#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dnt n SER 2 N 0.00 -3.80 -3.42 1.61 7.64 -1.26 -5.06 113.62 109.33 2dnt n SER 2 Ca 0.00 1.24 0.01 0.00 1.01 0.00 0.00 58.87 61.13 2dnt n SER 2 Cb 0.00 -4.39 -0.04 0.00 -1.01 0.00 0.00 64.21 58.77 2dnt n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dnt s SER 3 N -0.81 -0.48 0.00 6.43 0.15 -1.26 -5.15 113.70 112.59 2dnt s SER 3 Ca -0.15 0.68 0.00 0.00 0.70 0.00 0.00 55.95 57.17 2dnt s SER 3 Cb 0.01 1.49 0.00 0.00 -1.71 0.00 0.00 66.02 65.81 2dnt s SER 3 CO 0.60 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.56 2dnt n GLY 4 N 4.64 3.16 0.00 9.45 0.00 -1.26 -5.19 105.19 115.99 2dnt n GLY 4 Ca -0.11 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.71 2dnt n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dnt n SER 5 N 0.00 0.00 -3.76 1.61 2.88 -1.26 -5.19 113.62 107.90 2dnt n SER 5 Ca 0.00 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.47 2dnt n SER 5 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 2dnt n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dnt s SER 6 N 0.00 -0.29 0.00 -3.46 1.04 -1.26 -5.17 113.70 104.57 2dnt s SER 6 Ca 0.00 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 55.98 2dnt s SER 6 Cb 0.00 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.76 2dnt s SER 6 CO 0.00 -1.16 0.00 0.61 0.98 0.00 0.00 173.24 173.67 2dnt n GLY 7 N -0.44 3.37 0.00 7.32 0.00 -1.26 -5.12 105.19 109.05 2dnt n GLY 7 Ca -0.06 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.29 2dnt n GLY 7 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2dnt n MET 8 N -0.42 0.00 -3.32 1.61 2.81 -1.26 -5.09 117.12 111.45 2dnt n MET 8 Ca 0.00 0.00 0.03 0.00 -1.81 0.00 0.00 57.70 55.92 2dnt n MET 8 Cb 0.00 0.00 -0.04 0.00 -0.71 0.00 0.00 33.22 32.47 2dnt n MET 8 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2dnt s ALA 9 N 0.00 -3.00 0.00 3.04 0.00 -1.26 -5.18 121.76 115.36 2dnt s ALA 9 Ca 0.00 1.91 0.00 0.00 0.00 0.00 0.00 51.96 53.87 2dnt s ALA 9 Cb 0.00 -2.16 0.00 0.00 0.00 0.00 0.00 23.12 20.96 2dnt s ALA 9 CO 0.00 -0.88 0.00 0.43 0.00 0.00 0.00 175.76 175.31 2dnt n SER 10 N 4.51 0.00 -3.80 0.00 7.64 -1.26 -5.13 113.62 115.58 2dnt n SER 10 Ca -0.09 0.00 -0.27 0.00 1.01 0.00 0.00 58.87 59.52 2dnt n SER 10 Cb 0.55 0.00 -0.17 0.00 -1.01 0.00 0.00 64.21 63.58 2dnt n SER 10 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2dnt s GLU 11 N -1.23 0.92 0.52 1.43 2.02 -1.26 -5.14 118.70 115.97 2dnt s GLU 11 Ca 0.00 -0.35 0.06 0.00 0.02 0.00 0.00 54.97 54.71 2dnt s GLU 11 Cb 0.00 -1.83 0.03 0.00 0.10 0.00 