#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dar s SER 2 N 0.00 -0.14 0.13 1.61 1.04 -1.26 -5.18 113.70 109.90 2dar s SER 2 Ca 0.00 -0.76 0.05 0.00 0.48 0.00 0.00 55.95 55.73 2dar s SER 2 Cb 0.00 0.58 -0.04 0.00 0.10 0.00 0.00 66.02 66.66 2dar s SER 2 CO 0.00 -1.11 0.03 -0.94 0.98 0.00 0.00 173.24 172.20 2dar s SER 3 N -2.96 5.06 0.00 7.02 1.04 -1.26 -5.06 113.70 117.54 2dar s SER 3 Ca 0.17 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.37 2dar s SER 3 Cb -0.01 -1.20 0.00 0.00 0.10 0.00 0.00 66.02 64.91 2dar s SER 3 CO 0.04 0.13 0.00 0.61 0.98 0.00 0.00 173.24 175.00 2dar n GLY 4 N 0.22 1.23 4.31 7.32 0.00 -1.26 -5.00 105.19 112.01 2dar n GLY 4 Ca -0.10 -0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 2dar n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dar n SER 5 N 0.00 -2.10 -3.81 1.61 7.64 -1.26 -4.92 113.62 110.78 2dar n SER 5 Ca 0.00 -1.11 -0.12 0.00 1.01 0.00 0.00 58.87 58.64 2dar n SER 5 Cb 0.00 -2.30 -0.11 0.00 -1.01 0.00 0.00 64.21 60.79 2dar n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dar s SER 6 N -3.50 -0.18 0.35 6.43 1.04 -1.26 -5.17 113.70 111.41 2dar s SER 6 Ca 0.62 0.29 -0.12 0.00 0.48 0.00 0.00 55.95 57.22 2dar s SER 6 Cb -0.35 0.39 0.03 0.00 0.10 0.00 0.00 66.02 66.19 2dar s SER 6 CO 0.96 -0.16 0.66 -0.83 0.98 0.00 0.00 173.24 174.85 2dar s GLY 7 N -0.29 0.67 0.42 7.32 0.00 -1.26 -5.18 107.32 108.99 2dar s GLY 7 Ca -0.04 -0.94 0.07 0.00 0.00 0.00 0.00 44.72 43.81 2dar s GLY 7 CO 0.01 -0.52 0.31 0.99 0.00 0.00 0.00 173.10 173.89 2dar s ASP 8 N -3.10 4.82 -0.02 1.64 1.11 -1.26 -5.10 116.67 114.77 2dar s ASP 8 Ca 0.20 -0.87 -0.28 0.00 0.18 0.00 0.00 52.55 51.77 2dar s ASP 8 Cb -0.03 -0.51 -0.03 0.00 1.07 0.00 0.00 42.92 43.41 2dar s ASP 8 CO 0.13 -0.63 0.91 -1.10 1.18 0.00 0.00 175.17 175.67 2dar s GLN 9 N -4.06 4.53 0.25 8.23 -1.52 -1.26 -5.04 119.66 120.78 2dar s GLN 9 Ca 0.45 1.29 0.01 0.00 -1.95 0.00 0.00 55.36 55.16 2dar s GLN 9 Cb -0.01 -3.46 -0.04 0.00 -0.22 0.00 0.00 33.01 29.29 2dar s GLN 9 CO 0.26 -0.02 0.14 0.16 -0.25 0.00 0.00 175.29 175.58 2dar s ASP 10 N 0.96 0.80 0.50 5.90 1.47 -1.26 -5.15 116.67 119.88 2dar s ASP 10 Ca 0.48 -1.45 -0.19 0.00 1.18 0.00 0.00 52.55 52.57 2dar s ASP 10 Cb -0.20 0.35 -0.08 0.00 -0.34 0.00 0.00 42.92 42.64 2dar s ASP 10 CO 0.26 -0.84 1.02 -0.89 0.68 0.00 0.00 175.17 175.40 2dar s THR 11 N -3.90 3.95 0.28 2.11 2.01 -1.26 -4.96 115.64 113.88 2dar s THR 11 Ca 0.38 1.14 -0.03 0.00 0.31 0.00 0.00 61.69 63.49 2dar s THR 11 Cb 0.06 -3.48 0.25 0.00 0.01 0.00 0.00 72.50 69.34 2dar s THR 11 CO 0.15 -0.33 1.94 0.25 -0.69 0.00 0.00 174.62 175.94 2dar h LEU 12 N 1.38 0.99 -5.42 4.42 6.46 -2.01 -3.43 115.31 117.70 2dar h LEU 12 Ca -0.49 -0.04 -0.48 0.00 -0.12 0.00 0.00 57.88 56.76 2dar h LEU 