#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dar n SER 2 N 0.00 -2.57 -4.65 1.61 7.64 -1.26 -4.94 113.62 109.46 2dar n SER 2 Ca 0.00 -1.04 -0.24 0.00 1.01 0.00 0.00 58.87 58.60 2dar n SER 2 Cb 0.00 -2.68 0.11 0.00 -1.01 0.00 0.00 64.21 60.62 2dar n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dar s SER 3 N -3.51 4.29 -0.43 6.43 1.04 -1.26 -5.08 113.70 115.19 2dar s SER 3 Ca 0.60 -0.18 0.08 0.00 0.48 0.00 0.00 55.95 56.93 2dar s SER 3 Cb -0.33 -0.22 0.30 0.00 0.10 0.00 0.00 66.02 65.87 2dar s SER 3 CO 0.93 -1.90 0.88 0.61 0.98 0.00 0.00 173.24 174.74 2dar n GLY 4 N -2.93 1.57 2.83 7.32 0.00 -1.26 -5.05 105.19 107.67 2dar n GLY 4 Ca 0.14 -0.62 -0.29 0.00 0.00 0.00 0.00 46.02 45.25 2dar n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dar s SER 5 N -1.64 4.13 -0.08 1.61 0.01 -1.26 -4.87 113.70 111.60 2dar s SER 5 Ca 0.31 -3.36 -0.03 0.00 1.31 0.00 0.00 55.95 54.18 2dar s SER 5 Cb 0.27 -1.41 -0.04 0.00 0.21 0.00 0.00 66.02 65.06 2dar s SER 5 CO -0.11 -0.16 -0.09 -1.20 0.41 0.00 0.00 173.24 172.08 2dar n SER 6 N 2.61 1.25 0.00 2.44 7.64 -1.26 -5.10 113.62 121.19 2dar n SER 6 Ca 0.15 0.06 0.00 0.00 1.01 0.00 0.00 58.87 60.10 2dar n SER 6 Cb 0.36 -0.20 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 2dar n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dar n GLY 7 N 2.66 1.97 3.78 0.23 0.00 -1.26 -5.16 105.19 107.40 2dar n GLY 7 Ca -0.15 0.12 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 2dar n GLY 7 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2dar s ASP 8 N 0.00 4.04 1.04 1.61 1.47 -1.26 -5.00 116.67 118.57 2dar s ASP 8 Ca 0.00 1.26 -0.22 0.00 1.18 0.00 0.00 52.55 54.78 2dar s ASP 8 Cb 0.00 -1.95 -0.05 0.00 -0.34 0.00 0.00 42.92 40.58 2dar s ASP 8 CO 0.00 -2.25 -0.67 0.00 0.68 0.00 0.00 175.17 172.93 2dar n GLN 9 N -3.61 -0.67 -0.34 2.11 0.00 -1.26 -4.79 117.38 108.82 2dar n GLN 9 Ca 0.07 -0.18 -0.03 0.00 0.00 0.00 0.00 57.00 56.85 2dar n GLN 9 Cb 0.57 -1.36 0.09 0.00 0.00 0.00 0.00 30.24 29.54 2dar n GLN 9 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 2dar n ASP 10 N 0.98 2.91 -4.08 2.61 -0.08 -1.26 -4.83 116.55 112.80 2dar n ASP 10 Ca -0.00 -2.41 -0.13 0.00 -1.51 0.00 0.00 54.79 50.74 2dar n ASP 10 Cb 0.66 -0.59 -0.11 0.00 2.34 0.00 0.00 41.12 43.42 2dar n ASP 10 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2dar s THR 11 N -1.27 0.55 0.13 5.18 2.01 -1.26 -5.05 115.64 115.92 2dar s THR 11 Ca 0.18 -1.19 -0.11 0.00 0.31 0.00 0.00 61.69 60.88 2dar s THR 11 Cb 0.14 -0.75 -0.11 0.00 0.01 0.00 0.00 72.50 71.79 2dar s THR 11 CO 0.04 -0.45 1.38 0.25 -0.69 0.00 0.00 174.62 175.15 2dar h LEU 12 N 4.29 0.91 -6.00 4.42 5.85 -1.97 -3.45 115.31 