0.00 34.13 32.43 2dnt s GLU 11 CO 0.00 -0.50 0.45 -1.21 0.02 0.00 0.00 175.26 174.02 2dnt s GLU 12 N 1.80 2.31 -0.01 1.61 2.02 -1.26 -5.05 118.70 120.11 2dnt s GLU 12 Ca 0.01 -1.88 -0.25 0.00 0.02 0.00 0.00 54.97 52.87 2dnt s GLU 12 Cb -0.15 -2.22 -0.19 0.00 0.10 0.00 0.00 34.13 31.67 2dnt s GLU 12 CO -0.07 -0.57 1.23 1.37 0.02 0.00 0.00 175.26 177.25 2dnt h LEU 13 N 0.74 -0.09 0.00 1.80 -0.00 -2.06 -3.48 115.31 112.21 2dnt h LEU 13 Ca -0.37 -0.38 0.00 0.00 -0.00 0.00 0.00 57.88 57.13 2dnt h LEU 13 Cb 1.29 0.02 0.00 0.00 -0.00 0.00 0.00 40.66 41.98 2dnt h LEU 13 CO 0.55 0.35 0.00 -1.22 -0.00 0.00 0.00 178.44 178.13 2dnt n TYR 14 N -4.93 -0.23 -4.45 0.17 4.02 -1.26 -5.18 117.16 105.30 2dnt n TYR 14 Ca -0.08 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.60 2dnt n TYR 14 Cb 0.24 0.00 -0.14 0.00 -0.02 0.00 0.00 39.34 39.42 2dnt n TYR 14 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 176.86 174.02 2dnt s GLU 15 N -1.06 1.00 -0.22 -0.72 -1.05 -1.26 -5.10 118.70 110.29 2dnt s GLU 15 Ca 0.00 -0.67 -0.29 0.00 -0.15 0.00 0.00 54.97 53.86 2dnt s GLU 15 Cb 0.00 -1.00 -0.02 0.00 -0.44 0.00 0.00 34.13 32.67 2dnt s GLU 15 CO 0.00 0.26 1.46 0.08 0.95 0.00 0.00 175.26 178.00 2dnt s VAL 16 N -0.67 3.93 -0.03 1.83 1.01 -1.26 -4.84 120.40 120.36 2dnt s VAL 16 Ca 0.03 1.07 -0.24 0.00 0.00 0.00 0.00 61.98 62.84 2dnt s VAL 16 Cb -0.07 -3.88 -0.18 0.00 0.00 0.00 0.00 36.38 32.25 2dnt s VAL 16 CO 0.01 -0.30 1.09 -0.08 0.00 0.00 0.00 175.10 175.82 2dnt h GLU 17 N 9.72 -0.16 0.00 2.72 4.81 -1.95 -3.49 114.58 126.22 2dnt h GLU 17 Ca -0.30 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 2dnt h GLU 17 Cb 1.13 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.55 2dnt h GLU 17 CO 1.00 0.29 0.00 2.89 -0.73 0.00 0.00 179.01 182.46 2dnt n ARG 18 N -4.93 0.00 -3.60 1.92 1.85 -1.26 -5.01 116.66 105.63 2dnt n ARG 18 Ca -0.08 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.41 2dnt n ARG 18 Cb 0.27 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.60 2dnt n ARG 18 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 2dnt s ILE 19 N -2.00 5.34 -0.04 8.89 -1.09 -1.26 -2.90 121.20 128.13 2dnt s ILE 19 Ca 0.00 0.42 0.12 0.00 -2.23 0.00 0.00 60.65 58.96 2dnt s ILE 19 Cb 0.00 -3.58 -0.19 0.00 -1.58 0.00 0.00 42.46 37.12 2dnt s ILE 19 CO 0.00 0.39 0.22 1.33 -1.23 0.00 0.00 174.94 175.65 2dnt n VAL 20 N 3.67 0.22 -3.84 2.92 0.24 0.18 -4.96 118.33 116.77 2dnt n VAL 20 Ca -0.13 -0.35 -0.07 0.00 -2.04 0.00 0.00 64.34 61.75 2dnt n VAL 20 Cb 0.52 -0.04 -0.01 0.00 -1.47 0.00 0.00 33.84 32.84 2dnt n VAL 20 