#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dnt s SER 2 N 0.00 5.03 -0.37 1.61 1.04 -1.26 -5.06 113.70 114.70 2dnt s SER 2 Ca 0.00 -0.77 -0.02 0.00 0.48 0.00 0.00 55.95 55.63 2dnt s SER 2 Cb 0.00 -1.85 0.09 0.00 0.10 0.00 0.00 66.02 64.36 2dnt s SER 2 CO 0.00 -0.20 0.13 -0.94 0.98 0.00 0.00 173.24 173.21 2dnt s SER 3 N 1.47 5.13 0.00 7.02 1.04 -1.26 -4.88 113.70 122.22 2dnt s SER 3 Ca 0.02 -1.76 0.00 0.00 0.48 0.00 0.00 55.95 54.69 2dnt s SER 3 Cb -0.17 -1.79 0.00 0.00 0.10 0.00 0.00 66.02 64.16 2dnt s SER 3 CO 0.02 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 174.41 2dnt n GLY 4 N 4.60 -1.69 3.45 7.32 0.00 -1.26 -5.11 105.19 112.49 2dnt n GLY 4 Ca -0.06 0.72 -0.33 0.00 0.00 0.00 0.00 46.02 46.35 2dnt n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dnt s SER 5 N 0.00 4.51 0.57 1.61 1.04 -1.26 -5.10 113.70 115.07 2dnt s SER 5 Ca 0.00 -0.20 -0.20 0.00 0.48 0.00 0.00 55.95 56.03 2dnt s SER 5 Cb 0.00 -1.72 -0.05 0.00 0.10 0.00 0.00 66.02 64.36 2dnt s SER 5 CO 0.00 0.17 1.20 -0.55 0.98 0.00 0.00 173.24 175.04 2dnt s SER 6 N 0.36 5.39 -0.30 7.02 0.15 -1.26 -5.03 113.70 120.03 2dnt s SER 6 Ca -0.07 2.37 -0.03 0.00 0.70 0.00 0.00 55.95 58.93 2dnt s SER 6 Cb -0.15 -2.60 0.18 0.00 -1.71 0.00 0.00 66.02 61.74 2dnt s SER 6 CO 0.04 -1.45 0.60 -0.83 1.20 0.00 0.00 173.24 172.80 2dnt s GLY 7 N -1.55 -0.93 -0.24 9.45 0.00 -1.26 -5.03 107.32 107.76 2dnt s GLY 7 Ca 0.75 1.93 -0.11 0.00 0.00 0.00 0.00 44.72 47.28 2dnt s GLY 7 CO 0.33 3.29 0.24 1.03 0.00 0.00 0.00 173.10 177.99 2dnt n MET 8 N 5.43 -1.77 0.01 2.90 2.00 -1.26 -4.99 117.12 119.44 2dnt n MET 8 Ca -0.03 1.63 -0.00 0.00 0.00 0.00 0.00 57.70 59.30 2dnt n MET 8 Cb 0.51 -3.02 -0.00 0.00 0.00 0.00 0.00 33.22 30.70 2dnt n MET 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2dnt n ALA 9 N 0.59 2.99 -2.96 3.04 0.00 -1.26 -5.10 120.51 117.80 2dnt n ALA 9 Ca -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 2dnt n ALA 9 Cb 0.41 0.05 -0.00 0.00 0.00 0.00 0.00 19.45 19.91 2dnt n ALA 9 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2dnt n SER 10 N -2.71 -7.23 -3.04 0.00 2.88 -1.26 -4.33 113.62 97.92 2dnt n SER 10 Ca -0.00 0.91 -0.00 0.00 -1.33 0.00 0.00 58.87 58.45 2dnt n SER 10 Cb 0.00 -3.42 -0.00 0.00 -0.75 0.00 0.00 64.21 60.04 2dnt n SER 10 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2dnt n GLU 11 N 1.03 -1.38 -4.09 -1.46 1.02 -1.26 -4.98 120.64 109.52 2dnt n GLU 11 Ca -0.00 1.42 -0.23 0.00 -0.02 0.00 0.00 57.16 58.32 2dnt n GLU 11 Cb 0.26 -1.91 -0.05 