119.35 2dar h LEU 12 Ca -0.36 -0.54 -0.57 0.00 0.84 0.00 0.00 57.88 57.25 2dar h LEU 12 Cb 1.20 -0.27 0.01 0.00 0.37 0.00 0.00 40.66 41.97 2dar h LEU 12 CO 0.44 1.33 0.36 0.52 -0.34 0.00 0.00 178.44 180.74 2dar n VAL 13 N -3.97 0.00 -3.27 1.05 0.31 -1.26 -4.92 118.33 106.27 2dar n VAL 13 Ca -0.05 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.07 2dar n VAL 13 Cb 0.68 -0.25 0.05 0.00 -0.91 0.00 0.00 33.84 33.40 2dar n VAL 13 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dar n GLN 14 N 2.25 0.65 -3.74 5.55 6.02 0.67 -4.85 117.38 123.93 2dar n GLN 14 Ca 0.19 -3.08 -0.12 0.00 -0.01 0.00 0.00 57.00 53.98 2dar n GLN 14 Cb -0.02 -0.07 -0.12 0.00 1.02 0.00 0.00 30.24 31.05 2dar n GLN 14 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2dar s ARG 15 N -4.42 0.25 0.32 -1.09 0.52 -1.26 -2.10 118.95 111.16 2dar s ARG 15 Ca 0.50 0.51 -0.26 0.00 -0.52 0.00 0.00 55.73 55.96 2dar s ARG 15 Cb -0.04 -0.04 -0.10 0.00 0.52 0.00 0.00 34.95 35.29 2dar s ARG 15 CO 0.32 -0.13 0.95 0.00 0.02 0.00 0.00 175.30 176.46 2dar s ALA 16 N 0.98 3.22 -0.41 2.13 0.00 -1.26 -4.85 121.76 121.56 2dar s ALA 16 Ca -0.07 0.54 -0.24 0.00 0.00 0.00 0.00 51.96 52.19 2dar s ALA 16 Cb -0.08 -3.19 0.02 0.00 0.00 0.00 0.00 23.12 19.87 2dar s ALA 16 CO -0.07 0.17 0.82 -2.00 0.00 0.00 0.00 175.76 174.68 2dar s GLU 17 N -2.01 3.62 -0.11 0.00 2.12 -0.73 -4.86 118.70 116.73 2dar s GLU 17 Ca 0.50 0.18 -0.29 0.00 0.36 0.00 0.00 54.97 55.71 2dar s GLU 17 Cb -0.19 -3.87 -0.05 0.00 0.26 0.00 0.00 34.13 30.28 2dar s GLU 17 CO 0.24 -1.00 1.81 -1.01 -0.54 0.00 0.00 175.26 174.76 2dar s HIS 18 N 3.30 1.71 -0.22 5.30 3.76 -1.26 -3.01 115.29 124.87 2dar s HIS 18 Ca 0.32 0.20 -0.06 0.00 -0.15 0.00 0.00 55.06 55.37 2dar s HIS 18 Cb -0.12 -4.02 -0.02 0.00 1.11 0.00 0.00 32.58 29.52 2dar s HIS 18 CO 0.20 -4.03 0.02 0.42 -0.85 0.00 0.00 174.74 170.50 2dar s ILE 19 N 5.21 3.94 1.03 0.60 -1.09 0.09 -5.02 121.20 125.96 2dar s ILE 19 Ca 0.81 -0.30 -0.13 0.00 -2.23 0.00 0.00 60.65 58.79 2dar s ILE 19 Cb -0.33 -2.81 0.21 0.00 -1.58 0.00 0.00 42.46 37.95 2dar s ILE 19 CO 0.33 0.39 1.10 -2.16 -1.23 0.00 0.00 174.94 173.37 2dar s PRO 20 N 1.36 0.14 0.68 2.79 0.04 -1.26 -0.98 135.00 137.78 2dar s PRO 20 Ca 0.05 0.42 -0.10 0.00 0.04 0.00 0.00 61.00 61.40 2dar s PRO 20 Cb -0.15 -1.71 0.02 0.00 0.04 0.00 0.00 34.50 32.70 2dar s PRO 20 CO 0.01 -2.91 1.05 0.00 0.04 0.00 0.00 177.00 175.20 2dar s ALA 21 N -2.97 2.99 -1.12 8.56 0.00 -1.26 -4.05 121.76 123.90 2dar s ALA 21 Ca 0.66 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.16 2dar s ALA 21 Cb -0.18 -2.91 0.00 0.00 0.00 0.00 0.00 23.12 20.03 2dar s ALA 21 CO 0.57 -1.09 0.00 0.41 0.00 0.00 0.00 