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2dnt s ASP 21 N -3.76 -0.20 -0.22 -1.34 2.15 -1.18 -4.98 116.67 107.15 2dnt s ASP 21 Ca -0.05 -0.68 -0.20 0.00 0.43 0.00 0.00 52.55 52.05 2dnt s ASP 21 Cb 0.07 0.72 0.06 0.00 -0.30 0.00 0.00 42.92 43.46 2dnt s ASP 21 CO 0.53 -1.34 0.58 -0.75 -0.17 0.00 0.00 175.17 174.01 2dnt s LYS 22 N -3.51 0.67 0.33 4.34 2.20 -1.26 0.19 119.74 122.69 2dnt s LYS 22 Ca 0.12 0.81 -0.15 0.00 -0.36 0.00 0.00 55.97 56.40 2dnt s LYS 22 Cb -0.05 0.32 0.03 0.00 -1.51 0.00 0.00 37.83 36.61 2dnt s LYS 22 CO 0.07 -0.08 0.67 1.03 -0.36 0.00 0.00 175.35 176.68 2dnt s ARG 23 N 0.36 1.94 0.23 4.03 0.52 0.29 -4.95 118.95 121.37 2dnt s ARG 23 Ca -0.00 -1.33 0.11 0.00 -0.52 0.00 0.00 55.73 53.99 2dnt s ARG 23 Cb -0.04 0.57 -0.05 0.00 0.52 0.00 0.00 34.95 35.95 2dnt s ARG 23 CO -0.00 -0.87 -0.18 0.21 0.02 0.00 0.00 175.30 174.47 2dnt s LYS 24 N -3.18 1.72 0.52 3.54 2.20 -1.26 0.16 119.74 123.44 2dnt s LYS 24 Ca 0.18 -1.59 0.03 0.00 -0.36 0.00 0.00 55.97 54.23 2dnt s LYS 24 Cb -0.04 -1.88 0.03 0.00 -1.51 0.00 0.00 37.83 34.43 2dnt s LYS 24 CO 0.11 0.37 0.72 -0.80 -0.36 0.00 0.00 175.35 175.39 2dnt s ASN 25 N -3.13 5.37 0.45 1.43 0.01 -0.20 -4.90 114.94 113.97 2dnt s ASN 25 Ca 0.26 -0.13 0.16 0.00 -0.71 0.00 0.00 52.86 52.44 2dnt s ASN 25 Cb -0.07 -0.80 1.10 0.00 0.41 0.00 0.00 41.25 41.90 2dnt s ASN 25 CO 0.14 -1.05 1.98 0.50 -1.51 0.00 0.00 177.10 177.16 2dnt h LYS 26 N 0.22 0.32 -0.13 -0.60 3.11 -2.01 0.36 116.57 117.83 2dnt h LYS 26 Ca -0.41 -0.02 -0.12 0.00 -2.81 0.00 0.00 60.65 57.29 2dnt h LYS 26 Cb 1.29 -0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 32.44 2dnt h LYS 26 CO 0.50 0.21 -0.45 0.87 -2.81 0.00 0.00 179.45 177.77 2dnt h LYS 27 N 0.33 0.32 0.00 1.90 1.57 -2.06 -3.46 116.57 115.17 2dnt h LYS 27 Ca 0.27 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2dnt h LYS 27 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.94 2dnt h LYS 27 CO -0.07 0.71 0.00 0.41 -0.57 0.00 0.00 179.45 179.93 2dnt n GLY 28 N -0.06 1.55 3.75 3.86 0.00 0.13 -5.10 105.19 109.32 2dnt n GLY 28 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 2dnt n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dnt s LYS 29 N -0.03 4.52 -0.14 1.61 -0.14 -1.26 -4.73 119.74 119.56 2dnt s LYS 29 Ca 0.00 1.10 -0.29 0.00 -1.36 0.00 0.00 55.97 55.42 2dnt s LYS 29 Cb 0.00 -3.34 -0.01 0.00 -1.68 0.00 0.00 37.83 32.80 2dnt s LYS 29 CO 0.00 0.35 1.16 0.99 -0.76 0.00 0.00 175.35 177.09 2dnt s THR 30 N -0.30 4.43 -0.14 2.17 2.01 -1.26 -1.03 115.64 121.51 2dnt s THR 30 Ca 0.38 1.73 0.02 0.00 