#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 -1.52 0.14 1.61 2.88 -1.26 -5.06 113.62 110.41 2dnt n SER 2 Ca 0.00 0.58 0.00 0.00 -1.33 0.00 0.00 58.87 58.12 2dnt n SER 2 Cb 0.00 1.56 0.00 0.00 -0.75 0.00 0.00 64.21 65.02 2dnt n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dnt n SER 3 N -3.35 -0.74 -2.78 -3.46 7.64 -1.26 -5.06 113.62 104.61 2dnt n SER 3 Ca 0.00 0.50 -0.03 0.00 1.01 0.00 0.00 58.87 60.34 2dnt n SER 3 Cb 0.00 0.88 0.01 0.00 -1.01 0.00 0.00 64.21 64.09 2dnt n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dnt s GLY 4 N -4.53 -1.38 0.22 0.23 0.00 -1.26 -5.15 107.32 95.44 2dnt s GLY 4 Ca 0.00 -0.17 0.11 0.00 0.00 0.00 0.00 44.72 44.66 2dnt s GLY 4 CO 0.00 3.78 -0.20 -0.45 0.00 0.00 0.00 173.10 176.23 2dnt s SER 5 N 0.98 3.64 0.11 1.64 0.15 -1.26 -5.11 113.70 113.86 2dnt s SER 5 Ca 0.28 -0.86 0.06 0.00 0.70 0.00 0.00 55.95 56.13 2dnt s SER 5 Cb 0.02 -0.36 -0.04 0.00 -1.71 0.00 0.00 66.02 63.93 2dnt s SER 5 CO -0.06 0.09 -0.04 -0.44 1.20 0.00 0.00 173.24 173.99 2dnt s SER 6 N -2.95 4.77 0.00 5.45 0.01 -1.26 -4.86 113.70 114.86 2dnt s SER 6 Ca 0.24 -0.28 0.00 0.00 1.31 0.00 0.00 55.95 57.22 2dnt s SER 6 Cb -0.07 -1.04 0.00 0.00 0.21 0.00 0.00 66.02 65.11 2dnt s SER 6 CO 0.12 0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.55 2dnt n GLY 7 N 0.50 3.12 2.60 3.44 0.00 -1.26 -4.99 105.19 108.60 2dnt n GLY 7 Ca -0.11 -1.69 -0.22 0.00 0.00 0.00 0.00 46.02 44.00 2dnt n GLY 7 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2dnt n MET 8 N -0.02 2.41 -3.58 1.61 0.00 -1.26 -4.97 117.12 111.30 2dnt n MET 8 Ca 0.00 -4.16 -0.12 0.00 0.00 0.00 0.00 57.70 53.42 2dnt n MET 8 Cb 0.00 -1.95 -0.06 0.00 0.00 0.00 0.00 33.22 31.21 2dnt n MET 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2dnt s ALA 9 N -3.19 -1.90 -0.42 3.17 0.00 -1.26 -5.12 121.76 113.04 2dnt s ALA 9 Ca 0.43 1.63 0.02 0.00 0.00 0.00 0.00 51.96 54.04 2dnt s ALA 9 Cb 0.36 -0.78 0.14 0.00 0.00 0.00 0.00 23.12 22.83 2dnt s ALA 9 CO -0.11 -0.30 0.23 -1.54 0.00 0.00 0.00 175.76 174.04 2dnt s SER 10 N -0.73 3.43 -0.34 0.00 1.04 -1.26 -5.00 113.70 110.84 2dnt s SER 10 Ca -0.02 -2.52 -0.06 0.00 0.48 0.00 0.00 55.95 53.82 2dnt s SER 10 Cb -0.02 -0.85 0.19 0.00 0.10 0.00 0.00 66.02 65.44 2dnt s SER 10 CO 0.01 -0.28 0.98 -1.61 0.98 0.00 0.00 173.24 173.33 2dnt s GLU 11 N 0.54 0.28 0.49 4.02 2.02 -1.26 -5.17 118.70 119.61 2dnt s GLU 11 Ca 0.18 -0.09 0.04 0.00 0.02 0.00 0.00 54.97 55.12 2dnt s GLU 11 Cb -0.23 0.03 -0.01 0.00 0.10 0.00 0.00 34.13 34.02 