175.76 175.66 2dar n GLY 22 N -2.92 1.11 0.74 0.00 0.00 -1.26 -4.88 105.19 97.99 2dar n GLY 22 Ca 0.06 -0.53 -0.02 0.00 0.00 0.00 0.00 46.02 45.53 2dar n GLY 22 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dar n LYS 23 N -2.64 0.10 -3.85 1.61 4.01 -1.26 -5.09 118.16 111.05 2dar n LYS 23 Ca -0.11 0.04 -0.12 0.00 -0.51 0.00 0.00 58.31 57.61 2dar n LYS 23 Cb 0.37 -0.56 -0.12 0.00 -0.51 0.00 0.00 35.03 34.21 2dar n LYS 23 CO 0.00 0.00 0.00 0.50 -1.11 0.00 0.00 177.40 176.79 2dar s ARG 24 N -1.83 0.23 -0.72 1.97 3.52 -1.26 -5.09 118.95 115.77 2dar s ARG 24 Ca -0.06 0.00 0.04 0.00 -0.13 0.00 0.00 55.73 55.58 2dar s ARG 24 Cb 0.01 0.10 0.27 0.00 -1.56 0.00 0.00 34.95 33.78 2dar s ARG 24 CO 0.08 -0.04 0.94 0.25 -0.81 0.00 0.00 175.30 175.72 2dar n THR 25 N 2.58 3.12 -0.75 4.11 -2.24 -1.26 -4.83 114.28 115.01 2dar n THR 25 Ca -0.15 -5.43 -0.14 0.00 -2.27 0.00 0.00 64.05 56.06 2dar n THR 25 Cb 0.58 -1.99 0.12 0.00 -2.10 0.00 0.00 70.33 66.93 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 0.76 -2.01 -3.91 -0.78 -0.04 -1.26 -4.42 135.00 123.34 2dar n PRO 26 Ca 0.30 -0.81 -0.35 0.00 -0.04 0.00 0.00 63.50 62.60 2dar n PRO 26 Cb 0.39 -0.76 -0.14 0.00 -0.04 0.00 0.00 33.50 32.95 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 -4.15 3.20 1.04 0.54 -1.94 -1.26 -1.53 119.30 115.19 2dar s MET 27 Ca 0.33 -0.74 -0.23 0.00 -1.71 0.00 0.00 55.69 53.33 2dar s MET 27 Cb -0.03 -3.03 -0.06 0.00 2.01 0.00 0.00 34.83 33.72 2dar s MET 27 CO 0.25 -0.28 -0.84 0.00 -0.01 0.00 0.00 175.02 174.14 2dar n ALA 29 N -3.90 1.58 0.12 0.00 0.00 -1.01 -3.62 120.51 113.68 2dar n ALA 29 Ca -0.01 -0.87 -0.06 0.00 0.00 0.00 0.00 53.44 52.50 2dar n ALA 29 Cb 0.67 0.19 -0.03 0.00 0.00 0.00 0.00 19.45 20.28 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 -0.66 -0.35 0.00 0.00 -0.00 -1.93 -3.35 115.15 108.86 2dar h HIS 30 Ca -0.54 -0.01 -0.09 0.00 -0.00 0.00 0.00 60.37 59.73 2dar h HIS 30 Cb 1.52 0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 29.04 2dar h HIS 30 CO -0.06 -0.22 -0.44 0.00 -0.00 0.00 0.00 177.93 177.22 2dar n ASN 32 N -3.21 -2.53 -4.22 0.00 2.85 -1.24 -4.97 115.26 101.95 2dar n ASN 32 Ca 0.02 -0.73 -0.29 0.00 -0.11 0.00 0.00 54.58 53.48 2dar n ASN 32 Cb 0.71 -4.44 -0.16 0.00 1.24 0.00 0.00 39.78 37.13 2dar n ASN 32 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 2dar s GLN 33 N -5.94 2.09 0.14 1.20 -0.21 -1.26 -4.69 119.66 110.99 2dar s GLN 33 Ca 0.17 -0.78 -0.34 0.00 0.02 0.00 0.00 55.36 54.43 2dar s GLN 33 Cb -0.08 -1.85 -0.17 0.00 1.00 0.00 0.00 33.01 31.92 2dar s GLN 33 CO 0.78 0.36 1.04 1.55 -2.12 0.00 0.00 175.29 176.91 2dar n VAL 34 N 2.89 0.88 -3.80 1.09 3.14 -1.26 -2.80 118.33 