0.31 0.00 0.00 61.69 64.13 2dnt s THR 30 Cb -0.21 -4.11 0.01 0.00 0.01 0.00 0.00 72.50 68.20 2dnt s THR 30 CO 0.24 -0.09 -0.21 -1.61 -0.69 0.00 0.00 174.62 172.26 2dnt s GLU 31 N 2.90 2.92 -0.18 4.92 8.01 0.43 0.11 118.70 137.81 2dnt s GLU 31 Ca 0.52 -0.82 -0.04 0.00 0.01 0.00 0.00 54.97 54.64 2dnt s GLU 31 Cb -0.21 -2.37 -0.02 0.00 -4.31 0.00 0.00 34.13 27.22 2dnt s GLU 31 CO 0.15 -0.03 -0.03 0.71 0.01 0.00 0.00 175.26 176.08 2dnt s TYR 32 N 0.85 3.01 -0.32 1.61 2.02 0.90 0.10 117.35 125.53 2dnt s TYR 32 Ca -0.07 -0.47 -0.29 0.00 -0.37 0.00 0.00 57.07 55.87 2dnt s TYR 32 Cb -0.15 -2.02 -0.00 0.00 -0.40 0.00 0.00 41.96 39.38 2dnt s TYR 32 CO -0.02 -0.20 1.45 -1.17 -1.57 0.00 0.00 175.55 174.03 2dnt s LEU 33 N 0.78 3.77 0.07 -1.29 2.96 0.51 -2.80 118.68 122.69 2dnt s LEU 33 Ca -0.01 1.21 0.08 0.00 -0.22 0.00 0.00 54.13 55.18 2dnt s LEU 33 Cb -0.14 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.98 2dnt s LEU 33 CO 0.02 -1.27 -0.20 0.54 -1.32 0.00 0.00 176.35 174.11 2dnt s VAL 34 N 5.07 1.64 0.70 1.68 0.11 -1.16 0.50 120.40 128.95 2dnt s VAL 34 Ca 0.63 -1.36 -0.02 0.00 -2.93 0.00 0.00 61.98 58.31 2dnt s VAL 34 Cb -0.18 -1.47 0.11 0.00 -1.53 0.00 0.00 36.38 33.31 2dnt s VAL 34 CO 0.28 0.05 0.97 -0.13 -3.33 0.00 0.00 175.10 172.94 2dnt s ARG 35 N -1.54 1.85 0.16 1.54 0.52 -1.14 -3.50 118.95 116.83 2dnt s ARG 35 Ca 0.06 -0.92 -0.24 0.00 -0.52 0.00 0.00 55.73 54.11 2dnt s ARG 35 Cb -0.09 -2.32 0.06 0.00 0.52 0.00 0.00 34.95 33.12 2dnt s ARG 35 CO 0.03 -1.33 0.76 -1.58 0.02 0.00 0.00 175.30 173.20 2dnt s TRP 36 N -3.12 -0.33 0.35 -0.53 0.52 -1.26 -3.78 118.94 110.79 2dnt s TRP 36 Ca 0.64 0.05 -0.25 0.00 0.02 0.00 0.00 56.10 56.56 2dnt s TRP 36 Cb -0.07 0.61 -0.09 0.00 -1.15 0.00 0.00 33.47 32.77 2dnt s TRP 36 CO 0.44 -0.89 1.01 0.21 0.02 0.00 0.00 176.95 177.74 2dnt s LYS 37 N -3.58 4.40 0.00 4.98 2.20 -1.26 -3.44 119.74 123.04 2dnt s LYS 37 Ca 0.07 1.46 0.00 0.00 -0.36 0.00 0.00 55.97 57.13 2dnt s LYS 37 Cb -0.02 -2.72 0.00 0.00 -1.51 0.00 0.00 37.83 33.58 2dnt s LYS 37 CO -0.04 0.08 0.00 0.41 -0.36 0.00 0.00 175.35 175.44 2dnt n GLY 38 N 0.51 2.34 3.57 5.54 0.00 -1.26 -4.97 105.19 110.93 2dnt n GLY 38 Ca 0.03 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 2dnt n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dnt s TYR 39 N -0.77 3.12 1.07 1.61 2.02 -1.22 -5.04 117.35 118.14 2dnt s TYR 39 Ca 0.00 0.42 -0.15 0.00 -0.37 0.00 0.00 57.07 56.98 2dnt s TYR 39 Cb 0.00 -3.30 0.20 0.00 -0.40 0.00 0.00 41.96 38.46 2dnt s TYR 39 CO 0.00 -0.71 0.42 -0.25 -1.57 0.00 0.00 175.55 173.44 