12 Cb 1.21 -0.25 -0.04 0.00 -0.73 0.00 0.00 40.66 40.86 2dar h LEU 12 CO 0.59 0.74 0.97 0.52 -0.62 0.00 0.00 178.44 180.64 2dar n VAL 13 N -4.39 0.00 -2.83 1.05 0.31 -1.26 -4.88 118.33 106.33 2dar n VAL 13 Ca 0.09 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.22 2dar n VAL 13 Cb 0.04 -0.34 0.06 0.00 -0.91 0.00 0.00 33.84 32.69 2dar n VAL 13 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dar s GLN 14 N 4.57 2.23 0.19 5.55 -2.07 -0.81 -4.82 119.66 124.51 2dar s GLN 14 Ca 0.84 -1.27 0.01 0.00 -1.82 0.00 0.00 55.36 53.12 2dar s GLN 14 Cb -0.98 -2.54 -0.05 0.00 -1.09 0.00 0.00 33.01 28.36 2dar s GLN 14 CO 0.42 -0.93 0.05 1.03 -1.32 0.00 0.00 175.29 174.54 2dar s ARG 15 N -4.78 1.17 -0.08 9.60 0.52 -1.26 -2.20 118.95 121.93 2dar s ARG 15 Ca 0.61 -1.59 0.00 0.00 -0.52 0.00 0.00 55.73 54.24 2dar s ARG 15 Cb -0.07 -0.15 -0.03 0.00 0.52 0.00 0.00 34.95 35.22 2dar s ARG 15 CO 0.40 -0.22 -0.06 0.00 0.02 0.00 0.00 175.30 175.44 2dar s ALA 16 N -3.78 2.99 -0.47 2.13 0.00 -1.26 -4.88 121.76 116.49 2dar s ALA 16 Ca 0.29 -0.88 -0.28 0.00 0.00 0.00 0.00 51.96 51.09 2dar s ALA 16 Cb 0.07 -1.27 0.03 0.00 0.00 0.00 0.00 23.12 21.95 2dar s ALA 16 CO 0.07 0.53 1.08 -2.00 0.00 0.00 0.00 175.76 175.44 2dar s GLU 17 N -0.68 3.69 -0.34 0.00 2.12 -1.10 -4.88 118.70 117.51 2dar s GLU 17 Ca 0.10 0.48 -0.28 0.00 0.36 0.00 0.00 54.97 55.63 2dar s GLU 17 Cb -0.11 -3.90 -0.02 0.00 0.26 0.00 0.00 34.13 30.35 2dar s GLU 17 CO 0.02 -1.31 1.81 -1.01 -0.54 0.00 0.00 175.26 174.22 2dar s HIS 18 N 4.23 1.79 -0.17 5.30 3.76 -1.26 -2.96 115.29 125.98 2dar s HIS 18 Ca 0.45 0.63 -0.15 0.00 -0.15 0.00 0.00 55.06 55.84 2dar s HIS 18 Cb -0.08 -4.12 -0.04 0.00 1.11 0.00 0.00 32.58 29.44 2dar s HIS 18 CO 0.29 -2.95 0.33 0.42 -0.85 0.00 0.00 174.74 171.99 2dar s ILE 19 N 6.97 5.27 0.95 0.60 -1.09 -0.01 -5.00 121.20 128.91 2dar s ILE 19 Ca 0.80 0.61 -0.12 0.00 -2.23 0.00 0.00 60.65 59.71 2dar s ILE 19 Cb -0.22 -3.67 0.16 0.00 -1.58 0.00 0.00 42.46 37.15 2dar s ILE 19 CO 0.33 0.35 1.09 -2.16 -1.23 0.00 0.00 174.94 173.32 2dar s PRO 20 N 0.73 0.79 0.48 2.79 0.04 -1.26 -1.85 135.00 136.72 2dar s PRO 20 Ca 0.18 0.66 -0.21 0.00 0.04 0.00 0.00 61.00 61.67 2dar s PRO 20 Cb -0.14 -1.77 -0.08 0.00 0.04 0.00 0.00 34.50 32.56 2dar s PRO 20 CO 0.06 -2.52 1.08 0.00 0.04 0.00 0.00 177.00 175.65 2dar s ALA 21 N -2.94 2.87 0.00 8.56 0.00 -1.26 -3.56 121.76 125.42 2dar s ALA 21 Ca 0.64 0.71 0.00 0.00 0.00 0.00 0.00 51.96 53.31 2dar s ALA 21 Cb -0.18 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.64 2dar s ALA 21 CO 0.57 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 176.30 2dar n GLY 22 N 0.01 1.80 0.33 0.00 0.00 -1.25 -4.82 105.19 101.26 2dar n GLY 22 Ca 0.09 -0.28 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 