0.00 -0.02 0.00 0.00 31.44 29.72 2dnt n GLU 11 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2dnt s GLU 12 N -0.79 2.96 0.00 3.49 2.02 -1.26 -5.06 118.70 120.07 2dnt s GLU 12 Ca -0.02 -0.96 0.00 0.00 0.02 0.00 0.00 54.97 54.01 2dnt s GLU 12 Cb 0.00 -2.62 0.00 0.00 0.10 0.00 0.00 34.13 31.61 2dnt s GLU 12 CO 0.18 0.44 0.83 1.47 0.02 0.00 0.00 175.26 178.20 2dnt n LEU 13 N -0.89 0.00 -3.64 1.80 -0.00 -1.26 -4.86 117.00 108.15 2dnt n LEU 13 Ca -0.08 0.83 -0.09 0.00 -0.00 0.00 0.00 56.01 56.66 2dnt n LEU 13 Cb 0.57 -0.33 -0.07 0.00 -0.00 0.00 0.00 43.42 43.59 2dnt n LEU 13 CO 0.43 -0.33 0.37 -0.31 -0.00 0.00 0.00 177.39 177.55 2dnt s TYR 14 N -2.32 -0.97 -0.16 1.47 2.02 -1.26 -5.04 117.35 111.10 2dnt s TYR 14 Ca 0.00 2.05 -0.13 0.00 -0.37 0.00 0.00 57.07 58.63 2dnt s TYR 14 Cb 0.00 0.51 -0.05 0.00 -0.40 0.00 0.00 41.96 42.02 2dnt s TYR 14 CO 0.00 -0.48 0.26 -2.00 -1.57 0.00 0.00 175.55 171.76 2dnt s GLU 15 N 1.20 4.17 -0.04 -0.62 2.12 -1.26 -5.02 118.70 119.25 2dnt s GLU 15 Ca -0.07 0.04 -0.33 0.00 0.36 0.00 0.00 54.97 54.98 2dnt s GLU 15 Cb -0.05 -3.40 -0.11 0.00 0.26 0.00 0.00 34.13 30.83 2dnt s GLU 15 CO -0.13 0.31 1.89 0.28 -0.54 0.00 0.00 175.26 177.08 2dnt n VAL 16 N 3.35 0.60 -0.07 3.70 0.31 -1.26 -4.85 118.33 120.11 2dnt n VAL 16 Ca -0.13 -0.11 -0.12 0.00 -0.01 0.00 0.00 64.34 63.97 2dnt n VAL 16 Cb 0.52 -1.98 -0.11 0.00 -0.91 0.00 0.00 33.84 31.36 2dnt n VAL 16 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2dnt h GLU 17 N 9.40 0.00 0.00 5.55 4.81 -1.95 -3.50 114.58 128.89 2dnt h GLU 17 Ca -0.49 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2dnt h GLU 17 Cb 1.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 2dnt h GLU 17 CO 0.94 0.86 0.00 2.89 -0.73 0.00 0.00 179.01 182.97 2dnt n ARG 18 N -4.63 0.00 -3.64 1.92 1.85 -1.26 -5.01 116.66 105.89 2dnt n ARG 18 Ca -0.09 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.39 2dnt n ARG 18 Cb 0.42 0.00 -0.07 0.00 -1.05 0.00 0.00 32.46 31.76 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 -0.19 8.89 -1.09 -1.26 -2.96 121.20 127.93 2dnt s ILE 19 Ca 0.00 0.42 0.08 0.00 -2.23 0.00 0.00 60.65 58.92 2dnt s ILE 19 Cb 0.00 -3.56 -0.10 0.00 -1.58 0.00 0.00 42.46 37.22 2dnt s ILE 19 CO 0.00 0.46 0.25 1.33 -1.23 0.00 0.00 174.94 175.75 2dnt n VAL 20 N 3.14 0.00 -3.73 2.92 0.24 0.28 -4.96 118.33 116.21 2dnt n VAL 20 Ca -0.14 -0.25 -0.02 0.00 -2.04 0.00 0.00 64.34 61.88 2dnt n VAL 20 Cb 0.52 0.66 -0.01 0.00 -1.47 0.00 0.00 33.84 33.54 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 -2.33 -0.15 -0.27 -1.34 2.15 -1.19 -4.96 116.67 108.58 2dnt s ASP 21 Ca -0.00 -0.36 -0.23 0.00 0.43 0.00 0.00 52.55 52.39 2dnt s ASP 21 Cb 0.05 0.43 0.08 0.00 -0.30 0.00 0.00 42.92 43.19 2dnt s ASP 21 CO 0.32 -0.79 0.77 -0.75 -0.17 0.00 0.00 175.17 174.55 2dnt s LYS 22 N -3.13 0.74 0.33 4.34 2.20 -1.26 0.19 119.74 123.16 2dnt s LYS 22 Ca 0.13 0.97 -0.18 0.00 -0.36 0.00 0.00 55.97 56.53 2dnt s LYS 22 Cb -0.00 0.32 0.04 0.00 -1.51 0.00 0.00 37.83 36.67 2dnt s LYS 22 CO 0.01 -0.10 0.74 0.50 -0.36 0.00 0.00 175.35 176.14 2dnt s ARG 23 N 0.66 2.01 0.08 4.03 3.52 0.19 -4.97 118.95 124.47 2dnt s ARG 23 Ca -0.02 -1.24 0.03 0.00 -0.13 0.00 0.00 55.73 54.37 2dnt s ARG 23 Cb -0.05 0.61 -0.04 0.00 -1.56 0.00 0.00 34.95 33.91 2dnt s ARG 23 CO -0.05 -0.93 0.09 0.21 -0.81 0.00 0.00 175.30 173.81 2dnt s LYS 24 N -3.09 2.91 0.45 5.12 2.20 -1.26 0.18 119.74 126.25 2dnt s LYS 24 Ca 0.14 -0.67 -0.09 0.00 -0.36 0.00 0.00 55.97 54.98 2dnt s LYS 24 Cb -0.05 -2.75 -0.06 0.00 -1.51 0.00 0.00 37.83 33.47 2dnt s LYS 24 CO 0.10 0.57 0.80 -0.80 -0.36 0.00 0.00 175.35 175.66 2dnt s ASN 25 N -2.39 6.44 0.65 1.43 0.01 0.50 -4.87 114.94 116.71 2dnt s ASN 25 Ca 0.30 1.12 0.30 0.00 -0.71 0.00 0.00 52.86 53.87 2dnt s ASN 25 Cb -0.12 -2.32 1.63 0.00 0.41 0.00 0.00 41.25 40.84 2dnt s ASN 25 CO 0.22 -0.49 1.94 0.07 -1.51 0.00 0.00 177.10 177.33 2dnt h LYS 26 N 0.85 0.00 0.03 -0.60 -0.00 -2.00 1.21 116.57 116.06 2dnt h LYS 26 Ca -0.47 0.00 -0.22 0.00 -0.00 0.00 0.00 60.65 59.96 2dnt h LYS 26 Cb 1.19 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 33.40 2dnt h LYS 26 CO 0.63 0.00 -1.04 0.87 -0.00 0.00 0.00 179.45 179.91 2dnt h LYS 27 N 0.00 0.07 0.00 0.07 1.57 -2.05 -3.47 116.57 112.76 2dnt h LYS 27 Ca 0.04 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2dnt h LYS 27 Cb 0.72 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.07 2dnt h LYS 27 CO -0.00 1.04 0.00 0.41 -0.57 0.00 0.00 179.45 180.33 2dnt n GLY 28 N 1.35 1.78 3.87 3.86 0.00 0.42 -5.12 105.19 111.34 2dnt n GLY 28 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.05 3.41 -0.13 1.61 -0.14 -1.24 -4.76 119.74 118.44 2dnt s LYS 29 Ca 0.00 -0.15 -0.28 0.00 -1.36 0.00 0.00 55.97 54.18 2dnt s LYS 29 Cb 0.00 -3.17 -0.01 0.00 -1.68 0.00 0.00 37.83 32.97 2dnt s LYS 29 CO 0.00 0.77 0.94 0.99 -0.76 0.00 0.00 175.35 177.30 2dnt s THR 30 N -1.02 4.82 -0.07 2.17 2.01 -1.26 0.19 115.64 122.48 2dnt s THR 30 Ca 0.15 1.90 0.04 0.00 0.31 0.00 0.00 61.69 64.09 2dnt s THR 30 Cb -0.12 -4.25 -0.00 0.00 0.01 