#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 4.36 0.04 1.61 0.15 -1.26 -5.16 113.70 113.44 2dar s SER 2 Ca 0.00 -1.43 0.02 0.00 0.70 0.00 0.00 55.95 55.24 2dar s SER 2 Cb 0.00 0.38 -0.02 0.00 -1.71 0.00 0.00 66.02 64.66 2dar s SER 2 CO 0.00 -0.92 -0.08 -0.94 1.20 0.00 0.00 173.24 172.50 2dar s SER 3 N -4.04 0.87 0.00 5.45 1.04 -1.26 -5.16 113.70 110.59 2dar s SER 3 Ca 0.21 -0.50 0.00 0.00 0.48 0.00 0.00 55.95 56.14 2dar s SER 3 Cb 0.00 0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.14 2dar s SER 3 CO 0.12 -0.17 0.00 0.61 0.98 0.00 0.00 173.24 174.79 2dar n GLY 4 N 1.63 1.70 3.48 7.32 0.00 -1.26 -5.03 105.19 113.03 2dar n GLY 4 Ca -0.22 -1.90 -0.43 0.00 0.00 0.00 0.00 46.02 43.48 2dar n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dar s SER 5 N -1.00 6.26 -0.53 1.61 1.04 -1.26 -4.99 113.70 114.83 2dar s SER 5 Ca 0.00 -0.71 -0.27 0.00 0.48 0.00 0.00 55.95 55.45 2dar s SER 5 Cb 0.00 -2.38 -0.03 0.00 0.10 0.00 0.00 66.02 63.71 2dar s SER 5 CO 0.00 -1.17 1.90 -0.55 0.98 0.00 0.00 173.24 174.40 2dar s SER 6 N 3.03 5.34 0.71 7.02 0.15 -1.26 -4.97 113.70 123.72 2dar s SER 6 Ca 0.23 0.66 -0.07 0.00 0.70 0.00 0.00 55.95 57.47 2dar s SER 6 Cb -0.16 -2.53 0.06 0.00 -1.71 0.00 0.00 66.02 61.69 2dar s SER 6 CO 0.14 -2.26 1.03 -0.83 1.20 0.00 0.00 173.24 172.52 2dar s GLY 7 N 8.00 1.68 -0.03 9.45 0.00 -1.26 -5.11 107.32 120.05 2dar s GLY 7 Ca 0.73 -0.91 -0.10 0.00 0.00 0.00 0.00 44.72 44.45 2dar s GLY 7 CO 0.24 -0.50 0.22 -0.35 0.00 0.00 0.00 173.10 172.72 2dar s ASP 8 N -4.52 -0.12 -0.02 1.64 -1.08 -1.26 -5.12 116.67 106.19 2dar s ASP 8 Ca 0.60 0.11 -0.30 0.00 -0.52 0.00 0.00 52.55 52.44 2dar s ASP 8 Cb -0.11 0.33 -0.08 0.00 -1.46 0.00 0.00 42.92 41.60 2dar s ASP 8 CO 0.45 -0.29 1.97 -1.10 0.52 0.00 0.00 175.17 176.72 2dar s GLN 9 N -0.85 3.98 -0.29 4.34 -0.21 -1.26 -4.86 119.66 120.52 2dar s GLN 9 Ca -0.09 2.46 0.07 0.00 0.02 0.00 0.00 55.36 57.82 2dar s GLN 9 Cb -0.05 -4.18 0.60 0.00 1.00 0.00 0.00 33.01 30.38 2dar s GLN 9 CO 0.02 -1.13 1.64 -0.25 -2.12 0.00 0.00 175.29 173.44 2dar n ASP 10 N 8.17 4.16 -3.91 5.90 8.00 -1.26 -4.88 116.55 132.72 2dar n ASP 10 Ca 0.21 -3.05 -0.12 0.00 0.71 0.00 0.00 54.79 52.54 2dar n ASP 10 Cb 0.42 -0.72 -0.13 0.00 -0.02 0.00 0.00 41.12 40.67 2dar n ASP 10 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2dar s THR 11 N -2.55 0.11 0.61 -3.53 2.01 -1.26 -5.01 115.64 106.01 2dar s THR 11 Ca 0.45 -0.22 0.39 0.00 0.31 0.00 0.00 61.69 62.61 2dar s THR 11 Cb 0.36 -0.13 0.39 0.00 0.01 0.00 0.00 72.50 73.13 2dar s THR 11 CO 0.11 -0.08 2.19 0.17 -0.69 0.00 0.00 174.62 176.32 2dar h LEU 12 N 5.83 0.00 -9.80 4.42 -0.00 -1.98 -3.42 115.31 110.36 2dar h LEU 12 Ca -0.26 0.00 -0.54 