#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 6.17 -0.40 7.83 0.01 -1.26 -4.85 113.70 121.19 2akk s SER 2 Ca 0.00 -3.28 0.11 0.00 1.31 0.00 0.00 55.95 54.09 2akk s SER 2 Cb 0.00 -2.00 0.34 0.00 0.21 0.00 0.00 66.02 64.57 2akk s SER 2 CO 0.00 -0.32 0.74 2.30 0.41 0.00 0.00 173.24 176.37 2akk n ILE 3 N 3.01 0.22 -2.32 1.44 -5.35 -1.26 -4.99 119.36 110.11 2akk n ILE 3 Ca 0.17 -4.68 -0.43 0.00 -0.27 0.00 0.00 62.75 57.54 2akk n ILE 3 Cb 0.39 -0.53 -0.02 0.00 -1.74 0.00 0.00 39.64 37.74 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 -2.48 3.64 -0.26 6.28 2.02 -1.26 -4.80 118.70 121.84 2akk s GLU 4 Ca 0.41 1.09 -0.13 0.00 0.02 0.00 0.00 54.97 56.36 2akk s GLU 4 Cb 0.33 -4.01 -0.04 0.00 0.10 0.00 0.00 34.13 30.50 2akk s GLU 4 CO -0.09 -1.48 0.28 0.08 0.02 0.00 0.00 175.26 174.07 2akk s VAL 5 N 5.31 5.26 0.14 2.63 1.01 -1.26 -4.80 120.40 128.69 2akk s VAL 5 Ca 0.62 0.38 0.06 0.00 0.00 0.00 0.00 61.98 63.04 2akk s VAL 5 Cb -0.16 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 2akk s VAL 5 CO 0.30 0.23 -0.13 -0.13 0.00 0.00 0.00 175.10 175.38 2akk s ARG 6 N 1.72 1.09 0.00 2.72 3.00 -1.25 -0.01 118.95 126.21 2akk s ARG 6 Ca 0.11 -1.37 0.00 0.00 0.00 0.00 0.00 55.73 54.47 2akk s ARG 6 Cb -0.15 -0.84 0.00 0.00 0.00 0.00 0.00 34.95 33.95 2akk s ARG 6 CO 0.09 0.14 0.00 -0.40 0.00 0.00 0.00 175.30 175.13 2akk n ASP 7 N 0.13 0.00 0.09 0.23 5.75 -0.71 -4.79 116.55 117.26 2akk n ASP 7 Ca -0.12 -0.87 0.10 0.00 -0.01 0.00 0.00 54.79 53.88 2akk n ASP 7 Cb 0.59 0.00 0.42 0.00 -1.03 0.00 0.00 41.12 41.10 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 0.44 0.00 0.00 -1.24 -1.91 -3.48 115.58 109.38 2akk h ASN 9 Ca 0.00 -0.78 0.00 0.00 0.71 0.00 0.00 56.30 56.23 2akk h ASN 9 Cb 0.27 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 39.18 2akk h ASN 9 CO 0.00 1.68 0.00 0.61 -1.29 0.00 0.00 177.43 178.43 2akk n GLY 10 N 1.85 1.41 3.68 1.57 0.00 -0.93 -5.10 105.19 107.67 2akk n GLY 10 Ca -0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 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 3.48 0.13 4.61 0.00 -1.26 -4.76 121.76 121.97 2akk s ALA 11 Ca 0.00 0.15 -0.31 0.00 0.00 0.00 0.00 51.96 51.80 2akk s ALA 11 Cb 0.00 -3.30 -0.09 0.00 0.00 0.00 0.00 23.12 19.73 2akk s ALA 11 CO 0.00 -0.64 1.48 -0.51 0.00 0.00 0.00 175.76 176.10 2akk s LEU 12 N 2.11 4.37 0.36 0.00 1.43 -1.26 -1.73 118.68 123.96 2akk s LEU 12 Ca 0.42 2.46 0.07 0.00 -1.03 0.00 0.00 54.13 56.04 2akk s LEU 12 Cb -0.17 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.46 2akk s LEU 12 CO 0.14 -0.75 0.47 -0.76 0.23 0.00 0.00 176.35 175.69 2akk s LEU 13 N 1.26 3.82 0.37 1.79 1.43 0.99 -4.96 118.68 123.38 2akk s LEU 13 Ca 0.68 -0.31 -0.13 0.00 -1.03 0.00 0.00 54.13 53.34 2akk s LEU 13 Cb -0.40 -2.64 0.04 0.00 0.03 0.00 0.00 46.19 43.22 2akk s LEU 13 CO 0.31 -0.52 0.72 0.00 0.23 0.00 0.00 176.35 177.09 2akk s ALA 14 N -2.25 -0.44 0.15 4.21 0.00 -1.26 -4.72 121.76 117.44 2akk s ALA 14 Ca 0.47 -0.90 -0.31 0.00 0.00 0.00 0.00 51.96 51.22 2akk s ALA 14 Cb -0.09 0.78 -0.10 0.00 0.00 0.00 0.00 23.12 23.72 2akk s ALA 14 CO 0.31 -0.95 1.54 0.34 0.00 0.00 0.00 175.76 177.01 2akk s ASP 15 N -3.10 6.63 0.00 0.00 -1.08 -1.26 -2.20 116.67 115.66 2akk s ASP 15 Ca 0.18 2.56 0.00 0.00 -0.52 0.00 0.00 52.55 54.77 2akk s ASP 15 Cb -0.04 -2.59 0.00 0.00 -1.46 0.00 0.00 42.92 38.83 2akk s ASP 15 CO 0.13 -0.80 0.00 0.61 0.52 0.00 0.00 175.17 175.63 2akk n GLY 16 N 3.73 0.72 3.96 2.66 0.00 0.16 -4.97 105.19 111.45 2akk n GLY 16 Ca 0.14 -0.20 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.18 4.48 -0.05 1.61 -1.08 -0.94 -4.48 116.67 114.02 2akk s ASP 17 Ca 0.00 0.07 0.01 0.00 -0.52 0.00 0.00 52.55 52.11 2akk s ASP 17 Cb 0.00 -0.58 0.02 0.00 -1.46 0.00 0.00 42.92 40.90 2akk s ASP 17 CO 0.00 -1.78 -0.06 0.54 0.52 0.00 0.00 175.17 174.38 2akk s ASN 18 N -4.63 1.25 0.44 -0.34 2.20 -1.26 0.36 114.94 112.96 2akk s ASN 18 Ca 0.64 -0.18 0.03 0.00 -0.94 0.00 0.00 52.86 52.41 2akk s ASN 18 Cb -0.08 -0.57 -0.03 0.00 -2.00 0.00 0.00 41.25 38.58 2akk s ASN 18 CO 0.45 -0.04 0.07 0.68 -2.94 0.00 0.00 177.10 175.32 2akk s VAL 19 N 0.93 0.93 -0.04 3.54 -7.23 0.69 -0.28 120.40 118.94 2akk s VAL 19 Ca -0.11 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 57.86 2akk s VAL 19 Cb -0.15 -2.36 0.04 0.00 0.56 0.00 0.00 36.38 34.47 2akk s VAL 19 CO 0.00 0.00 0.45 -0.44 -0.31 0.00 0.00 175.10 174.81 2akk s SER 20 N -3.70 -0.38 0.07 4.85 0.01 0.15 0.23 113.70 114.93 2akk s SER 20 Ca 0.19 0.37 -0.31 0.00 1.31 0.00 0.00 55.95 57.52 2akk s SER 20 Cb 0.03 0.44 -0.08 0.00 0.21 