0.00 0.00 72.50 68.14 2dnt s THR 30 CO 0.04 0.01 -0.21 -1.61 -0.69 0.00 0.00 174.62 172.16 2dnt s GLU 31 N 2.05 2.46 -0.14 4.92 8.01 0.49 -1.52 118.70 134.96 2dnt s GLU 31 Ca 0.45 -0.77 -0.01 0.00 0.01 0.00 0.00 54.97 54.65 2dnt s GLU 31 Cb -0.18 -1.98 -0.02 0.00 -4.31 0.00 0.00 34.13 27.64 2dnt s GLU 31 CO 0.16 0.24 -0.12 0.71 0.01 0.00 0.00 175.26 176.26 2dnt s TYR 32 N 0.16 2.84 -0.44 1.61 2.02 0.20 0.56 117.35 124.32 2dnt s TYR 32 Ca -0.10 -0.61 -0.29 0.00 -0.37 0.00 0.00 57.07 55.69 2dnt s TYR 32 Cb -0.15 -1.87 0.01 0.00 -0.40 0.00 0.00 41.96 39.55 2dnt s TYR 32 CO 0.05 -0.20 1.37 -1.17 -1.57 0.00 0.00 175.55 174.03 2dnt s LEU 33 N 0.40 3.57 0.04 -1.29 2.96 0.50 -1.93 118.68 122.93 2dnt s LEU 33 Ca -0.09 0.72 0.07 0.00 -0.22 0.00 0.00 54.13 54.61 2dnt s LEU 33 Cb -0.16 -3.50 -0.02 0.00 0.50 0.00 0.00 46.19 43.01 2dnt s LEU 33 CO 0.05 -1.44 -0.20 0.54 -1.32 0.00 0.00 176.35 173.98 2dnt s VAL 34 N 5.36 1.64 0.70 1.68 0.11 -1.10 0.99 120.40 129.77 2dnt s VAL 34 Ca 0.59 -1.16 -0.04 0.00 -2.93 0.00 0.00 61.98 58.43 2dnt s VAL 34 Cb -0.12 -1.42 0.09 0.00 -1.53 0.00 0.00 36.38 33.39 2dnt s VAL 34 CO 0.32 0.22 0.99 -0.13 -3.33 0.00 0.00 175.10 173.17 2dnt s ARG 35 N -1.11 1.96 0.10 1.54 0.52 -1.16 -3.29 118.95 117.52 2dnt s ARG 35 Ca 0.07 -0.61 -0.25 0.00 -0.52 0.00 0.00 55.73 54.42 2dnt s ARG 35 Cb -0.09 -2.24 0.08 0.00 0.52 0.00 0.00 34.95 33.22 2dnt s ARG 35 CO 0.02 -1.31 0.69 -1.58 0.02 0.00 0.00 175.30 173.13 2dnt s TRP 36 N -3.19 -0.49 0.39 -0.53 0.52 -1.26 -3.74 118.94 110.64 2dnt s TRP 36 Ca 0.63 0.35 -0.27 0.00 0.02 0.00 0.00 56.10 56.82 2dnt s TRP 36 Cb -0.08 0.54 -0.10 0.00 -1.15 0.00 0.00 33.47 32.68 2dnt s TRP 36 CO 0.44 -0.75 1.43 0.15 0.02 0.00 0.00 176.95 178.24 2dnt s LYS 37 N -3.39 4.02 0.00 4.98 1.02 -1.26 -2.12 119.74 122.98 2dnt s LYS 37 Ca 0.01 2.45 0.00 0.00 0.02 0.00 0.00 55.97 58.45 2dnt s LYS 37 Cb -0.01 -2.88 0.00 0.00 -0.52 0.00 0.00 37.83 34.42 2dnt s LYS 37 CO -0.10 -0.55 0.00 0.41 -0.92 0.00 0.00 175.35 174.18 2dnt n GLY 38 N 0.55 2.10 3.60 -3.33 0.00 -1.26 -4.96 105.19 101.89 2dnt n GLY 38 Ca 0.02 -0.37 -0.43 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.59 2.99 1.47 1.61 2.02 -0.90 -5.02 117.35 118.92 2dnt s TYR 39 Ca 0.00 0.78 -0.24 0.00 -0.37 0.00 0.00 57.07 57.24 2dnt s TYR 39 Cb 0.00 -3.95 0.38 0.00 -0.40 0.00 0.00 41.96 37.99 2dnt s TYR 39 CO 0.00 -1.00 0.91 -0.51 -1.57 0.00 0.00 175.55 173.38 2dnt s ASP 40 N 2.07 -1.46 0.21 2.29 1.01 -1.26 -4.41 116.67 115.12 2dnt s ASP 40 Ca 0.43 0.78 -0.09 