118.47 2dar n VAL 34 Ca -0.17 -0.22 -0.36 0.00 -2.96 0.00 0.00 64.34 60.63 2dar n VAL 34 Cb 0.52 -0.54 -0.10 0.00 -1.06 0.00 0.00 33.84 32.67 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 -0.27 5.01 -0.27 1.55 1.01 -0.58 -4.91 121.20 122.74 2dar s ILE 35 Ca 0.75 0.06 -0.14 0.00 0.00 0.00 0.00 60.65 61.32 2dar s ILE 35 Cb -0.95 -3.31 -0.13 0.00 0.01 0.00 0.00 42.46 38.07 2dar s ILE 35 CO 0.54 0.39 -0.27 0.54 0.00 0.00 0.00 174.94 176.14 2dar n ARG 36 N 4.10 0.59 0.00 2.79 1.74 -1.26 -4.13 116.66 120.49 2dar n ARG 36 Ca -0.16 0.30 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 2dar n ARG 36 Cb 0.52 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.43 2dar n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dar n GLY 37 N 1.34 -0.36 3.74 -0.13 0.00 -1.26 -4.00 105.19 104.51 2dar n GLY 37 Ca -0.51 -1.58 -0.41 0.00 0.00 0.00 0.00 46.02 43.51 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 0.00 4.40 0.29 1.61 0.04 -1.26 -4.44 135.00 135.64 2dar s PRO 38 Ca 0.00 2.04 0.04 0.00 0.04 0.00 0.00 61.00 63.13 2dar s PRO 38 Cb 0.00 -3.19 -0.06 0.00 0.04 0.00 0.00 34.50 31.29 2dar s PRO 38 CO 0.00 -0.24 0.01 -0.59 0.04 0.00 0.00 177.00 176.23 2dar s PHE 39 N 0.06 1.85 0.15 0.56 -0.12 -0.15 -4.45 117.98 115.86 2dar s PHE 39 Ca 0.56 -0.89 0.07 0.00 -0.05 0.00 0.00 56.93 56.62 2dar s PHE 39 Cb -0.36 -1.13 -0.04 0.00 -0.63 0.00 0.00 43.02 40.85 2dar s PHE 39 CO 0.39 0.05 -0.04 -0.51 -0.05 0.00 0.00 175.22 175.06 2dar s LEU 40 N -3.42 3.23 -0.15 -1.99 1.43 -0.44 -0.73 118.68 116.61 2dar s LEU 40 Ca 0.33 -0.39 -0.04 0.00 -1.03 0.00 0.00 54.13 53.00 2dar s LEU 40 Cb 0.07 -1.93 0.06 0.00 0.03 0.00 0.00 46.19 44.42 2dar s LEU 40 CO 0.13 0.12 0.14 0.54 0.23 0.00 0.00 176.35 177.51 2dar s VAL 41 N -1.55 -0.20 0.14 -1.59 0.11 -1.16 -0.75 120.40 115.39 2dar s VAL 41 Ca 0.26 0.03 0.00 0.00 -2.93 0.00 0.00 61.98 59.33 2dar s VAL 41 Cb -0.10 -0.50 0.00 0.00 -1.53 0.00 0.00 36.38 34.25 2dar s VAL 41 CO 0.17 -0.12 0.00 0.00 -3.33 0.00 0.00 175.10 171.82 2dar n ALA 42 N 5.30 3.00 -2.57 1.54 0.00 -1.22 -1.77 120.51 124.80 2dar n ALA 42 Ca -0.06 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.95 2dar n ALA 42 Cb 0.49 0.09 0.00 0.00 0.00 0.00 0.00 19.45 20.03 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 -3.18 6.07 -2.62 0.00 7.99 -1.26 -4.67 117.00 119.32 2dar n LEU 43 Ca 0.00 -4.55 -0.14 0.00 -0.01 0.00 0.00 56.01 51.32 2dar n LEU 43 Cb 0.00 -1.54 -0.03 0.00 -0.11 0.00 0.00 43.42 41.74 2dar n LEU 43 CO 0.00 1.09 -0.05 0.61 -1.51 0.00 0.00 177.39 177.53 2dar n GLY 44 N 3.38 -0.30 3.64 -0.72 0.00 -1.26 -4.78 105.19 105.15 2dar n GLY 44 Ca 0.39 0.02 -0.09 0.00 0.00 0.00 0.00 46.02 