2dnt s GLU 11 CO -0.00 -0.41 0.16 -1.21 0.02 0.00 0.00 175.26 173.83 2dnt s GLU 12 N 1.95 2.20 0.06 1.61 2.02 -1.26 -5.06 118.70 120.21 2dnt s GLU 12 Ca 0.15 -2.14 -0.35 0.00 0.02 0.00 0.00 54.97 52.65 2dnt s GLU 12 Cb 0.02 -1.81 -0.19 0.00 0.10 0.00 0.00 34.13 32.25 2dnt s GLU 12 CO -0.14 -0.35 1.52 1.37 0.02 0.00 0.00 175.26 177.68 2dnt h LEU 13 N 1.23 -1.07 -7.00 1.80 -0.00 -2.06 -3.46 115.31 104.74 2dnt h LEU 13 Ca -0.42 0.04 0.01 0.00 -0.00 0.00 0.00 57.88 57.52 2dnt h LEU 13 Cb 1.29 0.28 -0.23 0.00 -0.00 0.00 0.00 40.66 42.01 2dnt h LEU 13 CO 0.69 -0.75 0.20 -0.31 -0.00 0.00 0.00 178.44 178.27 2dnt s TYR 14 N -5.72 -0.77 -0.00 0.17 2.02 -1.26 -5.03 117.35 106.76 2dnt s TYR 14 Ca -0.18 1.73 0.05 0.00 -0.37 0.00 0.00 57.07 58.30 2dnt s TYR 14 Cb 0.02 0.39 -0.01 0.00 -0.40 0.00 0.00 41.96 41.96 2dnt s TYR 14 CO 0.55 -0.37 -0.16 -1.83 -1.57 0.00 0.00 175.55 172.17 2dnt s GLU 15 N 0.76 1.25 0.06 -0.62 1.03 -1.26 -5.10 118.70 114.82 2dnt s GLU 15 Ca -0.03 -0.60 -0.34 0.00 0.03 0.00 0.00 54.97 54.04 2dnt s GLU 15 Cb -0.05 -1.22 -0.13 0.00 -0.80 0.00 0.00 34.13 31.93 2dnt s GLU 15 CO -0.07 0.33 1.70 0.28 -1.33 0.00 0.00 175.26 176.16 2dnt n VAL 16 N 2.58 0.23 -0.07 1.83 0.31 -1.26 -4.87 118.33 117.09 2dnt n VAL 16 Ca -0.15 -0.04 -0.19 0.00 -0.01 0.00 0.00 64.34 63.95 2dnt n VAL 16 Cb 0.55 -1.67 -0.13 0.00 -0.91 0.00 0.00 33.84 31.68 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 7.24 0.05 0.00 5.55 4.81 -1.95 -3.50 114.58 126.78 2dnt h GLU 17 Ca -0.46 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 2dnt h GLU 17 Cb 1.26 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.67 2dnt h GLU 17 CO 0.91 1.04 0.00 2.89 -0.73 0.00 0.00 179.01 183.12 2dnt n ARG 18 N -4.39 0.00 -3.37 1.92 1.85 -1.26 -5.01 116.66 106.40 2dnt n ARG 18 Ca -0.23 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.24 2dnt n ARG 18 Cb 0.66 0.00 -0.07 0.00 -1.05 0.00 0.00 32.46 32.00 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 5.21 -0.35 8.89 -1.09 -1.26 -2.94 121.20 127.66 2dnt s ILE 19 Ca 0.00 0.79 0.16 0.00 -2.23 0.00 0.00 60.65 59.37 2dnt s ILE 19 Cb 0.00 -3.75 -0.22 0.00 -1.58 0.00 0.00 42.46 36.91 2dnt s ILE 19 CO 0.00 0.29 0.50 0.52 -1.23 0.00 0.00 174.94 175.03 2dnt n VAL 20 N 3.99 0.00 -3.95 2.92 0.31 0.63 -4.96 118.33 117.26 2dnt n VAL 20 Ca -0.08 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 63.99 2dnt n VAL 20 Cb 0.51 0.51 0.02 0.00 -0.91 0.00 0.00 33.84 33.97 2dnt n VAL 20 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2dnt