0.00 -0.00 0.00 0.00 57.88 57.08 2dar h LEU 12 Cb 1.21 0.00 0.09 0.00 -0.00 0.00 0.00 40.66 41.95 2dar h LEU 12 CO 0.49 0.00 0.86 0.52 -0.00 0.00 0.00 178.44 180.31 2dar n VAL 13 N -2.96 1.11 -4.28 0.15 0.31 -1.26 -4.90 118.33 106.50 2dar n VAL 13 Ca -0.03 -0.28 -0.29 0.00 -0.01 0.00 0.00 64.34 63.73 2dar n VAL 13 Cb 0.16 -1.95 -0.04 0.00 -0.91 0.00 0.00 33.84 31.10 2dar n VAL 13 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2dar s GLN 14 N -0.65 2.23 -0.10 5.55 -0.21 -0.45 -4.89 119.66 121.14 2dar s GLN 14 Ca 0.63 -2.19 -0.04 0.00 0.02 0.00 0.00 55.36 53.78 2dar s GLN 14 Cb -0.50 -1.85 0.05 0.00 1.00 0.00 0.00 33.01 31.72 2dar s GLN 14 CO 0.50 -0.50 0.22 1.03 -2.12 0.00 0.00 175.29 174.42 2dar s ARG 15 N -4.10 0.13 0.67 2.91 0.52 -1.26 -2.05 118.95 115.76 2dar s ARG 15 Ca 0.21 0.60 -0.17 0.00 -0.52 0.00 0.00 55.73 55.86 2dar s ARG 15 Cb -0.00 -0.13 0.00 0.00 0.52 0.00 0.00 34.95 35.34 2dar s ARG 15 CO 0.13 -0.24 1.21 0.00 0.02 0.00 0.00 175.30 176.42 2dar s ALA 16 N 1.92 2.33 -0.37 2.13 0.00 -1.26 -4.96 121.76 121.55 2dar s ALA 16 Ca -0.02 0.94 -0.15 0.00 0.00 0.00 0.00 51.96 52.72 2dar s ALA 16 Cb -0.12 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.55 2dar s ALA 16 CO -0.08 -1.54 0.34 -2.00 0.00 0.00 0.00 175.76 172.49 2dar s GLU 17 N -3.66 3.31 0.06 0.00 2.12 -0.86 -4.91 118.70 114.77 2dar s GLU 17 Ca 0.76 -0.67 -0.30 0.00 0.36 0.00 0.00 54.97 55.11 2dar s GLU 17 Cb -0.30 -3.88 -0.09 0.00 0.26 0.00 0.00 34.13 30.13 2dar s GLU 17 CO 0.40 -0.63 1.78 -1.01 -0.54 0.00 0.00 175.26 175.25 2dar s HIS 18 N 1.91 2.00 -0.17 5.30 3.76 -1.26 -2.97 115.29 123.86 2dar s HIS 18 Ca 0.09 0.02 -0.01 0.00 -0.15 0.00 0.00 55.06 55.01 2dar s HIS 18 Cb -0.17 -4.08 -0.00 0.00 1.11 0.00 0.00 32.58 29.43 2dar s HIS 18 CO 0.12 -4.54 -0.11 0.42 -0.85 0.00 0.00 174.74 169.77 2dar s ILE 19 N 3.32 2.95 0.88 0.60 -1.09 -0.14 -5.02 121.20 122.70 2dar s ILE 19 Ca 0.79 -0.66 -0.11 0.00 -2.23 0.00 0.00 60.65 58.43 2dar s ILE 19 Cb -0.41 -2.28 0.12 0.00 -1.58 0.00 0.00 42.46 38.31 2dar s ILE 19 CO 0.35 0.49 1.09 -2.16 -1.23 0.00 0.00 174.94 173.48 2dar s PRO 20 N 0.98 1.37 0.79 2.79 0.04 -1.26 -1.19 135.00 138.51 2dar s PRO 20 Ca -0.02 0.86 -0.11 0.00 0.04 0.00 0.00 61.00 61.78 2dar s PRO 20 Cb -0.15 -1.82 0.07 0.00 0.04 0.00 0.00 34.50 32.64 2dar s PRO 20 CO -0.01 -2.17 1.09 0.00 0.04 0.00 0.00 177.00 175.94 2dar s ALA 21 N -2.93 2.17 0.00 8.56 0.00 -1.26 -3.68 121.76 124.61 2dar s ALA 21 Ca 0.63 0.15 0.00 0.00 0.00 0.00 0.00 51.96 52.74 2dar s ALA 21 Cb -0.18 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.71 2dar s ALA 21 CO 0.57 -1.81 0.00 0.41 0.00 0.00 0.00 175.76 174.92 2dar n GLY 22 N -1.35 1.32 0.35 0.00 0.00 -1.25 -4.64 