2dnt n ASP 40 N 6.27 -3.16 0.03 2.29 8.00 -1.26 -4.55 116.55 124.17 2dnt n ASP 40 Ca 0.01 -0.46 -0.03 0.00 0.71 0.00 0.00 54.79 55.03 2dnt n ASP 40 Cb 0.48 -0.81 0.22 0.00 -0.02 0.00 0.00 41.12 41.00 2dnt n ASP 40 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 2dnt h SER 41 N -2.84 0.43 -0.25 -2.24 0.87 -1.96 -1.64 113.55 105.92 2dnt h SER 41 Ca -0.27 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 2dnt h SER 41 Cb 0.84 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.69 2dnt h SER 41 CO 0.17 0.69 0.00 -0.62 -0.53 0.00 0.00 176.83 176.54 2dnt n GLU 42 N -4.12 1.76 0.00 2.24 1.02 -1.26 -3.29 120.64 117.00 2dnt n GLU 42 Ca -0.01 -1.17 0.06 0.00 -0.02 0.00 0.00 57.16 56.03 2dnt n GLU 42 Cb 0.41 -1.34 -0.05 0.00 -0.02 0.00 0.00 31.44 30.43 2dnt n GLU 42 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2dnt n ASP 43 N 0.41 0.90 -4.08 1.62 9.92 -0.65 -5.02 116.55 119.65 2dnt n ASP 43 Ca 0.14 -0.95 -0.37 0.00 -0.53 0.00 0.00 54.79 53.08 2dnt n ASP 43 Cb 0.31 0.82 0.03 0.00 -0.64 0.00 0.00 41.12 41.65 2dnt n ASP 43 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2dnt n ASP 44 N -0.93 -5.29 -4.46 -2.24 8.00 -1.04 -4.81 116.55 105.78 2dnt n ASP 44 Ca 0.04 0.33 -0.23 0.00 0.71 0.00 0.00 54.79 55.64 2dnt n ASP 44 Cb 0.23 -0.79 -0.10 0.00 -0.02 0.00 0.00 41.12 40.44 2dnt n ASP 44 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2dnt s THR 45 N -2.00 2.11 -0.46 -3.53 -4.23 -1.23 -5.05 115.64 101.25 2dnt s THR 45 Ca 0.45 -2.26 -0.09 0.00 -1.18 0.00 0.00 61.69 58.61 2dnt s THR 45 Cb -0.28 -2.38 0.11 0.00 1.34 0.00 0.00 72.50 71.29 2dnt s THR 45 CO 0.78 -0.36 0.32 0.26 -0.54 0.00 0.00 174.62 175.07 2dnt s TRP 46 N -2.73 3.41 0.15 3.99 0.52 -1.26 -2.97 118.94 120.05 2dnt s TRP 46 Ca 0.29 -1.79 -0.06 0.00 0.02 0.00 0.00 56.10 54.55 2dnt s TRP 46 Cb -0.00 -3.35 -0.06 0.00 -1.15 0.00 0.00 33.47 28.91 2dnt s TRP 46 CO 0.13 -0.95 0.41 -1.21 0.02 0.00 0.00 176.95 175.34 2dnt s GLU 47 N 1.37 3.67 0.69 4.98 0.41 -1.12 -4.89 118.70 123.81 2dnt s GLU 47 Ca 0.05 0.01 -0.11 0.00 -0.41 0.00 0.00 54.97 54.51 2dnt s GLU 47 Cb -0.25 -2.84 0.00 0.00 -1.78 0.00 0.00 34.13 29.26 2dnt s GLU 47 CO -0.00 0.46 1.06 -1.25 -0.49 0.00 0.00 175.26 175.04 2dnt s PRO 48 N -2.57 2.97 0.31 0.39 0.04 -1.26 -0.07 135.00 134.81 2dnt s PRO 48 Ca 0.41 0.97 0.15 0.00 0.04 0.00 0.00 61.00 62.56 2dnt s PRO 48 Cb -0.12 -1.99 0.44 0.00 0.04 0.00 0.00 34.50 32.87 2dnt s PRO 48 CO 0.23 -1.08 1.63 1.49 0.04 0.00 0.00 177.00 179.31 2dnt h GLU 49 N -0.64 0.00 0.00 4.56 4.81 0.45 -2.22 114.58 121.53 2dnt h GLU 49 Ca -0.44 