s ASP 21 N -3.29 0.01 -0.29 4.52 -1.08 -1.17 -4.93 116.67 110.43 2dnt s ASP 21 Ca -0.01 -0.39 -0.18 0.00 -0.52 0.00 0.00 52.55 51.46 2dnt s ASP 21 Cb 0.11 0.28 0.16 0.00 -1.46 0.00 0.00 42.92 42.02 2dnt s ASP 21 CO 0.67 -0.56 1.09 -0.75 0.52 0.00 0.00 175.17 176.14 2dnt s LYS 22 N -2.06 0.28 0.37 4.34 2.20 -1.26 0.13 119.74 123.74 2dnt s LYS 22 Ca 0.27 0.46 -0.05 0.00 -0.36 0.00 0.00 55.97 56.29 2dnt s LYS 22 Cb -0.01 0.07 0.02 0.00 -1.51 0.00 0.00 37.83 36.40 2dnt s LYS 22 CO 0.02 -0.05 0.57 -0.98 -0.36 0.00 0.00 175.35 174.54 2dnt s ARG 23 N 1.06 2.07 0.12 4.03 1.70 0.93 -4.98 118.95 123.88 2dnt s ARG 23 Ca -0.06 -1.74 0.05 0.00 -0.47 0.00 0.00 55.73 53.51 2dnt s ARG 23 Cb -0.03 0.49 -0.04 0.00 -0.57 0.00 0.00 34.95 34.80 2dnt s ARG 23 CO -0.13 -0.89 0.02 0.21 -1.08 0.00 0.00 175.30 173.43 2dnt s LYS 24 N -2.70 2.57 0.79 3.89 2.20 -1.26 0.23 119.74 125.46 2dnt s LYS 24 Ca 0.27 -0.90 -0.03 0.00 -0.36 0.00 0.00 55.97 54.95 2dnt s LYS 24 Cb -0.02 -2.52 0.16 0.00 -1.51 0.00 0.00 37.83 33.95 2dnt s LYS 24 CO 0.20 0.51 1.08 0.09 -0.36 0.00 0.00 175.35 176.87 2dnt n ASN 25 N 0.29 1.13 -0.15 1.43 3.02 0.18 -4.88 115.26 116.28 2dnt n ASN 25 Ca -0.10 -2.03 -0.09 0.00 -0.03 0.00 0.00 54.58 52.33 2dnt n ASN 25 Cb 0.53 -0.73 0.00 0.00 -0.61 0.00 0.00 39.78 38.97 2dnt n ASN 25 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2dnt h LYS 26 N 0.00 0.66 0.00 3.52 3.11 -2.00 -1.74 116.57 120.11 2dnt h LYS 26 Ca -0.36 -0.11 -0.05 0.00 -2.81 0.00 0.00 60.65 57.32 2dnt h LYS 26 Cb 1.24 -0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 32.35 2dnt h LYS 26 CO 0.35 0.60 -0.22 0.87 -2.81 0.00 0.00 179.45 178.23 2dnt h LYS 27 N 0.57 0.00 0.00 1.90 1.79 -2.06 -3.45 116.57 115.32 2dnt h LYS 27 Ca 0.15 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.62 2dnt h LYS 27 Cb 0.18 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.83 2dnt h LYS 27 CO -0.01 0.22 0.00 0.41 -1.08 0.00 0.00 179.45 178.99 2dnt n GLY 28 N -0.82 1.75 3.79 3.86 0.00 -0.65 -5.11 105.19 108.01 2dnt n GLY 28 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.17 4.32 -0.17 1.61 -0.14 -1.26 -4.69 119.74 119.24 2dnt s LYS 29 Ca 0.00 0.84 -0.26 0.00 -1.36 0.00 0.00 55.97 55.20 2dnt s LYS 29 Cb 0.00 -3.27 -0.01 0.00 -1.68 0.00 0.00 37.83 32.86 2dnt s LYS 29 CO 0.00 0.55 0.84 0.99 -0.76 0.00 0.00 175.35 176.97 2dnt s THR 30 N -0.86 4.87 -0.09 2.17 2.01 -1.26 0.49 115.64 122.96 2dnt s THR 30 Ca 0.31 1.66 0.03 0.00 0.31 0.00 0.00 61.69 64.00 2dnt s THR 30 Cb -0.20 -4.15 