105.19 99.62 2dar n GLY 22 Ca 0.08 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.20 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 0.80 -1.92 1.61 1.63 -1.94 -3.43 116.57 113.32 2dar h LYS 23 Ca 0.00 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.74 2dar h LYS 23 Cb 0.00 -0.18 -0.22 0.00 -0.60 0.00 0.00 32.23 31.23 2dar h LYS 23 CO 0.00 0.53 0.19 1.03 -3.45 0.00 0.00 179.45 177.74 2dar s ARG 24 N -5.91 0.76 -0.45 1.90 0.52 -1.26 -5.09 118.95 109.42 2dar s ARG 24 Ca -0.12 0.93 0.09 0.00 -0.52 0.00 0.00 55.73 56.12 2dar s ARG 24 Cb 0.24 0.35 0.33 0.00 0.52 0.00 0.00 34.95 36.39 2dar s ARG 24 CO 0.80 -0.10 0.78 0.25 0.02 0.00 0.00 175.30 177.06 2dar n THR 25 N 2.73 0.97 -1.14 0.02 -2.24 -1.26 -4.85 114.28 108.52 2dar n THR 25 Ca -0.14 -4.90 -0.29 0.00 -2.27 0.00 0.00 64.05 56.45 2dar n THR 25 Cb 0.55 -0.87 0.20 0.00 -2.10 0.00 0.00 70.33 68.12 2dar n THR 25 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2dar s PRO 26 N -2.67 -0.09 -0.19 -0.78 0.04 -1.26 -4.07 135.00 125.98 2dar s PRO 26 Ca 0.43 0.34 -0.18 0.00 0.04 0.00 0.00 61.00 61.63 2dar s PRO 26 Cb 0.30 -1.69 -0.03 0.00 0.04 0.00 0.00 34.50 33.12 2dar s PRO 26 CO -0.10 -3.04 0.50 1.41 0.04 0.00 0.00 177.00 175.81 2dar s MET 27 N -5.08 4.22 1.08 4.56 1.75 -1.26 -0.07 119.30 124.49 2dar s MET 27 Ca 0.67 0.40 -0.20 0.00 -1.25 0.00 0.00 55.69 55.30 2dar s MET 27 Cb -0.16 -3.54 0.04 0.00 2.84 0.00 0.00 34.83 34.01 2dar s MET 27 CO 0.57 -0.08 -0.33 0.00 -0.65 0.00 0.00 175.02 174.53 2dar n ALA 29 N -4.22 1.62 0.11 0.00 0.00 -1.20 -3.66 120.51 113.16 2dar n ALA 29 Ca 0.01 -0.83 -0.05 0.00 0.00 0.00 0.00 53.44 52.56 2dar n ALA 29 Cb 0.62 0.16 -0.02 0.00 0.00 0.00 0.00 19.45 20.20 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 -0.45 -0.31 0.00 0.00 -0.00 -1.94 -3.32 115.15 109.13 2dar h HIS 30 Ca -0.49 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 59.87 2dar h HIS 30 Cb 1.55 0.10 0.00 0.00 -0.00 0.00 0.00 27.41 29.06 2dar h HIS 30 CO -0.03 -0.19 0.00 0.00 -0.00 0.00 0.00 177.93 177.71 2dar n ASN 32 N -2.88 -3.71 -4.24 0.00 5.15 -1.24 -4.98 115.26 103.36 2dar n ASN 32 Ca 0.04 -0.68 -0.29 0.00 -0.60 0.00 0.00 54.58 53.04 2dar n ASN 32 Cb 0.45 -4.55 -0.16 0.00 -0.53 0.00 0.00 39.78 34.99 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 -6.08 2.00 0.18 1.20 -1.52 -1.26 -4.70 119.66 109.48 2dar s GLN 33 Ca 0.32 -0.81 -0.33 0.00 -1.95 0.00 0.00 55.36 52.59 2dar s GLN 33 Cb -0.15 -1.84 -0.14 0.00 -0.22 0.00 0.00 33.01 30.66 2dar s GLN 33 CO 0.77 0.43 1.48 1.55 -0.25 0.00 0.00 175.29 179.28 2dar n VAL 34 N 2.70 0.37 -3.24 1.09 3.14 -1.26 -0.92 118.33 120.21 2dar n VAL 34 Ca -0.16 -0.09 -0.41 0.00 -2.96 0.00 0.00 64.34 60.71 2dar n