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.73 2dnt h GLU 49 Cb 1.21 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 2dnt h GLU 49 CO 0.57 0.52 -0.30 0.37 -0.73 0.00 0.00 179.01 179.43 2dnt h GLN 50 N 0.00 0.00 0.00 1.92 4.15 -1.93 -2.87 115.11 116.38 2dnt h GLN 50 Ca -0.01 0.00 -0.22 0.00 0.77 0.00 0.00 58.65 59.19 2dnt h GLN 50 Cb 1.08 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.73 2dnt h GLN 50 CO 0.07 0.30 -1.29 0.45 -1.93 0.00 0.00 178.83 176.43 2dnt h HIS 51 N 0.00 0.00 0.00 3.99 3.86 -1.88 -3.37 115.15 117.75 2dnt h HIS 51 Ca -0.00 0.00 -0.65 0.00 -1.16 0.00 0.00 60.37 58.56 2dnt h HIS 51 Cb 0.87 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.34 2dnt h HIS 51 CO 0.00 0.86 3.43 1.28 0.86 0.00 0.00 177.93 184.36 2dnt n LEU 52 N -3.13 7.53 -4.81 2.43 4.77 -0.86 -4.91 117.00 118.02 2dnt n LEU 52 Ca -0.08 -4.06 -0.38 0.00 -0.03 0.00 0.00 56.01 51.46 2dnt n LEU 52 Cb 0.94 -1.52 -0.06 0.00 -2.33 0.00 0.00 43.42 40.45 2dnt n LEU 52 CO 0.45 1.49 0.30 -0.69 -1.33 0.00 0.00 177.39 177.61 2dnt s VAL 53 N 2.78 4.70 -0.56 4.08 1.01 -1.26 -3.57 120.40 127.58 2dnt s VAL 53 Ca 0.59 1.22 0.00 0.00 0.00 0.00 0.00 61.98 63.79 2dnt s VAL 53 Cb 0.16 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.64 2dnt s VAL 53 CO -0.06 0.47 0.00 0.59 0.00 0.00 0.00 175.10 176.10 2dnt n ASN 54 N 1.46 -5.24 0.00 3.32 3.02 -1.26 -4.72 115.26 111.84 2dnt n ASN 54 Ca -0.08 0.13 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 2dnt n ASN 54 Cb 0.51 -3.20 0.00 0.00 -0.61 0.00 0.00 39.78 36.47 2dnt n ASN 54 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dnt h GLU 56 N 0.00 0.00 -0.14 0.00 5.08 -1.85 -2.73 114.58 114.95 2dnt h GLU 56 Ca 0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2dnt h GLU 56 Cb 0.51 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 2dnt h GLU 56 CO 0.00 0.00 -0.14 1.49 -1.00 0.00 0.00 179.01 179.36 2dnt h GLU 57 N 0.00 -0.08 -0.37 2.33 4.81 -1.94 0.58 114.58 119.91 2dnt h GLU 57 Ca 0.22 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.53 2dnt h GLU 57 Cb 0.96 0.02 -0.09 0.00 0.63 0.00 0.00 28.75 30.27 2dnt h GLU 57 CO -0.00 -0.05 -0.27 1.88 -0.73 0.00 0.00 179.01 179.84 2dnt h TYR 58 N -0.08 -0.72 -0.76 0.92 0.05 -1.88 0.97 116.97 115.47 2dnt h TYR 58 Ca 0.02 0.05 0.17 0.00 0.05 0.00 0.00 58.73 59.03 2dnt h TYR 58 Cb 0.14 0.37 -0.12 0.00 1.01 0.00 0.00 36.73 38.14 2dnt h TYR 58 CO -0.70 -0.34 0.16 0.82 -1.05 0.00 0.00 178.16 177.05 2dnt h ILE 59 N -0.21 0.45 -0.44 -2.88 2.04 -1.35 0.83 117.51 115.94 2dnt h ILE 59 Ca 0.18 -0.08 0.01 0.00 