0.01 0.00 0.01 0.00 0.00 72.50 68.17 2dnt s THR 30 CO 0.20 0.02 -0.18 -1.83 -0.69 0.00 0.00 174.62 172.14 2dnt s GLU 31 N 2.19 2.43 -0.14 4.92 -1.05 0.14 -1.92 118.70 125.26 2dnt s GLU 31 Ca 0.39 -0.66 -0.03 0.00 -0.15 0.00 0.00 54.97 54.52 2dnt s GLU 31 Cb -0.17 -1.92 -0.03 0.00 -0.44 0.00 0.00 34.13 31.58 2dnt s GLU 31 CO 0.12 0.08 -0.05 0.71 0.95 0.00 0.00 175.26 177.07 2dnt s TYR 32 N 0.58 2.99 -0.48 4.83 1.51 0.11 -0.05 117.35 126.85 2dnt s TYR 32 Ca -0.15 -0.31 -0.28 0.00 -1.01 0.00 0.00 57.07 55.32 2dnt s TYR 32 Cb -0.17 -1.92 0.01 0.00 -0.11 0.00 0.00 41.96 39.77 2dnt s TYR 32 CO 0.05 -0.02 1.43 -1.17 -1.11 0.00 0.00 175.55 174.73 2dnt s LEU 33 N 0.24 3.50 -0.01 -1.29 2.96 0.34 -2.34 118.68 122.08 2dnt s LEU 33 Ca -0.04 0.61 0.06 0.00 -0.22 0.00 0.00 54.13 54.54 2dnt s LEU 33 Cb -0.14 -3.32 -0.02 0.00 0.50 0.00 0.00 46.19 43.21 2dnt s LEU 33 CO 0.03 -1.57 -0.21 0.54 -1.32 0.00 0.00 176.35 173.82 2dnt s VAL 34 N 5.81 1.66 0.77 1.68 0.11 -1.19 0.23 120.40 129.47 2dnt s VAL 34 Ca 0.58 -0.91 -0.07 0.00 -2.93 0.00 0.00 61.98 58.65 2dnt s VAL 34 Cb -0.12 -1.38 0.11 0.00 -1.53 0.00 0.00 36.38 33.46 2dnt s VAL 34 CO 0.29 0.46 1.08 -0.13 -3.33 0.00 0.00 175.10 173.48 2dnt s ARG 35 N -0.51 1.68 0.13 1.54 1.81 -1.15 -3.74 118.95 118.71 2dnt s ARG 35 Ca 0.08 -0.51 -0.24 0.00 -1.72 0.00 0.00 55.73 53.34 2dnt s ARG 35 Cb -0.08 -2.13 0.07 0.00 -0.45 0.00 0.00 34.95 32.36 2dnt s ARG 35 CO -0.01 -1.58 0.65 -1.58 -0.68 0.00 0.00 175.30 172.10 2dnt s TRP 36 N -3.38 -0.51 0.49 -0.53 0.52 -1.26 -3.74 118.94 110.53 2dnt s TRP 36 Ca 0.65 0.31 -0.22 0.00 0.02 0.00 0.00 56.10 56.86 2dnt s TRP 36 Cb -0.08 0.56 -0.07 0.00 -1.15 0.00 0.00 33.47 32.73 2dnt s TRP 36 CO 0.47 -0.80 1.20 -1.59 0.02 0.00 0.00 176.95 176.24 2dnt s LYS 37 N -3.65 3.58 0.00 4.98 -2.85 -1.26 -2.95 119.74 117.59 2dnt s LYS 37 Ca 0.02 1.85 0.00 0.00 -1.00 0.00 0.00 55.97 56.84 2dnt s LYS 37 Cb -0.01 -2.33 0.00 0.00 -2.06 0.00 0.00 37.83 33.43 2dnt s LYS 37 CO -0.12 -0.72 0.00 0.41 0.10 0.00 0.00 175.35 175.02 2dnt n GLY 38 N 0.48 1.85 3.63 0.59 0.00 -1.26 -4.95 105.19 105.53 2dnt n GLY 38 Ca 0.08 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.25 3.20 0.00 1.61 2.02 -1.15 -5.03 117.35 117.74 2dnt s TYR 39 Ca 0.00 1.08 0.00 0.00 -0.37 0.00 0.00 57.07 57.78 2dnt s TYR 39 Cb 0.00 -3.43 0.00 0.00 -0.40 0.00 0.00 41.96 38.13 2dnt s TYR 39 CO 0.00 -0.64 0.00 -0.25 -1.57 0.00 0.00 175.55 173.09 2dnt n ASP 40 N 6.51 -1.27 0.05 2.29 8.00 -1.26 -4.48 116.55 126.39 2dnt n ASP 40 Ca 