VAL 34 Cb 0.52 -1.42 -0.08 0.00 -1.06 0.00 0.00 33.84 31.80 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 0.48 5.02 -0.14 1.55 1.01 0.89 -4.87 121.20 125.15 2dar s ILE 35 Ca 0.75 0.44 -0.21 0.00 0.00 0.00 0.00 60.65 61.64 2dar s ILE 35 Cb -0.70 -3.94 -0.25 0.00 0.01 0.00 0.00 42.46 37.59 2dar s ILE 35 CO 0.43 -0.16 0.51 0.03 0.00 0.00 0.00 174.94 175.75 2dar h ARG 36 N 8.38 0.12 0.00 2.79 3.08 -1.88 -3.36 114.38 123.51 2dar h ARG 36 Ca -0.28 -0.20 0.00 0.00 0.07 0.00 0.00 59.98 59.57 2dar h ARG 36 Cb 1.13 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.25 2dar h ARG 36 CO 0.76 1.10 0.00 0.41 -1.07 0.00 0.00 179.97 181.17 2dar n GLY 37 N 1.62 0.05 3.74 0.04 0.00 -1.26 -3.94 105.19 105.44 2dar n GLY 37 Ca -0.24 -1.73 -0.41 0.00 0.00 0.00 0.00 46.02 43.65 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 0.80 4.41 0.43 1.61 0.04 -1.26 -4.37 135.00 136.66 2dar s PRO 38 Ca 0.00 2.05 0.03 0.00 0.04 0.00 0.00 61.00 63.12 2dar s PRO 38 Cb 0.00 -3.17 -0.03 0.00 0.04 0.00 0.00 34.50 31.34 2dar s PRO 38 CO 0.00 -0.19 0.07 -0.59 0.04 0.00 0.00 177.00 176.33 2dar s PHE 39 N -0.23 1.88 -0.05 0.56 -0.12 -0.34 -4.55 117.98 115.15 2dar s PHE 39 Ca 0.54 -1.10 0.05 0.00 -0.05 0.00 0.00 56.93 56.38 2dar s PHE 39 Cb -0.36 -1.37 -0.02 0.00 -0.63 0.00 0.00 43.02 40.64 2dar s PHE 39 CO 0.41 -0.03 -0.20 -0.51 -0.05 0.00 0.00 175.22 174.83 2dar s LEU 40 N -3.69 2.36 -0.22 -1.99 1.43 -0.46 -0.96 118.68 115.15 2dar s LEU 40 Ca 0.20 -0.37 0.01 0.00 -1.03 0.00 0.00 54.13 52.94 2dar s LEU 40 Cb 0.03 -1.45 0.05 0.00 0.03 0.00 0.00 46.19 44.86 2dar s LEU 40 CO 0.11 0.30 -0.08 0.54 0.23 0.00 0.00 176.35 177.45 2dar s VAL 41 N -0.49 1.59 0.00 -1.59 0.11 -1.16 -0.32 120.40 118.54 2dar s VAL 41 Ca 0.06 -1.11 0.00 0.00 -2.93 0.00 0.00 61.98 58.00 2dar s VAL 41 Cb -0.11 -1.76 0.00 0.00 -1.53 0.00 0.00 36.38 32.98 2dar s VAL 41 CO 0.01 0.04 0.00 0.00 -3.33 0.00 0.00 175.10 171.82 2dar n ALA 42 N 4.68 2.49 -1.94 1.54 0.00 -1.19 -2.03 120.51 124.06 2dar n ALA 42 Ca -0.13 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.88 2dar n ALA 42 Cb 0.45 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.90 2dar n ALA 42 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dar n LEU 43 N -1.73 6.34 -3.77 0.00 7.99 -1.26 -4.56 117.00 120.01 2dar n LEU 43 Ca 0.00 -4.07 -0.30 0.00 -0.01 0.00 0.00 56.01 51.63 2dar n LEU 43 Cb 0.00 -1.68 -0.06 0.00 -0.11 0.00 0.00 43.42 41.57 2dar n LEU 43 CO 0.00 0.84 -0.17 0.61 -1.51 0.00 0.00 177.39 177.16 2dar n GLY 44 N 4.44 -0.25 3.82 -0.72 0.00 -1.26 -4.81 105.19 106.40 2dar n GLY 44 Ca 0.51 0.07 -0.06 0.00 0.00 0.00 0.00 46.02 46.55 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 -5.75 1.58 -0.11 1.61 