0.00 0.71 0.00 0.00 52.55 54.38 2dnt s ASP 40 Cb -0.10 -1.08 0.16 0.00 1.01 0.00 0.00 42.92 42.91 2dnt s ASP 40 CO 0.23 -5.60 1.84 0.77 0.21 0.00 0.00 175.17 172.63 2dnt h SER 41 N -3.58 0.96 -0.31 0.27 4.64 -1.96 -0.15 113.55 113.43 2dnt h SER 41 Ca -0.41 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2dnt h SER 41 Cb 1.34 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2dnt h SER 41 CO 0.25 0.76 0.00 -0.62 -0.87 0.00 0.00 176.83 176.35 2dnt n GLU 42 N -4.45 1.75 -0.00 4.77 -0.58 -1.26 -3.22 120.64 117.65 2dnt n GLU 42 Ca 0.07 -1.12 0.06 0.00 -0.42 0.00 0.00 57.16 55.76 2dnt n GLU 42 Cb 0.07 -1.27 -0.08 0.00 -0.57 0.00 0.00 31.44 29.60 2dnt n GLU 42 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2dnt n ASP 43 N 0.39 1.32 -4.29 1.62 -0.08 -0.15 -5.02 116.55 110.34 2dnt n ASP 43 Ca 0.10 -0.42 -0.41 0.00 -1.51 0.00 0.00 54.79 52.56 2dnt n ASP 43 Cb 0.28 1.26 0.00 0.00 2.34 0.00 0.00 41.12 45.00 2dnt n ASP 43 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 2dnt n ASP 44 N -1.58 -3.10 -4.85 1.67 5.68 -0.70 -4.76 116.55 108.91 2dnt n ASP 44 Ca 0.00 0.75 -0.29 0.00 -0.50 0.00 0.00 54.79 54.75 2dnt n ASP 44 Cb 0.25 -0.88 -0.03 0.00 -1.14 0.00 0.00 41.12 39.31 2dnt n ASP 44 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 2dnt s THR 45 N -1.80 1.44 -0.19 2.12 -4.23 -1.21 -5.01 115.64 106.77 2dnt s THR 45 Ca 0.59 -1.69 -0.00 0.00 -1.18 0.00 0.00 61.69 59.40 2dnt s THR 45 Cb -0.58 -2.13 0.01 0.00 1.34 0.00 0.00 72.50 71.14 2dnt s THR 45 CO 0.64 0.00 -0.17 0.26 -0.54 0.00 0.00 174.62 174.81 2dnt s TRP 46 N -2.82 2.82 -0.05 3.99 0.52 -1.26 -2.72 118.94 119.42 2dnt s TRP 46 Ca 0.22 -1.48 0.06 0.00 0.02 0.00 0.00 56.10 54.92 2dnt s TRP 46 Cb -0.01 -1.96 -0.02 0.00 -1.15 0.00 0.00 33.47 30.34 2dnt s TRP 46 CO 0.14 -0.74 -0.23 -1.21 0.02 0.00 0.00 176.95 174.93 2dnt s GLU 47 N 1.31 2.42 0.19 4.98 0.41 -0.81 -4.89 118.70 122.31 2dnt s GLU 47 Ca 0.05 -0.86 -0.30 0.00 -0.41 0.00 0.00 54.97 53.45 2dnt s GLU 47 Cb -0.13 -2.19 -0.08 0.00 -1.78 0.00 0.00 34.13 29.95 2dnt s GLU 47 CO -0.10 0.49 1.11 -1.25 -0.49 0.00 0.00 175.26 175.02 2dnt s PRO 48 N -0.42 4.59 0.55 0.39 0.04 -1.26 0.62 135.00 139.51 2dnt s PRO 48 Ca 0.04 1.75 0.49 0.00 0.04 0.00 0.00 61.00 63.32 2dnt s PRO 48 Cb -0.12 -3.26 1.72 0.00 0.04 0.00 0.00 34.50 32.88 2dnt s PRO 48 CO 0.01 0.07 1.57 1.49 0.04 0.00 0.00 177.00 180.19 2dnt h GLU 49 N 4.96 0.00 -0.12 4.56 4.22 -1.62 1.47 114.58 128.04 2dnt h GLU 49 Ca -0.45 -0.00 0.00 0.00 0.08 0.00 0.00 59.36 58.99 2dnt h