0.08 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.44 2dnt n ASP 40 Cb 0.47 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.52 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 -1.34 0.65 0.25 -2.24 0.87 -1.96 -2.86 113.55 106.92 2dnt h SER 41 Ca 0.00 -0.50 0.00 0.00 -1.23 0.00 0.00 61.79 60.06 2dnt h SER 41 Cb 0.00 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 61.76 2dnt h SER 41 CO 0.00 1.29 -0.14 -1.84 -0.53 0.00 0.00 176.83 175.61 2dnt n GLU 42 N -3.80 0.89 0.03 2.24 0.28 -1.26 -3.23 120.64 115.79 2dnt n GLU 42 Ca -0.07 -0.41 0.11 0.00 -0.16 0.00 0.00 57.16 56.63 2dnt n GLU 42 Cb 0.82 -1.49 0.01 0.00 1.43 0.00 0.00 31.44 32.21 2dnt n GLU 42 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2dnt n ASP 43 N -0.70 0.61 -4.04 -1.84 -0.08 -1.14 -4.97 116.55 104.39 2dnt n ASP 43 Ca 0.15 -0.22 -0.36 0.00 -1.51 0.00 0.00 54.79 52.85 2dnt n ASP 43 Cb 0.30 0.83 0.04 0.00 2.34 0.00 0.00 41.12 44.63 2dnt n ASP 43 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2dnt n ASP 44 N -1.97 -5.64 -4.27 1.67 8.00 -1.09 -4.81 116.55 108.44 2dnt n ASP 44 Ca 0.02 0.23 -0.23 0.00 0.71 0.00 0.00 54.79 55.52 2dnt n ASP 44 Cb 0.44 -0.79 -0.09 0.00 -0.02 0.00 0.00 41.12 40.65 2dnt n ASP 44 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2dnt s THR 45 N -2.02 0.82 -0.19 -3.53 -1.32 -1.25 -5.06 115.64 103.09 2dnt s THR 45 Ca 0.42 -2.00 -0.03 0.00 -1.21 0.00 0.00 61.69 58.87 2dnt s THR 45 Cb -0.21 -2.56 -0.01 0.00 -1.51 0.00 0.00 72.50 68.21 2dnt s THR 45 CO 0.81 0.00 -0.06 0.26 -2.21 0.00 0.00 174.62 173.42 2dnt s TRP 46 N -3.32 2.94 -0.03 9.09 0.52 -1.26 -3.14 118.94 123.73 2dnt s TRP 46 Ca 0.31 -0.77 0.07 0.00 0.02 0.00 0.00 56.10 55.73 2dnt s TRP 46 Cb 0.06 -2.03 -0.02 0.00 -1.15 0.00 0.00 33.47 30.33 2dnt s TRP 46 CO 0.15 -0.40 -0.24 -1.21 0.02 0.00 0.00 176.95 175.28 2dnt s GLU 47 N 1.07 2.26 0.16 4.98 0.41 -0.99 -4.90 118.70 121.69 2dnt s GLU 47 Ca 0.01 -0.88 -0.30 0.00 -0.41 0.00 0.00 54.97 53.39 2dnt s GLU 47 Cb -0.15 -2.13 -0.07 0.00 -1.78 0.00 0.00 34.13 30.01 2dnt s GLU 47 CO -0.00 0.54 1.13 -1.25 -0.49 0.00 0.00 175.26 175.18 2dnt s PRO 48 N -0.55 4.55 0.30 0.39 0.04 -1.26 0.04 135.00 138.52 2dnt s PRO 48 Ca 0.08 1.74 0.01 0.00 0.04 0.00 0.00 61.00 62.87 2dnt s PRO 48 Cb -0.11 -3.28 0.72 0.00 0.04 0.00 0.00 34.50 31.87 2dnt s PRO 48 CO 0.00 0.00 1.54 -1.91 0.04 0.00 0.00 177.00 176.67 2dnt n GLU 49 N 2.63 -0.08 -0.27 4.56 0.00 -0.81 0.19 120.64 126.87 2dnt n GLU 49 Ca 0.04 1.47 0.07 0.00 0.00 0.00 0.00 57.16 