1.02 -1.26 -5.16 119.74 111.67 2dar s LYS 45 Ca 0.48 -0.90 -0.01 0.00 0.02 0.00 0.00 55.97 55.56 2dar s LYS 45 Cb -0.28 0.52 -0.03 0.00 -0.52 0.00 0.00 37.83 37.53 2dar s LYS 45 CO 0.75 -0.73 -0.06 -1.54 -0.92 0.00 0.00 175.35 172.86 2dar s SER 46 N -2.96 4.69 0.00 2.83 1.04 -1.26 -3.14 113.70 114.89 2dar s SER 46 Ca 0.12 -0.08 0.04 0.00 0.48 0.00 0.00 55.95 56.51 2dar s SER 46 Cb -0.04 -1.48 -0.01 0.00 0.10 0.00 0.00 66.02 64.58 2dar s SER 46 CO 0.06 0.27 -0.12 0.26 0.98 0.00 0.00 173.24 174.68 2dar s TRP 47 N -0.22 1.10 0.27 5.02 0.52 0.56 -3.23 118.94 122.96 2dar s TRP 47 Ca 0.03 -0.24 -0.29 0.00 0.02 0.00 0.00 56.10 55.62 2dar s TRP 47 Cb -0.13 -0.70 -0.10 0.00 -1.15 0.00 0.00 33.47 31.40 2dar s TRP 47 CO 0.03 -0.01 1.34 -1.01 0.02 0.00 0.00 176.95 177.31 2dar s HIS 48 N -0.40 3.11 -2.00 -1.98 3.76 -1.26 -1.35 115.29 115.17 2dar s HIS 48 Ca 0.04 1.26 0.11 0.00 -0.15 0.00 0.00 55.06 56.32 2dar s HIS 48 Cb -0.05 -3.69 0.64 0.00 1.11 0.00 0.00 32.58 30.60 2dar s HIS 48 CO -0.00 -2.05 1.08 -0.35 -0.85 0.00 0.00 174.74 172.57 2dar n PRO 49 N 1.74 0.49 -0.11 8.40 -0.04 -1.26 -0.99 135.00 143.23 2dar n PRO 49 Ca 0.04 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.29 2dar n PRO 49 Cb 0.42 -1.35 -0.09 0.00 -0.04 0.00 0.00 33.50 32.44 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 -0.85 0.52 0.05 0.54 1.02 -1.26 -4.68 120.64 115.98 2dar n GLU 50 Ca 0.08 0.17 -0.22 0.00 -0.02 0.00 0.00 57.16 57.17 2dar n GLU 50 Cb 0.04 -1.38 -0.14 0.00 -0.02 0.00 0.00 31.44 29.93 2dar n GLU 50 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 2dar h GLU 51 N -0.42 0.33 -5.03 3.49 4.11 -1.92 -3.45 114.58 111.69 2dar h GLU 51 Ca -0.54 -0.57 -0.37 0.00 0.07 0.00 0.00 59.36 57.95 2dar h GLU 51 Cb 1.64 0.21 -0.10 0.00 0.50 0.00 0.00 28.75 30.99 2dar h GLU 51 CO -0.22 1.27 1.85 0.34 0.07 0.00 0.00 179.01 182.32 2dar n PHE 52 N -3.80 0.21 -4.22 2.06 7.35 -0.16 -4.81 117.46 114.08 2dar n PHE 52 Ca -0.23 0.08 -0.13 0.00 -0.76 0.00 0.00 57.45 56.41 2dar n PHE 52 Cb 0.98 -1.05 -0.10 0.00 0.35 0.00 0.00 39.48 39.65 2dar n PHE 52 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2dar s ASN 53 N 2.71 0.73 1.43 -2.13 2.20 -1.26 -2.07 114.94 116.56 2dar s ASN 53 Ca 1.30 -1.27 -0.23 0.00 -0.94 0.00 0.00 52.86 51.72 2dar s ASN 53 Cb -0.88 0.23 0.37 0.00 -2.00 0.00 0.00 41.25 38.98 2dar s ASN 53 CO 0.52 -0.71 0.91 0.00 -2.94 0.00 0.00 177.10 174.89 2dar n ALA 55 N -5.70 2.01 -0.07 0.00 0.00 -1.17 -3.91 120.51 111.67 2dar n ALA 55 Ca 0.12 -0.76 -0.07 0.00 0.00 0.00 0.00 53.44 52.73 2dar n ALA 55 Cb 0.60 -0.26 -0.02 0.00 0.00 0.00 0.00 19.45 19.76 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 -2.37 0.00 0.61 0.00 -0.00 -1.26 -4.57 