.00 0.00 175.10 174.39 2akk s LEU 64 N 2.14 2.10 0.20 3.92 1.43 0.14 -4.96 118.68 123.66 2akk s LEU 64 Ca 0.23 -0.27 -0.32 0.00 -1.03 0.00 0.00 54.13 52.74 2akk s LEU 64 Cb -0.16 -0.27 -0.12 0.00 0.03 0.00 0.00 46.19 45.68 2akk s LEU 64 CO 0.09 -0.02 1.70 0.00 0.23 0.00 0.00 176.35 178.35 2akk s ARG 65 N -0.66 4.14 -0.12 1.70 1.70 -1.26 -0.33 118.95 124.11 2akk s ARG 65 Ca -0.02 2.58 0.05 0.00 -0.47 0.00 0.00 55.73 57.87 2akk s ARG 65 Cb -0.05 -3.08 0.34 0.00 -0.57 0.00 0.00 34.95 31.58 2akk s ARG 65 CO 0.00 -0.73 1.12 -2.37 -1.08 0.00 0.00 175.30 172.23 2akk n THR 66 N 3.94 1.35 1.01 4.99 5.66 0.15 -3.77 114.28 127.62 2akk n THR 66 Ca 0.15 -0.65 0.12 0.00 -3.05 0.00 0.00 64.05 60.63 2akk n THR 66 Cb 0.36 -0.49 0.22 0.00 -1.55 0.00 0.00 70.33 68.87 2akk n THR 66 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 2akk n GLU 67 N 0.16 0.04 -0.15 1.09 0.28 -1.26 -2.58 120.64 118.22 2akk n GLU 67 Ca 0.15 -0.03 0.07 0.00 -0.16 0.00 0.00 57.16 57.19 2akk n GLU 67 Cb 0.74 -1.50 0.14 0.00 1.43 0.00 0.00 31.44 32.25 2akk n GLU 67 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 2akk n PHE 68 N -1.45 0.26 -4.61 -1.84 1.16 -1.25 -4.49 117.46 105.24 2akk n PHE 68 Ca 0.06 -0.82 -0.30 0.00 -1.87 0.00 0.00 57.45 54.51 2akk n PHE 68 Cb 0.34 -0.16 -0.13 0.00 -1.61 0.00 0.00 39.48 37.92 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 -2.30 2.51 -0.15 5.98 1.43 -1.16 -1.81 118.68 123.18 2akk s LEU 69 Ca 0.27 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.87 2akk s LEU 69 Cb 0.22 -1.45 0.01 0.00 0.03 0.00 0.00 46.19 45.00 2akk s LEU 69 CO 0.05 0.23 -0.19 -0.75 0.23 0.00 0.00 176.35 175.92 2akk s LYS 70 N -1.59 3.10 0.03 1.70 2.36 0.15 -1.56 119.74 123.93 2akk s LYS 70 Ca 0.15 -0.81 -0.30 0.00 -2.55 0.00 0.00 55.97 52.46 2akk s LYS 70 Cb -0.10 -2.52 -0.08 0.00 -1.05 0.00 0.00 37.83 34.07 2akk s LYS 70 CO 0.06 -0.01 1.86 0.21 1.55 0.00 0.00 175.35 179.02 2akk s LYS 71 N 0.83 4.15 0.23 4.03 2.20 -1.26 0.21 119.74 130.14 2akk s LYS 71 Ca -0.06 2.50 -0.30 0.00 -0.36 0.00 0.00 55.97 57.75 2akk s LYS 71 Cb -0.15 -4.01 -0.09 0.00 -1.51 0.00 0.00 37.83 32.07 2akk s LYS 71 CO -0.01 -0.90 0.99 0.00 -0.36 0.00 0.00 175.35 175.07 2akk s ALA 72 N 4.03 3.35 0.00 3.13 0.00 0.64 -4.03 121.76 128.87 2akk s ALA 72 Ca 0.83 0.70 0.00 0.00 0.00 0.00 0.00 51.96 53.49 2akk s ALA 72 Cb -0.41 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.45 2akk s ALA 72 CO 0.38 0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.61 2akk n GLY 73 N 1.55 1.75 0.00 0.00 0.00 -1.26 -4.77 105.19 102.45 2akk n GLY 73 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2akk n GLY 73 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18