58.75 2dnt n GLU 49 Cb 0.46 -2.33 0.22 0.00 0.00 0.00 0.00 31.44 29.79 2dnt n GLU 49 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.13 177.50 2dnt h GLN 50 N 0.00 0.35 0.00 5.31 4.15 -1.91 0.94 115.11 123.96 2dnt h GLN 50 Ca 0.58 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.95 2dnt h GLN 50 Cb 1.18 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 28.78 2dnt h GLN 50 CO -0.93 0.23 -0.15 0.45 -1.93 0.00 0.00 178.83 176.50 2dnt h HIS 51 N 0.37 0.00 -1.55 3.99 3.86 0.17 -3.31 115.15 118.67 2dnt h HIS 51 Ca 0.45 0.00 -0.76 0.00 -1.16 0.00 0.00 60.37 58.90 2dnt h HIS 51 Cb 0.77 0.00 -0.17 0.00 1.06 0.00 0.00 27.41 29.07 2dnt h HIS 51 CO -0.20 0.15 1.94 1.28 0.86 0.00 0.00 177.93 181.96 2dnt n LEU 52 N -3.23 7.10 -4.77 2.43 4.77 0.33 -4.98 117.00 118.64 2dnt n LEU 52 Ca 0.01 -4.83 -0.38 0.00 -0.03 0.00 0.00 56.01 50.78 2dnt n LEU 52 Cb 0.46 -1.40 -0.06 0.00 -2.33 0.00 0.00 43.42 40.09 2dnt n LEU 52 CO 0.33 1.67 0.67 0.68 -1.33 0.00 0.00 177.39 179.40 2dnt s VAL 53 N -0.75 4.08 -1.18 4.08 -7.23 -1.24 -2.97 120.40 115.19 2dnt s VAL 53 Ca 0.43 1.80 0.00 0.00 -1.81 0.00 0.00 61.98 62.40 2dnt s VAL 53 Cb 0.12 -4.03 0.00 0.00 0.56 0.00 0.00 36.38 33.03 2dnt s VAL 53 CO -0.02 0.21 0.00 0.59 -0.31 0.00 0.00 175.10 175.57 2dnt n ASN 54 N 0.70 -5.28 -0.00 4.85 3.02 -1.26 -4.77 115.26 112.52 2dnt n ASN 54 Ca 0.01 0.28 0.10 0.00 -0.03 0.00 0.00 54.58 54.94 2dnt n ASN 54 Cb 0.49 -3.76 -0.14 0.00 -0.61 0.00 0.00 39.78 35.76 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 -1.84 -0.06 -0.10 0.00 1.02 -1.26 0.10 120.64 118.50 2dnt n GLU 56 Ca 0.00 1.21 -0.10 0.00 -0.02 0.00 0.00 57.16 58.25 2dnt n GLU 56 Cb 0.43 -2.03 -0.05 0.00 -0.02 0.00 0.00 31.44 29.77 2dnt n GLU 56 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2dnt h GLU 57 N 0.00 -0.35 0.44 3.49 4.81 -1.97 1.36 114.58 122.37 2dnt h GLU 57 Ca 0.60 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.83 2dnt h GLU 57 Cb 1.41 0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.87 2dnt h GLU 57 CO -0.73 -0.23 -0.21 1.88 -0.73 0.00 0.00 179.01 178.99 2dnt h TYR 58 N -0.36 -0.55 -0.24 0.92 0.05 0.35 -2.21 116.97 114.93 2dnt h TYR 58 Ca 0.12 -0.01 0.06 0.00 0.05 0.00 0.00 58.73 58.95 2dnt h TYR 58 Cb 0.59 0.18 -0.07 0.00 1.01 0.00 0.00 36.73 38.44 2dnt h TYR 58 CO -0.58 -0.31 -0.31 0.82 -1.05 0.00 0.00 178.16 176.73 2dnt h ILE 59 N -0.65 0.29 -0.44 -2.88 2.04 -0.73 0.39 117.51 115.51 2dnt h ILE 59 Ca -0.06 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.84 2dnt