46.34 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 -4.15 1.66 -0.13 1.61 1.02 -1.26 -5.16 119.74 113.33 2dar s LYS 45 Ca 0.26 -1.27 -0.02 0.00 0.02 0.00 0.00 55.97 54.97 2dar s LYS 45 Cb -0.15 0.50 -0.03 0.00 -0.52 0.00 0.00 37.83 37.63 2dar s LYS 45 CO 0.32 -0.71 -0.06 -1.54 -0.92 0.00 0.00 175.35 172.45 2dar s SER 46 N -3.03 4.64 -0.03 2.83 1.04 -1.26 -3.40 113.70 114.49 2dar s SER 46 Ca 0.21 -0.13 0.04 0.00 0.48 0.00 0.00 55.95 56.54 2dar s SER 46 Cb -0.02 -1.61 -0.00 0.00 0.10 0.00 0.00 66.02 64.49 2dar s SER 46 CO 0.10 0.22 -0.13 0.26 0.98 0.00 0.00 173.24 174.66 2dar s TRP 47 N 0.07 1.32 0.30 5.02 0.52 0.08 -2.40 118.94 123.85 2dar s TRP 47 Ca -0.01 -0.33 -0.29 0.00 0.02 0.00 0.00 56.10 55.48 2dar s TRP 47 Cb -0.14 -0.90 -0.10 0.00 -1.15 0.00 0.00 33.47 31.18 2dar s TRP 47 CO 0.03 -0.11 1.42 -1.01 0.02 0.00 0.00 176.95 177.30 2dar s HIS 48 N 0.01 2.93 -2.00 -1.98 3.76 -1.26 -1.33 115.29 115.42 2dar s HIS 48 Ca -0.01 1.16 0.14 0.00 -0.15 0.00 0.00 55.06 56.20 2dar s HIS 48 Cb -0.09 -3.83 0.82 0.00 1.11 0.00 0.00 32.58 30.59 2dar s HIS 48 CO 0.01 -2.53 1.24 -0.35 -0.85 0.00 0.00 174.74 172.27 2dar n PRO 49 N 1.46 0.49 -0.13 8.40 -0.04 -1.26 -0.93 135.00 142.98 2dar n PRO 49 Ca 0.03 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.23 2dar n PRO 49 Cb 0.40 -1.44 -0.10 0.00 -0.04 0.00 0.00 33.50 32.32 2dar n PRO 49 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2dar n GLU 50 N -0.94 0.56 0.07 0.54 0.28 -1.26 -4.67 120.64 115.22 2dar n GLU 50 Ca 0.10 0.23 -0.22 0.00 -0.16 0.00 0.00 57.16 57.11 2dar n GLU 50 Cb 0.05 -1.44 -0.15 0.00 1.43 0.00 0.00 31.44 31.33 2dar n GLU 50 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 177.13 178.02 2dar h GLU 51 N -0.78 0.38 -5.07 3.44 4.11 -1.93 -3.44 114.58 111.28 2dar h GLU 51 Ca -0.64 -0.64 -0.40 0.00 0.07 0.00 0.00 59.36 57.75 2dar h GLU 51 Cb 1.63 0.24 -0.09 0.00 0.50 0.00 0.00 28.75 31.02 2dar h GLU 51 CO -0.35 1.31 1.75 0.34 0.07 0.00 0.00 179.01 182.13 2dar n PHE 52 N -3.90 0.42 -4.26 2.06 7.35 -0.11 -4.82 117.46 114.20 2dar n PHE 52 Ca -0.18 0.16 -0.16 0.00 -0.76 0.00 0.00 57.45 56.51 2dar n PHE 52 Cb 0.95 -1.58 -0.09 0.00 0.35 0.00 0.00 39.48 39.11 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 5.38 1.00 1.29 -2.13 2.20 -1.26 -2.53 114.94 118.90 2dar s ASN 53 Ca 1.28 -1.55 -0.21 0.00 -0.94 0.00 0.00 52.86 51.44 2dar s ASN 53 Cb -0.92 0.44 0.32 0.00 -2.00 0.00 0.00 41.25 39.09 2dar s ASN 53 CO 0.48 -0.92 1.06 0.00 -2.94 0.00 0.00 177.10 174.78 2dar n ALA 55 N -5.08 1.57 -0.09 0.00 0.00 -1.17 -3.87 120.51 111.87 2dar n ALA 55 Ca 0.14 -1.13 -0.09 0.00 0.00 0.00 0.00 53.44 52.37 2dar n ALA 55 Cb 0.60 -0.11 -0.03 0.00 