2dar n GLY 22 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2dar h LYS 23 N 0.00 -0.09 -3.21 1.61 1.63 -1.93 -3.43 116.57 111.15 2dar h LYS 23 Ca 0.00 0.01 -0.11 0.00 -0.85 0.00 0.00 60.65 59.69 2dar h LYS 23 Cb 0.00 0.02 -0.19 0.00 -0.60 0.00 0.00 32.23 31.46 2dar h LYS 23 CO 0.00 -0.06 -0.30 0.50 -3.45 0.00 0.00 179.45 176.14 2dar s ARG 24 N -4.93 0.69 -0.55 1.90 3.52 -1.26 -5.10 118.95 113.22 2dar s ARG 24 Ca -0.10 -0.34 0.07 0.00 -0.13 0.00 0.00 55.73 55.23 2dar s ARG 24 Cb 0.08 0.30 0.28 0.00 -1.56 0.00 0.00 34.95 34.05 2dar s ARG 24 CO 0.47 -0.20 0.75 0.25 -0.81 0.00 0.00 175.30 175.76 2dar n THR 25 N 1.05 1.68 -0.78 4.11 -2.24 -1.26 -4.90 114.28 111.94 2dar n THR 25 Ca -0.21 -5.01 -0.16 0.00 -2.27 0.00 0.00 64.05 56.40 2dar n THR 25 Cb 0.57 -1.72 0.13 0.00 -2.10 0.00 0.00 70.33 67.21 2dar n THR 25 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2dar n PRO 26 N 0.64 -2.17 -3.83 -0.78 -0.04 -1.26 -4.38 135.00 123.18 2dar n PRO 26 Ca 0.28 -0.93 -0.36 0.00 -0.04 0.00 0.00 63.50 62.45 2dar n PRO 26 Cb 0.45 -0.87 -0.12 0.00 -0.04 0.00 0.00 33.50 32.92 2dar n PRO 26 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2dar s MET 27 N -4.32 3.68 1.08 0.54 -1.94 -1.26 -1.86 119.30 115.21 2dar s MET 27 Ca 0.38 -0.47 -0.22 0.00 -1.71 0.00 0.00 55.69 53.67 2dar s MET 27 Cb -0.04 -3.27 -0.00 0.00 2.01 0.00 0.00 34.83 33.53 2dar s MET 27 CO 0.29 -0.11 -0.57 0.00 -0.01 0.00 0.00 175.02 174.62 2dar n ALA 29 N -4.11 1.58 0.02 0.00 0.00 -0.54 -3.66 120.51 113.79 2dar n ALA 29 Ca -0.00 -0.84 -0.01 0.00 0.00 0.00 0.00 53.44 52.58 2dar n ALA 29 Cb 0.67 0.04 -0.01 0.00 0.00 0.00 0.00 19.45 20.16 2dar n ALA 29 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2dar h HIS 30 N 0.00 -0.09 0.00 0.00 -0.00 -1.93 -3.37 115.15 109.76 2dar h HIS 30 Ca -0.44 -0.00 -0.12 0.00 -0.00 0.00 0.00 60.37 59.81 2dar h HIS 30 Cb 1.68 0.03 -0.02 0.00 -0.00 0.00 0.00 27.41 29.11 2dar h HIS 30 CO 0.02 -0.05 -0.57 0.00 -0.00 0.00 0.00 177.93 177.33 2dar n ASN 32 N -3.28 -2.05 -4.16 0.00 5.15 -1.24 -4.99 115.26 104.69 2dar n ASN 32 Ca 0.01 -0.55 -0.24 0.00 -0.60 0.00 0.00 54.58 53.20 2dar n ASN 32 Cb 0.74 -4.61 -0.15 0.00 -0.53 0.00 0.00 39.78 35.23 2dar n ASN 32 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2dar s GLN 33 N -5.21 1.32 0.11 1.20 -1.52 -1.26 -4.71 119.66 109.59 2dar s GLN 33 Ca 0.00 -0.62 -0.36 0.00 -1.95 0.00 0.00 55.36 52.44 2dar s GLN 33 Cb -0.00 -1.29 -0.16 0.00 -0.22 0.00 0.00 33.01 31.34 2dar s GLN 33 CO 0.65 0.35 1.32 1.55 -0.25 0.00 0.00 175.29 178.91 2dar n VAL 34 N 2.58 0.21 -3.53 1.09 3.14 -1.26 -2.65 118.33 117.92 2dar n VAL 34 Ca -0.15 -0.05 -0.38 0.00 -2.96 0.00 0.00 64.34 60.80 2dar n VAL 34 Cb 0.54 -0.90 -0.09 0.00 -1.06 0.00 0.00 33.84 32.33 2dar n VAL 34 