0.00 0.00 66.02 66.62 2akk s SER 20 CO 0.11 -0.48 1.63 -0.76 0.41 0.00 0.00 173.24 174.14 2akk s LEU 21 N -1.16 4.36 0.00 2.44 2.01 0.47 0.10 118.68 126.90 2akk s LEU 21 Ca -0.12 2.46 0.24 0.00 0.01 0.00 0.00 54.13 56.72 2akk s LEU 21 Cb -0.03 -3.56 0.38 0.00 0.01 0.00 0.00 46.19 42.99 2akk s LEU 21 CO 0.06 -0.87 1.33 2.30 1.01 0.00 0.00 176.35 180.18 2akk n ILE 22 N 4.70 0.00 -4.17 -0.59 -5.35 -0.73 -1.52 119.36 111.70 2akk n ILE 22 Ca 0.16 -0.09 -0.16 0.00 -0.27 0.00 0.00 62.75 62.38 2akk n ILE 22 Cb 0.41 0.61 -0.06 0.00 -1.74 0.00 0.00 39.64 38.86 2akk n ILE 22 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 2akk s LYS 23 N -2.72 1.79 -0.56 6.28 1.02 -1.26 -4.90 119.74 119.38 2akk s LYS 23 Ca 0.17 -1.83 -0.19 0.00 0.02 0.00 0.00 55.97 54.13 2akk s LYS 23 Cb 0.18 0.39 0.08 0.00 -0.52 0.00 0.00 37.83 37.96 2akk s LYS 23 CO 0.64 -0.71 0.70 -0.51 -0.92 0.00 0.00 175.35 174.56 2akk s ASP 24 N -3.28 6.20 -0.40 2.83 1.01 -1.26 -2.40 116.67 119.37 2akk s ASP 24 Ca 0.35 -1.17 -0.13 0.00 0.71 0.00 0.00 52.55 52.31 2akk s ASP 24 Cb 0.01 -2.31 0.04 0.00 1.01 0.00 0.00 42.92 41.67 2akk s ASP 24 CO 0.22 -1.06 0.27 -0.76 0.21 0.00 0.00 175.17 174.04 2akk s LEU 25 N 2.82 5.01 0.01 1.23 2.01 0.48 -4.88 118.68 125.36 2akk s LEU 25 Ca 0.14 -1.06 -0.18 0.00 0.01 0.00 0.00 54.13 53.04 2akk s LEU 25 Cb -0.21 -2.09 -0.06 0.00 0.01 0.00 0.00 46.19 43.84 2akk s LEU 25 CO 0.09 -0.46 0.52 -0.75 1.01 0.00 0.00 176.35 176.76 2akk s LYS 26 N 1.59 4.17 0.00 1.70 2.36 -1.26 -0.01 119.74 128.29 2akk s LYS 26 Ca 0.03 0.61 0.00 0.00 -2.55 0.00 0.00 55.97 54.07 2akk s LYS 26 Cb -0.20 -3.28 0.00 0.00 -1.05 0.00 0.00 37.83 33.30 2akk s LYS 26 CO 0.07 0.54 0.07 -0.11 1.55 0.00 0.00 175.35 177.47 2akk n LEU 27 N 2.19 1.33 -3.85 5.43 -0.00 0.16 -4.93 117.00 117.32 2akk n LEU 27 Ca -0.10 0.30 -0.12 0.00 -0.00 0.00 0.00 56.01 56.09 2akk n LEU 27 Cb 0.51 -0.26 -0.12 0.00 -0.00 0.00 0.00 43.42 43.56 2akk n LEU 27 CO 0.41 -0.26 -0.22 -0.75 -0.00 0.00 0.00 177.39 176.57 2akk s LYS 28 N -0.65 0.23 5.62 1.96 2.20 -1.26 -5.04 119.74 122.80 2akk s LYS 28 Ca 0.00 -0.01 0.00 0.00 -0.36 0.00 0.00 55.97 55.60 2akk s LYS 28 Cb 0.00 0.10 0.00 0.00 -1.51 0.00 0.00 37.83 36.42 2akk s LYS 28 CO 0.00 -0.04 0.00 0.41 -0.36 0.00 0.00 175.35 175.36 2akk n GLY 