0.00 0.00 0.00 19.45 19.91 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 -2.70 0.00 0.93 0.00 -0.00 -1.26 -4.53 115.22 107.66 2dar n HIS 56 Ca -0.29 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.56 2dar n HIS 56 Cb 1.05 -0.50 0.58 0.00 -0.00 0.00 0.00 29.99 31.12 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 -1.54 -0.96 -4.10 0.00 4.76 -1.25 -4.88 118.16 110.18 2dar n LYS 58 Ca 0.07 0.12 -0.25 0.00 -2.87 0.00 0.00 58.31 55.37 2dar n LYS 58 Cb 0.33 -4.01 -0.05 0.00 -1.84 0.00 0.00 35.03 29.45 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 5.46 -0.31 4.39 0.01 -1.26 -4.59 114.94 114.64 2dar s ASN 59 Ca 0.29 -0.18 -0.38 0.00 -0.71 0.00 0.00 52.86 51.88 2dar s ASN 59 Cb -0.17 -1.40 -0.13 0.00 0.41 0.00 0.00 41.25 39.96 2dar s ASN 59 CO 1.01 0.05 2.00 1.07 -1.51 0.00 0.00 177.10 179.71 2dar n THR 60 N -0.52 0.25 -1.60 1.60 5.66 -1.26 -1.65 114.28 116.76 2dar n THR 60 Ca -0.08 -0.15 -0.34 0.00 -3.05 0.00 0.00 64.05 60.43 2dar n THR 60 Cb 0.55 -1.43 0.06 0.00 -1.55 0.00 0.00 70.33 67.97 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 7.00 2.89 -0.06 1.09 2.81 -1.05 -4.61 117.12 125.18 2dar n MET 61 Ca 0.35 -3.53 -0.04 0.00 -1.81 0.00 0.00 57.70 52.67 2dar n MET 61 Cb 0.18 -2.28 -0.01 0.00 -0.71 0.00 0.00 33.22 30.39 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 2.22 0.00 0.04 3.04 0.00 -1.88 -3.43 119.26 119.25 2dar h ALA 62 Ca 0.55 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2dar h ALA 62 Cb 0.81 0.45 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2dar h ALA 62 CO 1.40 0.45 -0.02 1.88 0.00 0.00 0.00 179.25 182.96 2dar h TYR 63 N -0.93 -0.05 -2.97 0.00 -1.99 -1.95 -3.42 116.97 105.66 2dar h TYR 63 Ca 0.00 -0.00 -0.42 0.00 2.00 0.00 0.00 58.73 60.31 2dar h TYR 63 Cb 0.45 0.02 0.22 0.00 2.00 0.00 0.00 36.73 39.42 2dar h TYR 63 CO -0.19 0.54 -0.18 0.44 -0.00 0.00 0.00 178.16 178.76 2dar n ILE 64 N -4.75 0.00 -1.31 -2.88 -5.35 -1.26 -4.93 119.36 98.88 2dar n ILE 64 Ca -0.07 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.02 2dar n ILE 64 Cb 0.30 -0.94 0.00 0.00 -1.74 0.00 0.00 39.64 37.25 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 1.35 0.01 3.52 3.28 0.00 -1.26 -4.74 105.19 107.35 2dar n GLY 65 Ca 0.04 -1.81 -0.08 0.00 0.00 0.00 0.00 46.02 44.17 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 0.06 -0.33 -0.04 1.61 -0.12 -0.89 -3.94 117.98 114.32 2dar s PHE 66 Ca 0.00 0.19 -0.01 0.00 -0.05 0.00 0.00 56.93 57.06 2dar s PHE 66 Cb 0.00 0.54 0.03 0.00 -0.63 0.00 0.00 43.02 42.96 2dar s PHE 66 CO 0.00 -0.55 0.03 0.08 -0.05 0.00 0.00 175.22 174.73 2dar s VAL 67 N -3.12 0.07 -0.34 -2.49 1.01 0.43 -0.24 120.40 115.73 2dar s