GLU 49 Cb 1.21 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 2dnt h GLU 49 CO 0.72 0.00 0.08 0.37 -2.18 0.00 0.00 179.01 178.00 2dnt h GLN 50 N 0.00 0.16 0.00 1.92 4.15 -1.90 -1.69 115.11 117.75 2dnt h GLN 50 Ca 0.94 -0.01 -0.05 0.00 0.77 0.00 0.00 58.65 60.30 2dnt h GLN 50 Cb 3.71 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 31.36 2dnt h GLN 50 CO -0.06 0.13 -0.22 0.45 -1.93 0.00 0.00 178.83 177.20 2dnt h HIS 51 N 0.15 0.00 -0.96 3.99 3.86 0.17 -3.31 115.15 119.05 2dnt h HIS 51 Ca 0.04 0.00 -0.73 0.00 -1.16 0.00 0.00 60.37 58.52 2dnt h HIS 51 Cb 0.00 0.00 -0.11 0.00 1.06 0.00 0.00 27.41 28.36 2dnt h HIS 51 CO -0.06 0.22 2.35 1.28 0.86 0.00 0.00 177.93 182.57 2dnt n LEU 52 N -3.57 6.44 -4.74 2.43 4.77 -0.64 -4.95 117.00 116.74 2dnt n LEU 52 Ca -0.01 -4.40 -0.38 0.00 -0.03 0.00 0.00 56.01 51.19 2dnt n LEU 52 Cb 0.36 -1.58 -0.06 0.00 -2.33 0.00 0.00 43.42 39.82 2dnt n LEU 52 CO 0.33 1.13 0.23 -0.69 -1.33 0.00 0.00 177.39 177.06 2dnt s VAL 53 N 1.75 5.07 -1.02 4.08 1.01 -1.25 -3.65 120.40 126.39 2dnt s VAL 53 Ca 0.44 1.10 0.00 0.00 0.00 0.00 0.00 61.98 63.51 2dnt s VAL 53 Cb 0.09 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.60 2dnt s VAL 53 CO -0.02 0.36 0.00 0.59 0.00 0.00 0.00 175.10 176.03 2dnt n ASN 54 N 3.26 -4.04 -0.23 3.32 3.02 -1.26 -4.84 115.26 114.49 2dnt n ASN 54 Ca -0.07 0.20 0.03 0.00 -0.03 0.00 0.00 54.58 54.71 2dnt n ASN 54 Cb 0.51 -2.59 0.02 0.00 -0.61 0.00 0.00 39.78 37.12 2dnt n ASN 54 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dnt n GLU 56 N 0.32 -0.08 -0.05 0.00 4.71 -1.26 -0.91 120.64 123.37 2dnt n GLU 56 Ca 0.03 1.48 -0.02 0.00 -0.01 0.00 0.00 57.16 58.65 2dnt n GLU 56 Cb 0.15 -2.32 -0.02 0.00 -1.01 0.00 0.00 31.44 28.24 2dnt n GLU 56 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 2dnt h GLU 57 N 0.00 -0.02 -0.38 3.49 4.81 -1.98 1.33 114.58 121.83 2dnt h GLU 57 Ca 0.56 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.84 2dnt h GLU 57 Cb 1.10 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 30.42 2dnt h GLU 57 CO -0.94 -0.02 -0.46 1.88 -0.73 0.00 0.00 179.01 178.74 2dnt h TYR 58 N -0.02 -1.42 -0.48 0.92 0.05 -1.39 0.24 116.97 114.87 2dnt h TYR 58 Ca 0.02 0.07 0.09 0.00 0.05 0.00 0.00 58.73 58.96 2dnt h TYR 58 Cb 0.08 0.67 -0.10 0.00 1.01 0.00 0.00 36.73 38.38 2dnt h TYR 58 CO -0.83 -0.39 -0.31 0.82 -1.05 0.00 0.00 178.16 176.39 2dnt h ILE 59 N -0.30 0.23 -0.35 -2.88 2.04 -0.99 0.59 117.51 115.84 2dnt h ILE 59 Ca 0.07 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.99 