h ILE 59 Cb 0.49 0.29 -0.07 0.00 -0.74 0.00 0.00 36.82 36.79 2dnt h ILE 59 CO 0.10 0.00 -0.41 0.45 0.00 0.00 0.00 178.15 178.29 2dnt h HIS 60 N -0.32 -1.27 -0.27 1.37 3.86 0.19 1.50 115.15 120.20 2dnt h HIS 60 Ca 0.13 0.07 0.07 0.00 -1.16 0.00 0.00 60.37 59.47 2dnt h HIS 60 Cb 0.53 0.61 -0.07 0.00 1.06 0.00 0.00 27.41 29.54 2dnt h HIS 60 CO -0.45 -0.32 -0.20 0.22 0.86 0.00 0.00 177.93 178.04 2dnt h ASP 61 N -0.18 -0.66 -0.99 2.45 3.58 -0.74 0.73 116.42 120.60 2dnt h ASP 61 Ca 0.07 0.13 0.15 0.00 0.42 0.00 0.00 57.03 57.81 2dnt h ASP 61 Cb 0.38 0.33 -0.09 0.00 1.72 0.00 0.00 39.33 41.66 2dnt h ASP 61 CO -0.52 -0.24 0.61 0.15 -2.88 0.00 0.00 179.24 176.36 2dnt h PHE 62 N -0.19 1.09 -0.34 0.28 3.57 0.18 0.36 116.94 121.90 2dnt h PHE 62 Ca 0.15 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.62 2dnt h PHE 62 Cb 0.41 -0.34 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 2dnt h PHE 62 CO -0.38 0.35 -0.04 -0.91 -2.23 0.00 0.00 178.31 175.10 2dnt h ASN 63 N 0.88 0.51 0.47 0.41 2.35 0.42 0.71 115.58 121.32 2dnt h ASN 63 Ca 0.53 -0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 56.14 2dnt h ASN 63 Cb 0.66 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.90 2dnt h ASN 63 CO -0.32 0.61 -0.23 0.03 -1.65 0.00 0.00 177.43 175.87 2dnt h ARG 64 N 0.51 -0.61 -0.24 0.81 2.47 0.16 -1.21 114.38 116.27 2dnt h ARG 64 Ca 0.10 0.04 0.06 0.00 -1.26 0.00 0.00 59.98 58.93 2dnt h ARG 64 Cb 0.39 0.14 -0.07 0.00 -1.65 0.00 0.00 29.97 28.78 2dnt h ARG 64 CO 0.02 -0.39 -0.23 0.00 0.56 0.00 0.00 179.97 179.93 2dnt h ARG 65 N -1.15 -0.23 0.19 0.04 -0.00 -0.67 -2.73 114.38 109.83 2dnt h ARG 65 Ca -0.07 0.02 -0.00 0.00 -0.50 0.00 0.00 59.98 59.43 2dnt h ARG 65 Cb 0.51 0.05 -0.02 0.00 0.00 0.00 0.00 29.97 30.51 2dnt h ARG 65 CO 0.11 -0.15 -0.33 1.25 0.00 0.00 0.00 179.97 180.85 2dnt h HIS 66 N -0.24 -0.93 -2.26 3.04 2.76 -0.95 -3.40 115.15 113.17 2dnt h HIS 66 Ca 0.14 0.02 -0.57 0.00 -2.20 0.00 0.00 60.37 57.76 2dnt h HIS 66 Cb 0.44 0.38 0.03 0.00 1.55 0.00 0.00 27.41 29.81 2dnt h HIS 66 CO -0.38 -0.40 1.12 2.41 -1.30 0.00 0.00 177.93 179.38 2dnt n THR 67 N -4.34 0.55 -1.45 6.26 -1.04 -0.46 -4.63 114.28 109.17 2dnt n THR 67 Ca -0.06 -0.10 0.18 0.00 -2.04 0.00 0.00 64.05 62.03 2dnt n THR 67 Cb 0.27 -2.05 -0.08 0.00 -1.82 0.00 0.00 70.33 66.66 2dnt n THR 67 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2dnt n GLU 68 N 6.44 -3.18 -2.09 -2.82 1.02 -1.26 -4.79 120.64 113.96 2dnt n GLU 68 Ca 0.20 2.45 -0.02 0.00 -0.02 0.00 0.00 57.16 59.78 2dnt