VAL 67 Ca 0.05 0.25 -0.23 0.00 0.00 0.00 0.00 61.98 62.05 2dar s VAL 67 Cb -0.01 -0.25 0.00 0.00 0.00 0.00 0.00 36.38 36.13 2dar s VAL 67 CO -0.08 0.17 0.75 -0.70 0.00 0.00 0.00 175.10 175.24 2dar s GLU 68 N 1.66 3.84 -0.04 2.72 2.12 -1.25 -0.04 118.70 127.71 2dar s GLU 68 Ca -0.01 0.38 -0.01 0.00 0.36 0.00 0.00 54.97 55.69 2dar s GLU 68 Cb -0.13 -3.77 0.03 0.00 0.26 0.00 0.00 34.13 30.52 2dar s GLU 68 CO -0.03 -0.75 0.02 -2.00 -0.54 0.00 0.00 175.26 171.96 2dar s GLU 69 N 2.96 0.23 -1.60 4.30 -6.30 0.68 -4.86 118.70 114.11 2dar s GLU 69 Ca 0.30 0.18 -0.07 0.00 -2.50 0.00 0.00 54.97 52.88 2dar s GLU 69 Cb -0.14 -0.58 0.07 0.00 0.00 0.00 0.00 34.13 33.48 2dar s GLU 69 CO 0.15 -0.23 0.34 1.63 0.02 0.00 0.00 175.26 177.17 2dar n LYS 70 N 4.69 -1.83 -2.74 4.30 4.76 -1.26 -1.51 118.16 124.57 2dar n LYS 70 Ca -0.16 0.22 -0.10 0.00 -2.87 0.00 0.00 58.31 55.40 2dar n LYS 70 Cb 0.50 -4.27 0.05 0.00 -1.84 0.00 0.00 35.03 29.47 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 -1.97 -0.36 3.61 0.72 0.00 -1.26 -5.05 105.19 100.88 2dar n GLY 71 Ca -0.18 0.18 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 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 -3.25 -2.27 -0.23 4.61 0.00 -0.57 -5.15 121.76 114.91 2dar s ALA 72 Ca 0.22 2.23 -0.16 0.00 0.00 0.00 0.00 51.96 54.25 2dar s ALA 72 Cb -0.03 -1.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.33 2dar s ALA 72 CO 0.49 -0.48 0.40 -0.51 0.00 0.00 0.00 175.76 175.66 2dar s LEU 73 N 1.65 4.11 -0.10 0.00 1.43 -1.25 -0.23 118.68 124.28 2dar s LEU 73 Ca -0.08 0.44 0.04 0.00 -1.03 0.00 0.00 54.13 53.50 2dar s LEU 73 Cb -0.05 -2.50 0.00 0.00 0.03 0.00 0.00 46.19 43.68 2dar s LEU 73 CO -0.16 -0.13 -0.23 -0.31 0.23 0.00 0.00 176.35 175.75 2dar s TYR 74 N 1.64 2.47 0.56 0.29 2.02 0.94 -3.06 117.35 122.22 2dar s TYR 74 Ca 0.18 -1.05 -0.20 0.00 -0.37 0.00 0.00 57.07 55.63 2dar s TYR 74 Cb -0.15 -1.67 -0.05 0.00 -0.40 0.00 0.00 41.96 39.69 2dar s TYR 74 CO 0.09 -0.44 1.21 0.00 -1.57 0.00 0.00 175.55 174.83 2dar n GLU 76 N -1.28 -0.05 0.46 0.00 0.28 -1.25 0.08 120.64 118.87 2dar n GLU 76 Ca 0.12 1.25 -0.20 0.00 -0.16 0.00 0.00 57.16 58.17 2dar n GLU 76 Cb 0.49 -2.26 -0.10 0.00 1.43 0.00 0.00 31.44 31.00 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 -1.08 0.14 -1.84 3.38 -1.93 -0.58 115.31 113.41 2dar h LEU 77 Ca 0.78 0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.81 2dar h LEU 77 Cb 2.12 0.29 -0.03 0.00 0.09 0.00 0.00 40.66 43.13 2dar h LEU 77 CO -0.67 -0.73 -0.27 0.00 0.09 0.00 0.00 178.44 176.86 2dar h TYR 79 N -0.49 -0.71 -0.72 0.00 5.03 -1.19 -1.99 116.97 116.89 2dar h TYR 79 Ca 0.03 0.02 0.16 0.00 2.58 0.00 0.00 58.73 61.52 