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 2dar s ILE 35 N 0.36 5.27 -0.16 1.55 1.01 -0.78 -4.93 121.20 123.52 2dar s ILE 35 Ca 0.81 0.37 -0.18 0.00 0.00 0.00 0.00 60.65 61.66 2dar s ILE 35 Cb -0.90 -3.60 -0.23 0.00 0.01 0.00 0.00 42.46 37.74 2dar s ILE 35 CO 0.47 0.26 0.37 0.03 0.00 0.00 0.00 174.94 176.07 2dar h ARG 36 N 7.88 0.11 0.00 2.79 3.08 -1.91 -3.39 114.38 122.94 2dar h ARG 36 Ca -0.35 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 59.50 2dar h ARG 36 Cb 1.17 0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.29 2dar h ARG 36 CO 0.64 1.09 0.00 0.41 -1.07 0.00 0.00 179.97 181.04 2dar n GLY 37 N 1.63 0.20 3.75 0.04 0.00 -1.26 -3.86 105.19 105.69 2dar n GLY 37 Ca -0.29 -1.73 -0.41 0.00 0.00 0.00 0.00 46.02 43.59 2dar n GLY 37 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dar s PRO 38 N 0.92 4.42 0.37 1.61 0.04 -1.26 -4.52 135.00 136.57 2dar s PRO 38 Ca 0.00 2.05 0.04 0.00 0.04 0.00 0.00 61.00 63.13 2dar s PRO 38 Cb 0.00 -3.17 -0.05 0.00 0.04 0.00 0.00 34.50 31.32 2dar s PRO 38 CO 0.00 -0.18 0.06 -0.59 0.04 0.00 0.00 177.00 176.33 2dar s PHE 39 N -0.30 1.99 -0.17 0.56 -0.12 -0.77 -4.59 117.98 114.59 2dar s PHE 39 Ca 0.53 -0.99 -0.00 0.00 -0.05 0.00 0.00 56.93 56.43 2dar s PHE 39 Cb -0.36 -1.35 -0.00 0.00 -0.63 0.00 0.00 43.02 40.67 2dar s PHE 39 CO 0.41 0.02 -0.14 -0.51 -0.05 0.00 0.00 175.22 174.96 2dar s LEU 40 N -3.57 2.51 -0.32 -1.99 1.43 -0.81 -0.83 118.68 115.10 2dar s LEU 40 Ca 0.31 -0.47 -0.11 0.00 -1.03 0.00 0.00 54.13 52.83 2dar s LEU 40 Cb 0.07 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.70 2dar s LEU 40 CO 0.15 0.06 0.19 0.54 0.23 0.00 0.00 176.35 177.52 2dar s VAL 41 N 0.94 4.93 0.08 -1.59 0.11 -1.15 -0.81 120.40 122.91 2dar s VAL 41 Ca -0.03 -0.32 -0.19 0.00 -2.93 0.00 0.00 61.98 58.51 2dar s VAL 41 Cb -0.15 -3.52 0.04 0.00 -1.53 0.00 0.00 36.38 31.22 2dar s VAL 41 CO -0.02 0.03 0.46 0.00 -3.33 0.00 0.00 175.10 172.24 2dar s ALA 42 N 1.67 -1.14 -1.61 1.54 0.00 0.11 -2.72 121.76 119.60 2dar s ALA 42 Ca 0.05 0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.31 2dar s ALA 42 Cb -0.17 0.52 0.00 0.00 0.00 0.00 0.00 23.12 23.47 2dar s ALA 42 CO 0.08 -0.56 0.00 1.28 0.00 0.00 0.00 175.76 176.56 2dar n LEU 43 N 0.16 -1.55 -1.55 0.00 7.99 -1.26 -1.13 117.00 119.66 2dar n LEU 43 Ca -0.17 0.17 -0.11 0.00 -0.01 0.00 0.00 56.01 55.88 2dar n LEU 43 Cb 0.62 -2.61 0.02 0.00 -0.11 0.00 0.00 43.42 41.34 2dar n LEU 43 CO 0.18 -0.39 -0.02 0.61 -1.51 0.00 0.00 177.39 176.27 2dar n GLY 44 N -0.77 0.08 3.78 -0.72 0.00 -1.26 -5.01 105.19 101.29 2dar n GLY 44 Ca -0.20 -0.35 -0.06 0.00 0.00 0.00 0.00 46.02 45.41 2dar n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dar s LYS 45 N -5.03 1.52 0.21 1.61 1.02 -0.28 -5.18 119.74 113.61 