115.22 107.63 2dar n HIS 56 Ca -0.16 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.69 2dar n HIS 56 Cb 0.77 -0.40 0.44 0.00 -0.00 0.00 0.00 29.99 30.80 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 -2.16 -4.08 -4.20 0.00 4.76 -1.25 -4.92 118.16 106.31 2dar n LYS 58 Ca 0.05 0.48 -0.30 0.00 -2.87 0.00 0.00 58.31 55.67 2dar n LYS 58 Cb 0.37 -5.00 -0.09 0.00 -1.84 0.00 0.00 35.03 28.47 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 -3.88 4.79 -0.05 4.39 0.01 -1.26 -4.62 114.94 114.32 2dar s ASN 59 Ca 0.32 -0.23 -0.37 0.00 -0.71 0.00 0.00 52.86 51.87 2dar s ASN 59 Cb -0.17 -1.08 -0.15 0.00 0.41 0.00 0.00 41.25 40.25 2dar s ASN 59 CO 0.87 0.19 1.57 1.07 -1.51 0.00 0.00 177.10 179.29 2dar n THR 60 N 0.76 0.17 -1.81 1.60 5.66 -1.26 -0.65 114.28 118.75 2dar n THR 60 Ca -0.12 -0.03 -0.29 0.00 -3.05 0.00 0.00 64.05 60.55 2dar n THR 60 Cb 0.52 -1.15 0.04 0.00 -1.55 0.00 0.00 70.33 68.19 2dar n THR 60 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 175.07 172.25 2dar n MET 61 N 4.06 3.21 0.01 1.09 2.81 -0.88 -4.68 117.12 122.74 2dar n MET 61 Ca 0.22 -3.84 -0.19 0.00 -1.81 0.00 0.00 57.70 52.08 2dar n MET 61 Cb 0.19 -2.28 -0.14 0.00 -0.71 0.00 0.00 33.22 30.28 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 2.21 -0.02 0.00 3.04 0.00 -1.90 -3.42 119.26 119.17 2dar h ALA 62 Ca 0.46 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2dar h ALA 62 Cb 1.11 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2dar h ALA 62 CO 1.12 0.37 -0.40 0.66 0.00 0.00 0.00 179.25 181.00 2dar n TYR 63 N -4.22 0.48 -0.78 0.00 4.02 -1.26 -4.73 117.16 110.67 2dar n TYR 63 Ca -0.15 0.21 -0.34 0.00 -0.01 0.00 0.00 57.90 57.60 2dar n TYR 63 Cb 0.75 -0.54 0.13 0.00 -0.02 0.00 0.00 39.34 39.66 2dar n TYR 63 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 176.86 176.29 2dar n ILE 64 N -3.81 0.00 -0.89 -0.72 -5.35 -1.26 -4.88 119.36 102.45 2dar n ILE 64 Ca -0.06 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 62.21 2dar n ILE 64 Cb 0.21 -0.42 0.00 0.00 -1.74 0.00 0.00 39.64 37.69 2dar n ILE 64 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dar n GLY 65 N 2.45 -0.37 3.59 3.28 0.00 -1.26 -4.77 105.19 108.10 2dar n GLY 65 Ca 0.00 -1.74 -0.05 0.00 0.00 0.00 0.00 46.02 44.23 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 -0.10 -0.20 -0.05 1.61 -0.12 -0.87 -4.02 117.98 114.22 2dar s PHE 66 Ca 0.00 0.07 -0.02 0.00 -0.05 0.00 0.00 56.93 56.93 2dar s PHE 66 Cb 0.00 0.55 0.04 0.00 -0.63 0.00 0.00 43.02 42.97 2dar s PHE 66 CO 0.00 -0.44 0.11 0.08 -0.05 0.00 0.00 175.22 174.92 2dar s VAL 67 N -2.83 -0.09 -0.19 -2.49 1.01 0.21 -1.34 120.40 114.68 2dar s VAL 67 Ca 0.09 0.24 -0.24 0.00 0.00 0.00 0.00 61.98 62.07 