1.00 0.00 0.00 64.86 65.97 2dnt h ILE 59 Cb 0.49 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 2dnt h ILE 59 CO -0.49 0.04 0.28 0.45 0.00 0.00 0.00 178.15 178.43 2dnt h HIS 60 N 0.23 0.53 -0.51 1.37 3.86 0.24 0.34 115.15 121.21 2dnt h HIS 60 Ca 0.44 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.62 2dnt h HIS 60 Cb 0.78 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 29.05 2dnt h HIS 60 CO -0.29 0.32 0.15 0.22 0.86 0.00 0.00 177.93 179.20 2dnt h ASP 61 N 0.57 0.70 0.83 2.45 1.82 0.15 1.02 116.42 123.96 2dnt h ASP 61 Ca 0.17 -0.10 -0.08 0.00 -0.39 0.00 0.00 57.03 56.62 2dnt h ASP 61 Cb -0.04 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 39.78 2dnt h ASP 61 CO -0.05 0.67 -0.39 0.15 -1.61 0.00 0.00 179.24 178.00 2dnt h PHE 62 N 0.74 0.00 0.01 0.28 3.57 0.15 0.94 116.94 122.64 2dnt h PHE 62 Ca 0.17 0.00 -0.29 0.00 3.53 0.00 0.00 57.97 61.38 2dnt h PHE 62 Cb 0.23 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.92 2dnt h PHE 62 CO 0.01 0.39 -1.64 -0.91 -2.23 0.00 0.00 178.31 173.94 2dnt h ASN 63 N 0.00 0.05 0.97 0.41 2.35 0.73 -3.35 115.58 116.75 2dnt h ASN 63 Ca -0.00 -0.09 -0.17 0.00 -0.55 0.00 0.00 56.30 55.48 2dnt h ASN 63 Cb 0.91 -0.02 -0.03 0.00 0.05 0.00 0.00 38.32 39.23 2dnt h ASN 63 CO 0.05 1.08 -1.10 0.08 -1.65 0.00 0.00 177.43 175.90 2dnt h ARG 64 N 0.01 0.00 -0.44 0.81 -0.00 0.12 -2.97 114.38 111.91 2dnt h ARG 64 Ca -0.26 0.00 0.06 0.00 -0.00 0.00 0.00 59.98 59.78 2dnt h ARG 64 Cb 1.99 0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 31.91 2dnt h ARG 64 CO 0.09 0.52 0.15 0.00 -0.00 0.00 0.00 179.97 180.73 2dnt h ARG 65 N 0.00 0.31 0.09 0.08 2.47 0.80 -3.24 114.38 114.88 2dnt h ARG 65 Ca -0.10 -0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 58.59 2dnt h ARG 65 Cb 1.62 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.87 2dnt h ARG 65 CO 0.07 0.20 -0.04 1.25 0.56 0.00 0.00 179.97 182.01 2dnt h HIS 66 N 0.32 -0.11 -3.76 3.04 2.76 -1.69 -3.44 115.15 112.27 2dnt h HIS 66 Ca 0.21 -0.00 -0.63 0.00 -2.20 0.00 0.00 60.37 57.74 2dnt h HIS 66 Cb 0.20 0.04 -0.15 0.00 1.55 0.00 0.00 27.41 29.05 2dnt h HIS 66 CO -0.16 -0.07 -0.31 0.99 -1.30 0.00 0.00 177.93 177.09 2dnt s THR 67 N -1.83 5.20 0.40 6.26 2.01 -1.12 -5.04 115.64 121.52 2dnt s THR 67 Ca -0.02 0.42 -0.26 0.00 0.31 0.00 0.00 61.69 62.15 2dnt s THR 67 Cb 0.00 -3.68 -0.11 0.00 0.01 0.00 0.00 72.50 68.73 2dnt s THR 67 CO 0.05 0.15 1.19 -0.62 -0.69 0.00 0.00 174.62 174.70 2dnt n GLU 68 N 5.28 1.76 0.17 4.92 1.02 -1.23 -3.98 120.64 128.58 2dnt n GLU 68 Ca -0.10 0.63 0.00 0.00 -0.02 0.00 0.00 