29 N 2.57 3.19 0.37 5.54 0.00 -1.26 -2.36 105.19 113.24 2akk n GLY 29 Ca -0.15 0.27 0.01 0.00 0.00 0.00 0.00 46.02 46.14 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 8.03 0.22 0.05 1.61 7.64 -1.26 -4.94 113.62 124.98 2akk n SER 30 Ca 0.00 -1.91 -0.03 0.00 1.01 0.00 0.00 58.87 57.94 2akk n SER 30 Cb 0.00 -0.18 -0.01 0.00 -1.01 0.00 0.00 64.21 63.01 2akk n SER 30 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2akk h SER 31 N 0.00 -0.16 -3.52 6.43 0.02 -1.91 -3.43 113.55 110.99 2akk h SER 31 Ca 0.00 0.01 -0.71 0.00 -0.84 0.00 0.00 61.79 60.24 2akk h SER 31 Cb 1.28 0.04 -0.25 0.00 0.14 0.00 0.00 62.40 63.62 2akk h SER 31 CO 0.00 0.12 -0.48 -0.89 -1.14 0.00 0.00 176.83 174.44 2akk s THR 32 N -2.13 4.62 -0.27 -2.27 2.01 -1.26 -5.04 115.64 111.30 2akk s THR 32 Ca -0.03 -0.99 0.01 0.00 0.31 0.00 0.00 61.69 60.99 2akk s THR 32 Cb 0.00 -3.65 0.05 0.00 0.01 0.00 0.00 72.50 68.91 2akk s THR 32 CO 0.08 -0.34 -0.07 -0.69 -0.69 0.00 0.00 174.62 172.91 2akk s VAL 33 N 1.54 2.49 0.21 3.82 1.01 -1.26 0.40 120.40 128.61 2akk s VAL 33 Ca 0.03 -1.48 -0.08 0.00 0.00 0.00 0.00 61.98 60.44 2akk s VAL 33 Cb -0.21 -2.42 -0.07 0.00 0.00 0.00 0.00 36.38 33.69 2akk s VAL 33 CO 0.06 -0.02 0.50 -0.76 0.00 0.00 0.00 175.10 174.88 2akk s LEU 34 N 1.17 4.19 0.30 3.92 1.02 0.98 -4.92 118.68 125.35 2akk s LEU 34 Ca -0.07 0.80 0.08 0.00 0.02 0.00 0.00 54.13 54.97 2akk s LEU 34 Cb -0.19 -3.56 -0.04 0.00 0.02 0.00 0.00 46.19 42.42 2akk s LEU 34 CO -0.04 -0.05 0.12 -0.54 0.02 0.00 0.00 176.35 175.86 2akk s LYS 35 N -2.83 2.47 0.43 1.70 -0.14 -1.26 -0.39 119.74 119.71 2akk s LYS 35 Ca 0.45 -1.41 -0.24 0.00 -1.36 0.00 0.00 55.97 53.41 2akk s LYS 35 Cb -0.11 -2.26 -0.08 0.00 -1.68 0.00 0.00 37.83 33.70 2akk s LYS 35 CO 0.23 0.23 1.20 0.50 -0.76 0.00 0.00 175.35 176.75 2akk s ARG 36 N -3.81 3.88 0.00 1.68 3.52 -1.01 -3.27 118.95 119.94 2akk s ARG 36 Ca 0.35 1.90 0.00 0.00 -0.13 0.00 0.00 55.73 57.85 2akk s ARG 36 Cb -0.05 -2.57 0.00 0.00 -1.56 0.00 0.00 34.95 30.77 2akk s ARG 36 CO 0.23 -0.49 0.00 0.41 -0.81 0.00 0.00 175.30 174.64 2akk n GLY 37 N 0.58 0.51 3.63 8.12 0.00 -0.58 -4.96 105.19 112.49 2akk n GLY 37 Ca 0.06 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.00 4.75 -0.19 2.61 2.01 -1.20 -4.82 115.64 116.79 2akk s THR 38 