2dar s VAL 67 Cb -0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 36.38 36.16 2dar s VAL 67 CO -0.05 0.10 0.76 -0.70 0.00 0.00 0.00 175.10 175.20 2dar s GLU 68 N 1.40 4.25 -0.17 2.72 2.12 -1.26 -1.29 118.70 126.48 2dar s GLU 68 Ca -0.06 0.86 -0.15 0.00 0.36 0.00 0.00 54.97 55.98 2dar s GLU 68 Cb -0.12 -3.58 0.04 0.00 0.26 0.00 0.00 34.13 30.73 2dar s GLU 68 CO -0.05 -0.32 0.45 -2.00 -0.54 0.00 0.00 175.26 172.81 2dar s GLU 69 N 2.13 0.52 -1.61 4.30 2.56 0.39 -4.91 118.70 122.08 2dar s GLU 69 Ca 0.34 0.64 -0.19 0.00 0.00 0.00 0.00 54.97 55.77 2dar s GLU 69 Cb -0.16 0.24 0.19 0.00 2.00 0.00 0.00 34.13 36.40 2dar s GLU 69 CO 0.11 -0.07 0.47 1.63 -0.56 0.00 0.00 175.26 176.84 2dar n LYS 70 N 2.91 -0.77 -2.90 4.30 4.76 -1.26 0.12 118.16 125.32 2dar n LYS 70 Ca -0.14 0.12 -0.12 0.00 -2.87 0.00 0.00 58.31 55.30 2dar n LYS 70 Cb 0.57 -4.00 0.06 0.00 -1.84 0.00 0.00 35.03 29.81 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 -1.14 -0.37 3.62 0.72 0.00 -1.26 -5.04 105.19 101.72 2dar n GLY 71 Ca 0.06 0.15 -0.11 0.00 0.00 0.00 0.00 46.02 46.12 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 -3.27 -1.93 -0.24 4.61 0.00 0.12 -5.15 121.76 115.90 2dar s ALA 72 Ca 0.17 1.84 -0.08 0.00 0.00 0.00 0.00 51.96 53.89 2dar s ALA 72 Cb -0.02 -1.24 -0.03 0.00 0.00 0.00 0.00 23.12 21.83 2dar s ALA 72 CO 0.53 -0.27 0.09 -0.51 0.00 0.00 0.00 175.76 175.60 2dar s LEU 73 N 0.02 3.58 -0.13 0.00 1.43 -1.25 -0.46 118.68 121.86 2dar s LEU 73 Ca 0.01 -0.14 0.01 0.00 -1.03 0.00 0.00 54.13 52.99 2dar s LEU 73 Cb -0.04 -1.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 2dar s LEU 73 CO -0.03 -0.00 -0.17 -0.31 0.23 0.00 0.00 176.35 176.06 2dar s TYR 74 N 1.44 2.73 0.42 0.29 2.02 -0.41 -3.05 117.35 120.79 2dar s TYR 74 Ca 0.06 -0.91 -0.25 0.00 -0.37 0.00 0.00 57.07 55.60 2dar s TYR 74 Cb -0.15 -1.82 -0.08 0.00 -0.40 0.00 0.00 41.96 39.51 2dar s TYR 74 CO 0.04 -0.37 1.25 0.00 -1.57 0.00 0.00 175.55 174.91 2dar n GLU 76 N -0.02 -0.05 0.20 0.00 0.28 -1.26 0.92 120.64 120.72 2dar n GLU 76 Ca 0.05 1.10 -0.15 0.00 -0.16 0.00 0.00 57.16 58.00 2dar n GLU 76 Cb 0.45 -1.92 -0.07 0.00 1.43 0.00 0.00 31.44 31.32 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 -0.80 -0.08 -1.84 3.38 -1.93 0.13 115.31 114.17 2dar h LEU 77 Ca 0.63 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.68 2dar h LEU 77 Cb 1.60 0.27 -0.01 0.00 0.09 0.00 0.00 40.66 42.61 2dar h LEU 77 CO -0.63 -0.43 0.02 0.00 0.09 0.00 0.00 178.44 177.49 2dar h TYR 79 N 0.05 -0.66 -1.01 0.00 5.03 -1.08 -1.21 116.97 118.10 2dar h TYR 79 Ca 0.04 0.00 0.26 0.00 2.58 0.00 0.00 58.73 61.61 2dar h TYR 79 Cb 0.03 0.26 -0.08 0.00 1.55 0.00 0.00 36.73 38.49 2dar h TYR 79 CO -0.11 -0.32 