2dar s LYS 45 Ca 0.13 -0.82 0.06 0.00 0.02 0.00 0.00 55.97 55.37 2dar s LYS 45 Cb -0.06 0.53 -0.04 0.00 -0.52 0.00 0.00 37.83 37.75 2dar s LYS 45 CO 0.16 -0.69 0.15 -1.54 -0.92 0.00 0.00 175.35 172.51 2dar s SER 46 N -2.90 5.40 0.16 2.83 1.04 -1.26 0.04 113.70 119.02 2dar s SER 46 Ca 0.10 -0.24 -0.13 0.00 0.48 0.00 0.00 55.95 56.17 2dar s SER 46 Cb -0.04 -1.35 0.01 0.00 0.10 0.00 0.00 66.02 64.74 2dar s SER 46 CO 0.03 0.01 0.37 0.26 0.98 0.00 0.00 173.24 174.90 2dar s TRP 47 N -1.97 0.13 0.00 5.02 0.52 0.01 -1.47 118.94 121.18 2dar s TRP 47 Ca 0.32 -0.49 -0.21 0.00 0.02 0.00 0.00 56.10 55.74 2dar s TRP 47 Cb -0.09 0.13 -0.05 0.00 -1.15 0.00 0.00 33.47 32.31 2dar s TRP 47 CO 0.24 -0.77 0.60 -1.01 0.02 0.00 0.00 176.95 176.03 2dar s HIS 48 N -3.91 3.69 -2.00 -1.98 3.76 -1.26 -1.92 115.29 111.67 2dar s HIS 48 Ca 0.12 1.22 0.14 0.00 -0.15 0.00 0.00 55.06 56.38 2dar s HIS 48 Cb 0.02 -2.61 0.84 0.00 1.11 0.00 0.00 32.58 31.93 2dar s HIS 48 CO -0.03 0.36 1.26 -0.35 -0.85 0.00 0.00 174.74 175.12 2dar n PRO 49 N 2.69 0.48 -0.06 8.40 -0.04 -1.26 -0.56 135.00 144.65 2dar n PRO 49 Ca -0.07 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.35 2dar n PRO 49 Cb 0.51 -1.45 -0.11 0.00 -0.04 0.00 0.00 33.50 32.41 2dar n PRO 49 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2dar n GLU 50 N -0.95 1.56 -0.10 0.54 1.02 -1.26 -4.67 120.64 116.78 2dar n GLU 50 Ca 0.11 -0.03 -0.19 0.00 -0.02 0.00 0.00 57.16 57.03 2dar n GLU 50 Cb 0.05 -1.35 -0.12 0.00 -0.02 0.00 0.00 31.44 29.99 2dar n GLU 50 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2dar n GLU 51 N -2.44 0.67 -1.51 3.49 1.02 -0.97 -4.88 120.64 116.02 2dar n GLU 51 Ca -0.19 0.18 -0.30 0.00 -0.02 0.00 0.00 57.16 56.83 2dar n GLU 51 Cb 0.86 -1.56 -0.17 0.00 -0.02 0.00 0.00 31.44 30.55 2dar n GLU 51 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2dar n PHE 52 N -3.37 0.41 -4.18 -0.32 7.35 0.27 -4.84 117.46 112.79 2dar n PHE 52 Ca -0.44 0.17 -0.11 0.00 -0.76 0.00 0.00 57.45 56.31 2dar n PHE 52 Cb 0.99 -1.59 -0.10 0.00 0.35 0.00 0.00 39.48 39.13 2dar n PHE 52 CO 0.00 0.00 0.00 -0.80 -0.76 0.00 0.00 176.76 175.20 2dar s ASN 53 N 5.39 1.11 1.24 -2.13 0.01 -1.26 -2.97 114.94 116.32 2dar s ASN 53 Ca 1.29 -1.04 -0.14 0.00 -0.71 0.00 0.00 52.86 52.25 2dar s ASN 53 Cb -0.93 0.11 0.31 0.00 0.41 0.00 0.00 41.25 41.15 2dar s ASN 53 CO 0.48 -0.50 0.97 0.00 -1.51 0.00 0.00 177.10 176.54 2dar n ALA 55 N -5.16 2.27 -0.04 0.00 0.00 -1.14 -3.48 120.51 112.97 2dar n ALA 55 Ca 0.03 -0.68 -0.07 0.00 0.00 0.00 0.00 53.44 52.73 2dar n ALA 55 Cb 0.55 -0.71 -0.02 0.00 0.00 0.00 0.00 19.45 19.26 2dar n ALA 55 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2dar n HIS 56 N -2.57 0.00 1.67 0.00 -0.00 -1.26 -4.62 115.22 108.43 2dar n HIS 56 Ca -0.12 