Ca 0.00 1.40 -0.24 0.00 0.31 0.00 0.00 61.69 63.16 2akk s THR 38 Cb 0.00 -4.19 -0.02 0.00 0.01 0.00 0.00 72.50 68.30 2akk s THR 38 CO 0.00 -0.25 0.76 -0.32 -0.69 0.00 0.00 174.62 174.12 2akk s MET 39 N 3.06 4.25 -0.52 4.92 1.75 -1.26 -0.39 119.30 131.12 2akk s MET 39 Ca 0.36 0.87 -0.03 0.00 -1.25 0.00 0.00 55.69 55.63 2akk s MET 39 Cb -0.14 -3.58 0.14 0.00 2.84 0.00 0.00 34.83 34.08 2akk s MET 39 CO 0.12 -0.32 0.33 0.42 -0.65 0.00 0.00 175.02 174.92 2akk s ILE 40 N 2.14 3.57 -0.04 10.11 1.01 0.13 -4.72 121.20 133.41 2akk s ILE 40 Ca 0.35 -2.45 0.00 0.00 0.00 0.00 0.00 60.65 58.55 2akk s ILE 40 Cb -0.16 -3.38 -0.03 0.00 0.01 0.00 0.00 42.46 38.89 2akk s ILE 40 CO 0.11 -0.79 -0.01 0.00 0.00 0.00 0.00 174.94 174.25 2akk s ARG 41 N 0.60 2.83 0.00 2.79 1.04 -1.24 -0.22 118.95 124.74 2akk s ARG 41 Ca 0.12 -0.54 0.00 0.00 -1.04 0.00 0.00 55.73 54.27 2akk s ARG 41 Cb -0.22 -2.68 0.00 0.00 -2.04 0.00 0.00 34.95 30.01 2akk s ARG 41 CO -0.04 0.65 0.00 0.41 -0.04 0.00 0.00 175.30 176.29 2akk n GLY 42 N 1.77 0.88 3.95 3.88 0.00 0.16 -4.36 105.19 111.47 2akk n GLY 42 Ca -0.16 -0.19 -0.23 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.15 3.67 0.12 -0.61 -5.25 -0.29 -4.10 121.20 112.57 2akk s ILE 43 Ca 0.00 -0.48 -0.01 0.00 -0.99 0.00 0.00 60.65 59.17 2akk s ILE 43 Cb 0.00 -3.37 -0.04 0.00 2.95 0.00 0.00 42.46 42.00 2akk s ILE 43 CO 0.00 -0.27 0.04 0.00 -1.79 0.00 0.00 174.94 172.91 2akk s ARG 44 N -4.65 0.87 0.44 0.37 1.70 0.15 0.36 118.95 118.19 2akk s ARG 44 Ca 0.51 -1.40 -0.02 0.00 -0.47 0.00 0.00 55.73 54.36 2akk s ARG 44 Cb -0.10 0.21 -0.02 0.00 -0.57 0.00 0.00 34.95 34.47 2akk s ARG 44 CO 0.39 -0.22 0.69 -0.51 -1.08 0.00 0.00 175.30 174.56 2akk s LEU 45 N -3.03 3.71 0.00 -1.89 1.43 -1.26 -1.75 118.68 115.88 2akk s LEU 45 Ca 0.21 0.52 0.00 0.00 -1.03 0.00 0.00 54.13 53.83 2akk s LEU 45 Cb 0.08 -3.41 0.00 0.00 0.03 0.00 0.00 46.19 42.89 2akk s LEU 45 CO -0.01 -0.59 0.00 0.35 0.23 0.00 0.00 176.35 176.33 2akk n THR 46 N -2.09 0.00 0.87 5.49 -2.24 -1.26 -4.82 114.28 110.24 2akk n THR 46 Ca -0.00 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 2akk n THR 46 Cb 0.57 0.00 0.52 0.00 -2.10 0.00 0.00 70.33 69.31 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 -1.34 0.00 -4.86 3.42 8.00 -1.26 -4.73 116.55 