2dnt h ILE 59 Cb 0.47 0.23 -0.08 0.00 -0.74 0.00 0.00 36.82 36.69 2dnt h ILE 59 CO -0.51 0.00 -0.44 0.45 0.00 0.00 0.00 178.15 177.64 2dnt h HIS 60 N -0.20 -1.30 -0.31 1.37 3.86 0.32 1.48 115.15 120.37 2dnt h HIS 60 Ca 0.20 0.07 0.06 0.00 -1.16 0.00 0.00 60.37 59.54 2dnt h HIS 60 Cb 0.53 0.62 -0.05 0.00 1.06 0.00 0.00 27.41 29.57 2dnt h HIS 60 CO -0.57 -0.46 -0.03 0.22 0.86 0.00 0.00 177.93 177.95 2dnt h ASP 61 N -0.37 -0.20 -1.00 2.45 3.58 0.97 0.18 116.42 122.03 2dnt h ASP 61 Ca 0.12 0.08 0.05 0.00 0.42 0.00 0.00 57.03 57.70 2dnt h ASP 61 Cb 0.60 0.16 -0.06 0.00 1.72 0.00 0.00 39.33 41.74 2dnt h ASP 61 CO -0.54 -0.06 0.65 0.15 -2.88 0.00 0.00 179.24 176.55 2dnt h PHE 62 N 0.05 1.21 -0.32 0.28 3.57 0.20 -1.74 116.94 120.19 2dnt h PHE 62 Ca 0.15 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 2dnt h PHE 62 Cb 0.22 -0.40 -0.01 0.00 2.79 0.00 0.00 35.95 38.55 2dnt h PHE 62 CO -0.26 0.65 0.12 -0.91 -2.23 0.00 0.00 178.31 175.69 2dnt h ASN 63 N 1.21 0.44 -0.52 0.41 2.35 0.34 -2.70 115.58 117.12 2dnt h ASN 63 Ca 0.42 -0.17 0.10 0.00 -0.55 0.00 0.00 56.30 56.10 2dnt h ASN 63 Cb 0.10 -0.11 -0.08 0.00 0.05 0.00 0.00 38.32 38.27 2dnt h ASN 63 CO -0.15 0.49 0.02 0.03 -1.65 0.00 0.00 177.43 176.17 2dnt h ARG 64 N 0.36 0.14 0.09 0.81 2.47 0.13 0.29 114.38 118.67 2dnt h ARG 64 Ca 0.11 -0.01 0.02 0.00 -1.26 0.00 0.00 59.98 58.84 2dnt h ARG 64 Cb 0.19 -0.03 -0.05 0.00 -1.65 0.00 0.00 29.97 28.43 2dnt h ARG 64 CO -0.01 0.09 -0.46 0.00 0.56 0.00 0.00 179.97 180.15 2dnt h ARG 65 N 0.14 -0.65 0.45 0.04 2.47 -1.10 -2.93 114.38 112.79 2dnt h ARG 65 Ca 0.26 0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 59.01 2dnt h ARG 65 Cb 0.39 0.15 -0.02 0.00 -1.65 0.00 0.00 29.97 28.85 2dnt h ARG 65 CO -0.41 -0.43 -0.41 1.25 0.56 0.00 0.00 179.97 180.52 2dnt h HIS 66 N -0.68 -1.12 -1.54 3.04 2.76 -1.07 -3.43 115.15 113.11 2dnt h HIS 66 Ca 0.02 0.00 -0.61 0.00 -2.20 0.00 0.00 60.37 57.59 2dnt h HIS 66 Cb 0.71 0.43 0.15 0.00 1.55 0.00 0.00 27.41 30.25 2dnt h HIS 66 CO -0.42 -0.55 -0.87 2.41 -1.30 0.00 0.00 177.93 177.20 2dnt n THR 67 N -4.89 0.78 -3.97 6.26 -1.04 0.96 -4.93 114.28 107.45 2dnt n THR 67 Ca -0.10 -0.48 -0.34 0.00 -2.04 0.00 0.00 64.05 61.08 2dnt n THR 67 Cb 0.38 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.74 2dnt n THR 67 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2dnt s GLU 68 N -0.96 3.01 -0.09 -2.82 2.02 -1.26 -4.89 118.70 113.71 2dnt s GLU 68 Ca 0.58 -0.85 -0.07 0.00 0.02 0.00 0.00 54.97 54.64 2dnt s GLU 68 Cb -0.65 -2.93 0.03 0.00 0.10 0.00 0.00 34.13 30.68 2dnt s GLU 68 CO 0.60 -0.31 0.13 1.63 0.02 0.00 0.00 175.26 177.33 2dnt n LYS 69 N 4.70 -4.02 0.18 1.61 4.76 -1.26 -5.01 118.16 119.12 2dnt n LYS 69 Ca -0.18 3.02 0.00 0.00 -2.87 0.00 0.00 58.31 58.28 2dnt n LYS 69 Cb 0.49 -4.08 0.00 0.00 -1.84 0.00 0.00 35.03 29.59 2dnt n LYS 69 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 2dnt n GLN 70 N 1.90 0.00 -3.13 1.97 -0.06 -1.26 -5.12 117.38 111.68 2dnt n GLN 70 Ca -0.23 0.00 -0.38 0.00 -2.00 0.00 0.00 57.00 54.39 2dnt n GLN 70 Cb 0.35 0.00 -0.06 0.00 -4.06 0.00 0.00 30.24 26.47 2dnt n GLN 70 CO 0.00 0.00 0.00 -1.59 -0.20 0.00 0.00 177.06 175.27 2dnt s LYS 71 N -2.00 4.34 0.16 3.69 0.00 -1.26 -5.06 119.74 119.61 2dnt s LYS 71 Ca 0.00 0.91 -0.15 0.00 0.00 0.00 0.00 55.97 56.74 2dnt s LYS 71 Cb 0.00 -3.15 -0.07 0.00 0.00 0.00 0.00 37.83 34.61 2dnt s LYS 71 CO 0.00 0.55 0.56 -1.21 0.00 0.00 0.00 175.35 175.26 2dnt s GLU 72 N -1.36 3.99 0.24 1.78 2.02 -1.26 -5.07 118.70 119.04 2dnt s GLU 72 Ca 0.35 0.51 -0.13 0.00 0.02 0.00 0.00 54.97 55.73 2dnt s GLU 72 Cb -0.20 -2.92 -0.08 0.00 0.10 0.00 0.00 34.13 31.04 2dnt s GLU 72 CO 0.22 0.47 0.62 0.45 0.02 0.00 0.00 175.26 177.03 2dnt s SER 73 N -1.73 6.75 0.09 -0.19 0.15 -1.26 -5.09 113.70 112.41 2dnt s SER 73 Ca 0.38 1.10 0.02 0.00 0.70 0.00 0.00 55.95 58.15 2dnt s SER 73 Cb -0.15 -2.30 -0.04 0.00 -1.71 0.00 0.00 66.02 61.83 2dnt s SER 73 CO 0.19 -0.06 -0.07 -0.83 1.20 0.00 0.00 173.24 173.67 2dnt s GLY 74 N -2.13 0.72 1.05 9.45 0.00 -1.26 -5.16 107.32 109.98 2dnt s GLY 74 Ca 0.47 -1.23 -0.18 0.00 0.00 0.00 0.00 44.72 43.78 2dnt s GLY 74 CO 0.20 -1.33 1.16 -1.55 0.00 0.00 0.00 173.10 171.57 2dnt n PRO 75 N 0.27 -2.12 -3.57 2.90 -0.04 -1.26 -5.02 135.00 126.16 2dnt n PRO 75 Ca -0.14 -1.81 -0.41 0.00 -0.04 0.00 0.00 63.50 61.10 2dnt n PRO 75 Cb 0.59 -1.43 -0.11 0.00 -0.04 0.00 0.00 33.50 32.52 2dnt n PRO 75 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dnt s SER 76 N -4.98 5.81 -0.06 3.54 0.15 -1.26 -4.97 113.70 111.92 2dnt s SER 76 Ca 0.70 -0.94 -0.07 0.00 0.70 0.00 0.00 55.95 56.33 2dnt s SER 76 Cb -0.04 -2.05 -0.04 0.00 -1.71 0.00 0.00 66.02 62.18 2dnt s SER 76 CO 0.51 -0.39 0.32 0.28 1.20 0.00 0.00 173.24 175.16 2dnt h SER 77 N 8.47 -0.23 0.00 5.45 0.02 -2.08 -3.57 113.55 121.61 2dnt h SER 77 Ca -0.26 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 2dnt h SER 77 Cb 1.11 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2dnt h SER 77 CO 0.68 0.21 0.00 0.61 -1.14 0.00 0.00 176.83 177.19