0.00 0.15 0.00 -0.00 0.00 0.00 57.72 57.75 2dar n HIS 56 Cb 0.77 -0.34 0.74 0.00 -0.00 0.00 0.00 29.99 31.16 2dar n HIS 56 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2dar n LYS 58 N -0.77 -0.91 -4.02 0.00 4.76 -1.23 -4.83 118.16 111.17 2dar n LYS 58 Ca 0.19 0.05 -0.22 0.00 -2.87 0.00 0.00 58.31 55.46 2dar n LYS 58 Cb 0.22 -2.47 -0.05 0.00 -1.84 0.00 0.00 35.03 30.89 2dar n LYS 58 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2dar s ASN 59 N -3.99 4.92 -0.06 4.39 0.01 -1.26 -4.56 114.94 114.38 2dar s ASN 59 Ca 0.03 -0.65 -0.29 0.00 -0.71 0.00 0.00 52.86 51.25 2dar s ASN 59 Cb -0.02 -0.85 -0.07 0.00 0.41 0.00 0.00 41.25 40.72 2dar s ASN 59 CO 0.72 -0.28 1.97 0.28 -1.51 0.00 0.00 177.10 178.27 2dar s THR 60 N -2.36 3.14 -0.55 1.60 -1.32 -1.26 -0.94 115.64 113.94 2dar s THR 60 Ca 0.38 0.16 0.01 0.00 -1.21 0.00 0.00 61.69 61.03 2dar s THR 60 Cb -0.04 -3.12 0.46 0.00 -1.51 0.00 0.00 72.50 68.29 2dar s THR 60 CO 0.24 -0.04 1.79 0.23 -2.21 0.00 0.00 174.62 174.63 2dar n MET 61 N 7.82 2.89 -0.07 7.08 2.81 -1.16 -4.62 117.12 131.86 2dar n MET 61 Ca 0.22 -3.51 -0.09 0.00 -1.81 0.00 0.00 57.70 52.51 2dar n MET 61 Cb 0.43 -2.27 -0.05 0.00 -0.71 0.00 0.00 33.22 30.62 2dar n MET 61 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2dar h ALA 62 N 1.97 0.06 0.04 3.04 0.00 -1.90 -3.42 119.26 119.05 2dar h ALA 62 Ca 0.54 -0.53 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2dar h ALA 62 Cb 1.12 0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.24 2dar h ALA 62 CO 1.32 0.33 -0.02 1.88 0.00 0.00 0.00 179.25 182.76 2dar h TYR 63 N -1.00 -0.05 -3.19 0.00 -1.99 -1.97 -3.43 116.97 105.34 2dar h TYR 63 Ca -0.08 -0.00 -0.42 0.00 2.00 0.00 0.00 58.73 60.23 2dar h TYR 63 Cb 0.63 0.02 0.21 0.00 2.00 0.00 0.00 36.73 39.59 2dar h TYR 63 CO -0.00 0.23 -0.03 0.96 -0.00 0.00 0.00 178.16 179.32 2dar s ILE 64 N -1.96 1.74 0.00 -2.88 -4.36 -1.26 -4.96 121.20 107.52 2dar s ILE 64 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 60.65 60.33 2dar s ILE 64 Cb -0.01 -2.09 0.00 0.00 1.25 0.00 0.00 42.46 41.61 2dar s ILE 64 CO 0.21 0.00 0.00 0.61 0.24 0.00 0.00 174.94 176.00 2dar n GLY 65 N 0.89 0.67 3.54 6.27 0.00 -1.26 -4.84 105.19 110.46 2dar n GLY 65 Ca 0.06 -1.92 -0.10 0.00 0.00 0.00 0.00 46.02 44.05 2dar n GLY 65 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2dar s PHE 66 N 0.34 -0.38 -0.07 1.61 -0.12 -0.93 -3.61 117.98 114.82 2dar s PHE 66 Ca 0.00 0.49 0.02 0.00 -0.05 0.00 0.00 56.93 57.39 2dar s PHE 66 Cb 0.00 0.48 0.01 0.00 -0.63 0.00 0.00 43.02 42.89 2dar s PHE 66 CO 0.00 -0.44 -0.12 0.08 -0.05 0.00 0.00 175.22 174.68 2dar s VAL 67 N -1.98 1.16 0.16 -2.49 1.01 0.26 -1.92 120.40 116.60 2dar s VAL 67 Ca 0.01 -0.49 -0.22 0.00 0.00 0.00 0.00 61.98 61.27 2dar s VAL 67 Cb -0.01 -1.06 -0.08 0.00 0.00 0.00 0.00 36.38 35.24 2dar s VAL 67 CO -0.02 0.36 0.71 -0.70 0.00 0.00 0.00 175.10 175.45 2dar s GLU 68 N 0.66 4.38 -0.29 2.72 -6.30 -1.25 -0.08 118.70 118.54 2dar s GLU 68 Ca -0.15 0.96 0.01 0.00 -2.50 0.00 0.00 54.97 53.30 2dar s GLU 68 Cb -0.16 -3.12 0.18 0.00 0.00 0.00 0.00 34.13 31.03 2dar s GLU 68 CO 0.04 0.53 0.53 -2.00 0.02 0.00 0.00 175.26 174.38 2dar s GLU 69 N -1.43 0.51 -1.48 4.30 2.12 0.16 -4.91 118.70 117.97 2dar s GLU 69 Ca 0.37 0.67 -0.11 0.00 0.36 0.00 0.00 54.97 56.26 2dar s GLU 69 Cb -0.20 0.17 0.07 0.00 0.26 0.00 0.00 34.13 34.42 2dar s GLU 69 CO 0.23 -0.80 0.91 1.63 -0.54 0.00 0.00 175.26 176.68 2dar n LYS 70 N 5.40 -5.35 -2.33 4.30 4.76 -1.26 -2.53 118.16 121.16 2dar n LYS 70 Ca 0.00 0.60 -0.04 0.00 -2.87 0.00 0.00 58.31 56.00 2dar n LYS 70 Cb 0.51 -5.40 0.02 0.00 -1.84 0.00 0.00 35.03 28.33 2dar n LYS 70 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dar n GLY 71 N -1.68 0.26 3.55 0.72 0.00 -1.26 -5.07 105.19 101.71 2dar n GLY 71 Ca -0.04 -0.34 -0.05 0.00 0.00 0.00 0.00 46.02 45.59 2dar n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dar s ALA 72 N -3.08 -1.75 -0.25 4.61 0.00 -1.05 -5.14 121.76 115.10 2dar s ALA 72 Ca 0.00 2.15 -0.15 0.00 0.00 0.00 0.00 51.96 53.97 2dar s ALA 72 Cb -0.00 -1.50 -0.04 0.00 0.00 0.00 0.00 23.12 21.58 2dar s ALA 72 CO 0.17 -0.65 0.38 -0.51 0.00 0.00 0.00 175.76 175.15 2dar s LEU 73 N 2.28 4.07 -0.16 0.00 1.43 -1.26 -0.67 118.68 124.38 2dar s LEU 73 Ca -0.07 0.36 0.01 0.00 -1.03 0.00 0.00 54.13 53.40 2dar s LEU 73 Cb -0.09 -2.45 0.01 0.00 0.03 0.00 0.00 46.19 43.69 2dar s LEU 73 CO -0.18 -0.15 -0.19 -0.31 0.23 0.00 0.00 176.35 175.75 2dar s TYR 74 N 1.83 2.75 0.59 0.29 2.02 0.88 -2.87 117.35 122.85 2dar s TYR 74 Ca 0.16 -1.42 -0.19 0.00 -0.37 0.00 0.00 57.07 55.25 2dar s TYR 74 Cb -0.15 -1.89 -0.03 0.00 -0.40 0.00 0.00 41.96 39.48 2dar s TYR 74 CO 0.09 -0.68 1.27 0.00 -1.57 0.00 0.00 175.55 174.66 2dar n GLU 76 N -1.50 -0.06 0.36 0.00 0.28 -1.24 -0.09 120.64 118.40 2dar n GLU 76 Ca 0.13 1.26 -0.19 0.00 -0.16 0.00 0.00 57.16 58.21 2dar n GLU 76 Cb 0.48 -2.21 -0.10 0.00 1.43 0.00 0.00 31.44 31.04 2dar n GLU 76 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 2dar h LEU 77 N 0.00 -1.27 -0.29 -1.84 3.38 -1.91 0.16 115.31 113.53 2dar h LEU 77 Ca 0.72 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.83 2dar h LEU 77 Cb 1.84 0.39 -0.05 0.00 0.09 0.00 0.00 40.66 42.93 2dar h LEU 77 CO -0.72 -0.70 -0.05 0.00 0.09 0.00 0.00 178.44 177.05 2dar h TYR 79 N 0.02 -0.76 -0.33 0.00 5.03 -1.07 0.18 116.97 120.04 2dar h TYR 79 Ca 0.14 0.01 0.10 0.00 2.58 0.00 0.00 58.73 61.55 2dar h TYR 79 Cb 0.21 0.30 -0.01 0.00 1.55 0.00 0.00 36.73 38.77 2dar h TYR 79 CO -0.26 -0.36 0.53 1.49 -1.32 0.00 0.00 