115.77 2akk n ASP 47 Ca 0.00 0.37 -0.35 0.00 0.71 0.00 0.00 54.79 55.52 2akk n ASP 47 Cb 0.00 -0.45 -0.06 0.00 -0.02 0.00 0.00 41.12 40.60 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 -2.90 6.71 0.06 -2.24 0.01 -1.26 -4.99 113.70 109.08 2akk s SER 48 Ca 0.14 0.91 0.22 0.00 1.31 0.00 0.00 55.95 58.53 2akk s SER 48 Cb 0.15 -2.22 -0.20 0.00 0.21 0.00 0.00 66.02 63.96 2akk s SER 48 CO 0.41 0.12 0.69 -0.62 0.41 0.00 0.00 173.24 174.25 2akk n GLU 49 N 0.73 0.64 0.00 12.44 1.02 -1.26 -4.12 120.64 130.09 2akk n GLU 49 Ca -0.06 -0.05 0.09 0.00 -0.02 0.00 0.00 57.16 57.12 2akk n GLU 49 Cb 0.52 -1.65 -0.03 0.00 -0.02 0.00 0.00 31.44 30.27 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 -2.46 1.58 -4.29 1.62 9.92 -1.26 -3.93 116.55 117.73 2akk n ASP 50 Ca -0.04 -1.29 -0.26 0.00 -0.53 0.00 0.00 54.79 52.68 2akk n ASP 50 Cb 0.59 0.59 -0.13 0.00 -0.64 0.00 0.00 41.12 41.54 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 -2.26 1.30 0.27 -1.24 8.01 -1.26 0.03 118.70 123.55 2akk s GLU 51 Ca 0.13 -1.10 0.02 0.00 0.01 0.00 0.00 54.97 54.04 2akk s GLU 51 Cb 0.15 -1.53 -0.04 0.00 -4.31 0.00 0.00 34.13 28.40 2akk s GLU 51 CO 0.53 0.37 0.15 0.96 0.01 0.00 0.00 175.26 177.29 2akk s ILE 52 N -0.99 0.25 -0.05 -1.63 -4.36 0.60 -4.16 121.20 110.86 2akk s ILE 52 Ca 0.08 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 58.51 2akk s ILE 52 Cb -0.10 -2.53 -0.00 0.00 1.25 0.00 0.00 42.46 41.08 2akk s ILE 52 CO 0.03 0.00 -0.18 -0.70 0.24 0.00 0.00 174.94 174.34 2akk s GLU 53 N -3.90 1.85 0.29 0.37 2.12 -0.72 0.42 118.70 119.12 2akk s GLU 53 Ca 0.37 -0.62 0.01 0.00 0.36 0.00 0.00 54.97 55.09 2akk s GLU 53 Cb 0.06 -1.59 -0.00 0.00 0.26 0.00 0.00 34.13 32.85 2akk s GLU 53 CO 0.17 0.24 0.35 0.41 -0.54 0.00 0.00 175.26 175.89 2akk n GLY 54 N 3.16 2.54 3.07 -1.50 0.00 -0.19 0.34 105.19 112.61 2akk n GLY 54 Ca -0.18 -1.66 -0.19 0.00 0.00 0.00 0.00 46.02 43.99 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 -2.80 0.81 0.09 1.61 1.70 -1.26 -0.74 118.95 118.36 2akk s ARG 55 Ca 0.27 -0.50 0.00 0.00 -0.47 0.00 0.00 55.73 55.03 2akk s ARG 55 Cb -0.00 -0.78 -0.00 0.00 -0.57 0.00 0.00 34.95 33.60 2akk s ARG 55 CO 0.19 0.20 0.01 0.25 -1.08 0.00 0.00 175.30 174.87 2akk n THR 56 N 2.46 0.00 0.51 4.99 -2.24 0.15 -3.58 114.28 