0.67 1.49 -1.32 0.00 0.00 178.16 178.58 2dar h GLU 80 N -0.48 0.31 -0.18 1.82 4.81 -0.74 1.89 114.58 122.00 2dar h GLU 80 Ca -0.03 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2dar h GLU 80 Cb 0.41 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 2dar h GLU 80 CO -0.03 0.20 0.09 0.87 -0.73 0.00 0.00 179.01 179.42 2dar h LYS 81 N 0.31 0.25 0.00 1.92 1.57 -0.45 -1.98 116.57 118.20 2dar h LYS 81 Ca 0.54 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.29 2dar h LYS 81 Cb 1.53 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.79 2dar h LYS 81 CO -0.20 0.26 -0.62 1.19 -0.57 0.00 0.00 179.45 179.51 2dar n PHE 82 N -4.90 0.67 0.17 -1.35 3.72 0.07 -4.49 117.46 111.35 2dar n PHE 82 Ca -0.04 0.29 -0.17 0.00 -0.05 0.00 0.00 57.45 57.48 2dar n PHE 82 Cb 0.08 -0.69 -0.10 0.00 -0.94 0.00 0.00 39.48 37.83 2dar n PHE 82 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 176.76 177.45 2dar h PHE 83 N -0.97 -1.50 -1.53 1.38 -1.00 0.27 -3.24 116.94 110.35 2dar h PHE 83 Ca 0.00 0.03 -0.70 0.00 2.81 0.00 0.00 57.97 60.11 2dar h PHE 83 Cb 0.62 0.62 -0.13 0.00 3.61 0.00 0.00 35.95 40.68 2dar h PHE 83 CO -0.27 -0.62 1.73 0.00 -1.61 0.00 0.00 178.31 177.54 2dar s ALA 84 N -5.81 3.61 -0.09 2.45 0.00 -0.74 -4.77 121.76 116.41 2dar s ALA 84 Ca -0.17 -3.09 -0.00 0.00 0.00 0.00 0.00 51.96 48.70 2dar s ALA 84 Cb 0.06 -4.38 -0.00 0.00 0.00 0.00 0.00 23.12 18.79 2dar s ALA 84 CO 0.61 -3.06 -0.01 0.77 0.00 0.00 0.00 175.76 174.07 2dar h SER 85 N 7.52 0.00 0.00 0.00 0.02 -1.69 -3.40 113.55 115.99 2dar h SER 85 Ca 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 2dar h SER 85 Cb 0.88 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.42 2dar h SER 85 CO 1.35 0.43 0.00 0.61 -1.14 0.00 0.00 176.83 178.08 2dar n GLY 86 N 1.81 -1.17 3.56 -3.77 0.00 -1.26 -4.34 105.19 100.01 2dar n GLY 86 Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 0.00 2.84 0.12 1.61 0.04 -1.26 -4.98 135.00 133.37 2dar s PRO 87 Ca 0.00 0.81 0.09 0.00 0.04 0.00 0.00 61.00 61.93 2dar s PRO 87 Cb 0.00 -4.32 -0.04 0.00 0.04 0.00 0.00 34.50 30.18 2dar s PRO 87 CO 0.00 -2.46 -0.16 0.45 0.04 0.00 0.00 177.00 174.87 2dar s SER 88 N 7.38 4.01 -0.09 6.66 0.15 -1.26 -4.92 113.70 125.63 2dar s SER 88 Ca 0.69 -0.53 0.02 0.00 0.70 0.00 0.00 55.95 56.84 2dar s SER 88 Cb -0.15 -0.61 0.01 0.00 -1.71 0.00 0.00 66.02 63.56 2dar s SER 88 CO 0.24 0.17 -0.16 -0.55 1.20 0.00 0.00 173.24 174.14 2dar s SER 89 N -2.21 2.32 0.00 5.45 0.15 -1.26 -5.18 113.70 112.96 2dar s SER 89 Ca 0.19 -0.40 0.00 0.00 0.70 0.00 0.00 55.95 56.44 2dar s SER 89 Cb -0.11 -1.06 0.00 0.00 -1.71 0.00 0.00 66.02 63.15 2dar s SER 89 CO 0.11 0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.22