178.16 178.23 2dar h GLU 80 N -0.54 0.00 0.03 1.82 4.57 -0.57 1.68 114.58 121.56 2dar h GLU 80 Ca -0.03 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.09 2dar h GLU 80 Cb 0.47 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.07 2dar h GLU 80 CO -0.04 0.00 -0.22 0.87 -1.18 0.00 0.00 179.01 178.44 2dar h LYS 81 N 0.00 0.10 0.00 1.92 1.57 0.09 -3.16 116.57 117.09 2dar h LYS 81 Ca 0.16 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 2dar h LYS 81 Cb 1.22 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.57 2dar h LYS 81 CO -0.00 1.02 -0.62 0.74 -0.57 0.00 0.00 179.45 180.02 2dar h PHE 82 N -0.75 0.00 0.19 -1.35 0.04 0.15 -3.39 116.94 111.82 2dar h PHE 82 Ca -0.04 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 2dar h PHE 82 Cb 1.12 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.27 2dar h PHE 82 CO 0.24 0.47 -0.12 0.74 -0.60 0.00 0.00 178.31 179.03 2dar h PHE 83 N -1.00 -0.32 -0.41 -0.55 -1.00 0.22 -3.29 116.94 110.59 2dar h PHE 83 Ca -0.10 -0.00 -0.68 0.00 2.81 0.00 0.00 57.97 60.00 2dar h PHE 83 Cb 0.69 0.12 -0.05 0.00 3.61 0.00 0.00 35.95 40.31 2dar h PHE 83 CO -0.07 -0.18 2.60 0.00 -1.61 0.00 0.00 178.31 179.05 2dar n ALA 84 N -2.27 4.39 -2.30 2.45 0.00 -1.12 -4.91 120.51 116.76 2dar n ALA 84 Ca -0.04 -3.81 -0.34 0.00 0.00 0.00 0.00 53.44 49.26 2dar n ALA 84 Cb 0.12 -3.57 -0.04 0.00 0.00 0.00 0.00 19.45 15.96 2dar n ALA 84 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2dar s SER 85 N 3.87 5.80 1.04 0.00 0.01 -1.24 -4.47 113.70 118.72 2dar s SER 85 Ca 0.51 -1.09 -0.07 0.00 1.31 0.00 0.00 55.95 56.62 2dar s SER 85 Cb 0.09 -2.57 0.10 0.00 0.21 0.00 0.00 66.02 63.85 2dar s SER 85 CO 0.01 -2.15 0.45 0.61 0.41 0.00 0.00 173.24 172.57 2dar n GLY 86 N 6.82 -1.85 3.74 3.44 0.00 -1.26 -4.99 105.19 111.09 2dar n GLY 86 Ca 0.37 -1.59 -0.41 0.00 0.00 0.00 0.00 46.02 44.39 2dar n GLY 86 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dar s PRO 87 N -4.00 4.41 -0.24 1.61 0.04 -1.26 -5.02 135.00 130.53 2dar s PRO 87 Ca 0.27 2.05 -0.06 0.00 0.04 0.00 0.00 61.00 63.30 2dar s PRO 87 Cb -0.02 -3.18 -0.02 0.00 0.04 0.00 0.00 34.50 31.32 2dar s PRO 87 CO 0.20 -0.20 0.04 -1.12 0.04 0.00 0.00 177.00 175.95 2dar s SER 88 N 0.14 4.89 0.26 6.66 0.01 -1.26 -4.99 113.70 119.41 2dar s SER 88 Ca 0.55 -0.26 -0.02 0.00 1.31 0.00 0.00 55.95 57.53 2dar s SER 88 Cb -0.36 -1.87 0.53 0.00 0.21 0.00 0.00 66.02 64.53 2dar s SER 88 CO 0.40 -0.03 1.74 -1.28 0.41 0.00 0.00 173.24 174.48 2dar h SER 89 N 8.20 0.40 0.00 2.44 0.87 -2.07 -3.57 113.55 119.82 2dar h SER 89 Ca -0.39 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.28 2dar h SER 89 Cb 1.17 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 2dar h SER 89 CO 0.59 0.14 0.00 0.61 -0.53 0.00 0.00 176.83 177.64