116.57 2akk n THR 56 Ca -0.16 -0.46 0.13 0.00 -2.27 0.00 0.00 64.05 61.29 2akk n THR 56 Cb 0.56 0.11 0.41 0.00 -2.10 0.00 0.00 70.33 69.31 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 0.25 0.00 0.00 3.42 5.19 -1.99 -3.39 116.42 119.90 2akk h ASP 57 Ca -0.08 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.32 2akk h ASP 57 Cb 0.24 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.75 2akk h ASP 57 CO 0.13 0.00 -0.38 1.17 -3.12 0.00 0.00 179.24 177.04 2akk n LYS 58 N -2.39 0.16 -3.52 3.56 4.81 -1.26 -4.99 118.16 114.53 2akk n LYS 58 Ca 0.04 0.06 -0.41 0.00 -0.87 0.00 0.00 58.31 57.13 2akk n LYS 58 Cb 0.39 -0.77 -0.10 0.00 0.02 0.00 0.00 35.03 34.56 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 -2.25 5.17 -0.24 3.15 1.09 -1.26 -5.06 121.20 121.78 2akk s ILE 59 Ca -0.09 -0.46 -0.08 0.00 -1.10 0.00 0.00 60.65 58.93 2akk s ILE 59 Cb 0.01 -3.76 -0.03 0.00 -1.06 0.00 0.00 42.46 37.62 2akk s ILE 59 CO 0.13 -0.14 0.08 -1.59 -0.10 0.00 0.00 174.94 173.32 2akk s LYS 60 N 1.68 3.73 0.00 2.79 -2.85 -1.26 0.34 119.74 124.17 2akk s LYS 60 Ca 0.05 -0.44 0.00 0.00 -1.00 0.00 0.00 55.97 54.58 2akk s LYS 60 Cb -0.18 -3.35 0.00 0.00 -2.06 0.00 0.00 37.83 32.24 2akk s LYS 60 CO 0.10 -0.13 0.00 0.41 0.10 0.00 0.00 175.35 175.83 2akk n GLY 61 N 4.77 0.61 3.43 0.59 0.00 0.08 -4.95 105.19 109.72 2akk n GLY 61 Ca -0.16 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.81 2.60 -0.32 0.99 2.34 -0.01 -4.88 118.68 117.59 2akk s LEU 62 Ca 0.00 -0.26 -0.18 0.00 0.06 0.00 0.00 54.13 53.74 2akk s LEU 62 Cb 0.00 -1.52 -0.01 0.00 -0.56 0.00 0.00 46.19 44.10 2akk s LEU 62 CO 0.00 0.32 0.52 -0.69 -1.06 0.00 0.00 176.35 175.44 2akk s VAL 63 N -0.57 5.03 0.02 1.48 1.01 -1.26 -1.02 120.40 125.08 2akk s VAL 63 Ca 0.08 0.54 0.05 0.00 0.00 0.00 0.00 61.98 62.65 2akk s VAL 63 Cb -0.11 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 2akk s VAL 63 CO 0.01 -0.11 -0.14 -0.76 0.00 0.00 0.00 175.10 174.09 2akk s LEU 64 N 2.38 2.10 0.21 3.92 1.43 0.17 -4.94 118.68 123.96 2akk s LEU 64 Ca 0.20 -0.36 -0.32 0.00 -1.03 0.00 0.00 54.13 52.62 2akk s LEU 64 Cb -0.15 -0.68 -0.12 0.00 0.03 0.00 0.00 46.19 45.27 2akk s LEU 64 CO 0.12 0.11 1.69 0.00 0.23 0.00 0.00 176.35 178.50 2akk s ARG 65 N -0.75 4.13 -0.14 1.70 1.70 -1.26 -0.29 118.95 