57.16 57.67 2dnt n GLU 68 Cb 0.51 -2.25 0.00 0.00 -0.02 0.00 0.00 31.44 29.68 2dnt n GLU 68 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2dnt n LYS 69 N 0.20 0.00 0.00 3.49 0.00 -1.26 -5.01 118.16 115.57 2dnt n LYS 69 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.38 2dnt n LYS 69 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.41 2dnt n LYS 69 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 2dnt n GLN 70 N -3.31 0.00 -1.13 1.64 6.02 -1.26 -4.84 117.38 114.50 2dnt n GLN 70 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2dnt n GLN 70 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 2dnt n GLN 70 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 2dnt n LYS 71 N 0.00 -3.11 -2.51 -1.09 0.00 -1.26 -4.99 118.16 105.20 2dnt n LYS 71 Ca 0.00 2.36 -0.04 0.00 0.00 0.00 0.00 58.31 60.63 2dnt n LYS 71 Cb 0.00 -2.78 -0.03 0.00 0.00 0.00 0.00 35.03 32.22 2dnt n LYS 71 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2dnt n GLU 72 N -1.52 -4.88 -1.57 1.64 2.13 -1.26 -4.85 120.64 110.33 2dnt n GLU 72 Ca 0.00 3.61 -0.43 0.00 0.66 0.00 0.00 57.16 61.01 2dnt n GLU 72 Cb 0.15 -4.98 -0.00 0.00 0.27 0.00 0.00 31.44 26.88 2dnt n GLU 72 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2dnt n SER 73 N 1.77 0.83 -4.89 4.31 3.41 -1.26 -4.96 113.62 112.83 2dnt n SER 73 Ca -0.28 1.08 -0.29 0.00 -0.26 0.00 0.00 58.87 59.13 2dnt n SER 73 Cb 0.43 -1.27 -0.01 0.00 -0.26 0.00 0.00 64.21 63.10 2dnt n SER 73 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dnt s GLY 74 N -0.71 1.63 0.99 5.00 0.00 -1.26 -5.08 107.32 107.89 2dnt s GLY 74 Ca 0.61 -0.36 -0.15 0.00 0.00 0.00 0.00 44.72 44.82 2dnt s GLY 74 CO 0.58 -0.17 1.18 2.56 0.00 0.00 0.00 173.10 177.25 2dnt s PRO 75 N -4.61 0.49 0.26 2.90 0.04 -1.26 -5.03 135.00 127.80 2dnt s PRO 75 Ca 0.50 0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.58 2dnt s PRO 75 Cb -0.10 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.65 2dnt s PRO 75 CO 0.43 -2.59 0.00 0.45 0.04 0.00 0.00 177.00 175.34 2dnt n SER 76 N -3.99 -0.48 -4.72 6.66 2.88 -1.26 -5.07 113.62 107.63 2dnt n SER 76 Ca 0.10 0.46 -0.64 0.00 -1.33 0.00 0.00 58.87 57.46 2dnt n SER 76 Cb 0.59 0.65 -0.09 0.00 -0.75 0.00 0.00 64.21 64.61 2dnt n SER 76 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dnt n SER 77 N -3.33 1.62 0.00 -3.46 3.41 -1.26 -5.39 113.62 105.22 2dnt n SER 77 Ca 0.00 1.13 0.00 0.00 -0.26 0.00 0.00 58.87 59.74 2dnt n SER 77 Cb 0.00 -0.98 0.00 0.00 -0.26 0.00 0.00 64.21 62.97 2dnt n SER 77 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49