2dar h TYR 79 Cb 0.51 0.31 -0.13 0.00 1.55 0.00 0.00 36.73 38.97 2dar h TYR 79 CO -0.24 -0.25 -0.06 1.49 -1.32 0.00 0.00 178.16 177.79 2dar h GLU 80 N -0.28 0.07 -0.68 1.82 4.81 -1.04 1.95 114.58 121.23 2dar h GLU 80 Ca 0.01 -0.00 0.13 0.00 -0.13 0.00 0.00 59.36 59.37 2dar h GLU 80 Cb 0.31 -0.01 -0.13 0.00 0.63 0.00 0.00 28.75 29.55 2dar h GLU 80 CO -0.18 0.04 -0.19 0.87 -0.73 0.00 0.00 179.01 178.83 2dar h LYS 81 N 0.07 -0.02 0.00 1.92 1.57 -0.42 0.33 116.57 120.02 2dar h LYS 81 Ca 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 2dar h LYS 81 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 2dar h LYS 81 CO -0.67 -0.01 -0.37 1.19 -0.57 0.00 0.00 179.45 179.02 2dar n PHE 82 N -5.46 0.57 -0.06 -1.35 3.72 -0.01 -3.86 117.46 111.02 2dar n PHE 82 Ca 0.08 0.25 -0.14 0.00 -0.05 0.00 0.00 57.45 57.60 2dar n PHE 82 Cb 0.36 -0.58 -0.09 0.00 -0.94 0.00 0.00 39.48 38.23 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 -0.67 -1.53 -0.98 1.38 0.04 0.29 -1.54 116.94 113.93 2dar h PHE 83 Ca 0.00 0.07 -0.50 0.00 2.80 0.00 0.00 57.97 60.34 2dar h PHE 83 Cb 0.37 0.70 -0.16 0.00 2.20 0.00 0.00 35.95 39.06 2dar h PHE 83 CO -0.16 -0.51 0.53 0.00 -0.60 0.00 0.00 178.31 177.57 2dar n ALA 84 N -3.02 6.49 -1.67 2.45 0.00 0.12 -4.98 120.51 119.90 2dar n ALA 84 Ca -0.04 -3.05 -0.48 0.00 0.00 0.00 0.00 53.44 49.87 2dar n ALA 84 Cb 0.37 -2.23 -0.05 0.00 0.00 0.00 0.00 19.45 17.54 2dar n ALA 84 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2dar n SER 85 N 1.10 3.00 0.00 0.00 7.64 -0.58 -4.65 113.62 120.13 2dar n SER 85 Ca 0.50 1.06 0.00 0.00 1.01 0.00 0.00 58.87 61.43 2dar n SER 85 Cb 0.55 -1.37 0.00 0.00 -1.01 0.00 0.00 64.21 62.38 2dar n SER 85 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dar n GLY 86 N 3.63 -0.13 3.59 0.23 0.00 -1.26 -5.09 105.19 106.16 2dar n GLY 86 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.56 -1.32 0.40 1.61 0.04 -1.26 -5.08 135.00 128.83 2dar s PRO 87 Ca 0.00 -0.10 0.08 0.00 0.04 0.00 0.00 61.00 61.01 2dar s PRO 87 Cb 0.00 -1.59 -0.03 0.00 0.04 0.00 0.00 34.50 32.92 2dar s PRO 87 CO 0.00 -3.77 0.29 0.45 0.04 0.00 0.00 177.00 174.01 2dar s SER 88 N -3.92 4.89 0.22 6.66 0.15 -1.26 -5.15 113.70 115.29 2dar s SER 88 Ca 0.71 -0.80 0.00 0.00 0.70 0.00 0.00 55.95 56.57 2dar s SER 88 Cb -0.09 -0.62 -0.04 0.00 -1.71 0.00 0.00 66.02 63.56 2dar s SER 88 CO 0.56 -0.55 0.15 -0.44 1.20 0.00 0.00 173.24 174.16 2dar s SER 89 N -4.03 0.43 0.00 5.45 0.01 -1.26 -5.30 113.70 109.00 2dar s SER 89 Ca 0.44 -1.45 0.00 0.00 1.31 0.00 0.00 55.95 56.26 2dar s SER 89 Cb -0.02 0.40 0.00 0.00 0.21 0.00 0.00 66.02 66.61 2dar s SER 89 CO 0.26 -0.87 0.00 0.61 0.41 0.00 0.00 173.24 173.65