124.04 2akk s ARG 65 Ca 0.04 2.58 0.04 0.00 -0.47 0.00 0.00 55.73 57.92 2akk s ARG 65 Cb -0.07 -3.08 0.33 0.00 -0.57 0.00 0.00 34.95 31.56 2akk s ARG 65 CO 0.00 -0.72 1.19 -2.37 -1.08 0.00 0.00 175.30 172.32 2akk n THR 66 N 3.77 1.52 0.19 4.99 5.66 0.10 -3.93 114.28 126.58 2akk n THR 66 Ca 0.15 -0.70 0.11 0.00 -3.05 0.00 0.00 64.05 60.56 2akk n THR 66 Cb 0.36 -0.56 0.12 0.00 -1.55 0.00 0.00 70.33 68.70 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 1.18 0.00 -0.08 1.09 5.08 -1.87 -2.99 114.58 116.98 2akk h GLU 67 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2akk h GLU 67 Cb 1.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.68 2akk h GLU 67 CO 0.33 0.03 0.00 1.97 -1.00 0.00 0.00 179.01 180.33 2akk n PHE 68 N -3.01 0.25 -4.60 4.33 1.16 -1.25 -4.43 117.46 109.92 2akk n PHE 68 Ca 0.03 -0.85 -0.32 0.00 -1.87 0.00 0.00 57.45 54.44 2akk n PHE 68 Cb 0.55 -0.16 -0.12 0.00 -1.61 0.00 0.00 39.48 38.14 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 -2.41 2.89 -0.15 5.98 1.43 -1.17 -1.78 118.68 123.47 2akk s LEU 69 Ca 0.28 -0.26 -0.01 0.00 -1.03 0.00 0.00 54.13 53.11 2akk s LEU 69 Cb 0.23 -1.67 -0.01 0.00 0.03 0.00 0.00 46.19 44.78 2akk s LEU 69 CO 0.05 0.28 -0.11 -0.75 0.23 0.00 0.00 176.35 176.04 2akk s LYS 70 N -1.33 3.36 0.12 1.70 2.36 0.11 -1.28 119.74 124.78 2akk s LYS 70 Ca 0.15 -0.68 -0.31 0.00 -2.55 0.00 0.00 55.97 52.58 2akk s LYS 70 Cb -0.11 -2.72 -0.11 0.00 -1.05 0.00 0.00 37.83 33.85 2akk s LYS 70 CO 0.06 0.09 1.85 1.17 1.55 0.00 0.00 175.35 180.07 2akk n LYS 71 N 3.89 2.82 -2.19 4.03 0.00 -1.26 0.30 118.16 125.76 2akk n LYS 71 Ca -0.18 1.03 -0.42 0.00 0.00 0.00 0.00 58.31 58.73 2akk n LYS 71 Cb 0.52 -2.93 -0.03 0.00 0.00 0.00 0.00 35.03 32.59 2akk n LYS 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2akk s ALA 72 N 2.86 3.59 0.00 3.14 0.00 0.61 -4.73 121.76 127.24 2akk s ALA 72 Ca 0.82 0.92 0.00 0.00 0.00 0.00 0.00 51.96 53.71 2akk s ALA 72 Cb -0.47 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.04 2akk s ALA 72 CO 0.37 -0.93 0.00 0.41 0.00 0.00 0.00 175.76 175.61 2akk n GLY 73 N 3.68 3.71 0.16 0.00 0.00 -1.26 -4.94 105.19 106.54 2akk n GLY 73 Ca 0.13 -0.03 0.02 0.00 0.00 0.00 0.00 46.02 46.14 2akk n GLY 73 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76