n GLU 68 Cb 0.35 -3.78 -0.02 0.00 -0.02 0.00 0.00 31.44 27.97 2dnt n GLU 68 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2dnt n LYS 69 N -4.31 -3.44 -3.09 3.49 4.76 -1.26 -4.74 118.16 109.57 2dnt n LYS 69 Ca -0.06 2.69 -0.14 0.00 -2.87 0.00 0.00 58.31 57.94 2dnt n LYS 69 Cb 0.68 -3.64 0.01 0.00 -1.84 0.00 0.00 35.03 30.25 2dnt n LYS 69 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2dnt n GLN 70 N 1.24 -2.02 0.02 1.97 6.02 -1.26 -4.83 117.38 118.52 2dnt n GLN 70 Ca -0.15 1.76 0.00 0.00 -0.01 0.00 0.00 57.00 58.61 2dnt n GLN 70 Cb 0.22 -4.76 0.00 0.00 1.02 0.00 0.00 30.24 26.72 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 -0.76 0.00 -1.52 -1.09 4.81 -1.26 -5.01 118.16 113.33 2dnt n LYS 71 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 2dnt n LYS 71 Cb 0.53 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.58 2dnt n LYS 71 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 2dnt n GLU 72 N -2.29 -3.92 -3.34 1.64 4.07 -1.26 -5.01 120.64 110.54 2dnt n GLU 72 Ca 0.00 2.88 -0.25 0.00 -0.06 0.00 0.00 57.16 59.73 2dnt n GLU 72 Cb 0.00 -3.03 -0.09 0.00 -0.06 0.00 0.00 31.44 28.26 2dnt n GLU 72 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 2dnt n SER 73 N 0.96 -0.73 0.00 4.31 7.64 -1.26 -5.11 113.62 119.43 2dnt n SER 73 Ca 0.00 -2.41 0.00 0.00 1.01 0.00 0.00 58.87 57.47 2dnt n SER 73 Cb 0.00 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 62.83 2dnt n SER 73 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dnt n GLY 74 N 2.85 -1.81 3.79 0.23 0.00 -1.26 -4.92 105.19 104.07 2dnt n GLY 74 Ca 0.29 -1.42 -0.29 0.00 0.00 0.00 0.00 46.02 44.59 2dnt n GLY 74 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dnt s PRO 75 N 0.00 1.53 -0.10 1.61 0.04 -1.26 -5.07 135.00 131.74 2dnt s PRO 75 Ca 0.00 0.44 0.01 0.00 0.04 0.00 0.00 61.00 61.49 2dnt s PRO 75 Cb 0.00 -1.87 0.02 0.00 0.04 0.00 0.00 34.50 32.69 2dnt s PRO 75 CO 0.00 -1.96 -0.14 -1.12 0.04 0.00 0.00 177.00 173.82 2dnt s SER 76 N -3.97 2.30 -0.14 6.66 0.01 -1.26 -5.11 113.70 112.19 2dnt s SER 76 Ca 0.63 -0.39 0.00 0.00 1.31 0.00 0.00 55.95 57.50 2dnt s SER 76 Cb -0.15 -1.01 0.02 0.00 0.21 0.00 0.00 66.02 65.09 2dnt s SER 76 CO 0.54 -0.01 -0.13 -0.55 0.41 0.00 0.00 173.24 173.50 2dnt s SER 77 N 1.07 2.59 0.00 2.44 0.15 -1.26 -5.28 113.70 113.41 2dnt s SER 77 Ca -0.05 -0.45 0.20 0.00 0.70 0.00 0.00 55.95 56.35 2dnt s SER 77 Cb -0.15 -1.12 1.21 0.00 -1.71 0.00 0.00 66.02 64.26 2dnt s SER 77 CO -0.02 -0.07 1.59 0.61 1.20 0.00 0.00 173.24 176.55