#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 1.47 0.05 1.61 0.15 -1.26 -5.04 113.70 110.69 2dar s SER 2 Ca 0.00 -0.15 -0.24 0.00 0.70 0.00 0.00 55.95 56.26 2dar s SER 2 Cb 0.00 0.09 -0.17 0.00 -1.71 0.00 0.00 66.02 64.23 2dar s SER 2 CO 0.00 -0.30 1.58 0.77 1.20 0.00 0.00 173.24 176.49 2dar h SER 3 N 8.38 -0.03 0.00 5.45 4.64 -2.12 -3.49 113.55 126.37 2dar h SER 3 Ca -0.15 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2dar h SER 3 Cb 1.14 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2dar h SER 3 CO 0.23 0.13 0.00 0.61 -0.87 0.00 0.00 176.83 176.93 2dar n GLY 4 N -0.68 0.21 3.67 -0.77 0.00 -1.26 -5.08 105.19 101.28 2dar n GLY 4 Ca -0.08 -0.53 -0.43 0.00 0.00 0.00 0.00 46.02 44.99 2dar n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dar s SER 5 N -4.00 6.91 0.25 1.61 0.15 -1.26 -4.91 113.70 112.45 2dar s SER 5 Ca 0.00 1.88 -0.12 0.00 0.70 0.00 0.00 55.95 58.41 2dar s SER 5 Cb 0.00 -2.55 0.34 0.00 -1.71 0.00 0.00 66.02 62.11 2dar s SER 5 CO 0.00 -0.73 1.57 -1.28 1.20 0.00 0.00 173.24 173.99 2dar h SER 6 N 8.13 -1.06 -0.35 5.45 0.87 -2.04 -3.46 113.55 121.09 2dar h SER 6 Ca -0.32 0.29 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 2dar h SER 6 Cb 1.14 0.63 0.00 0.00 -0.44 0.00 0.00 62.40 63.73 2dar h SER 6 CO 0.93 -0.30 0.00 0.61 -0.53 0.00 0.00 176.83 177.54 2dar n GLY 7 N -1.55 0.80 3.56 5.77 0.00 -1.26 -5.00 105.19 107.51 2dar n GLY 7 Ca 0.12 -0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 2dar n GLY 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dar s ASP 8 N -1.98 5.37 -0.24 1.61 1.11 -1.26 -4.92 116.67 116.35 2dar s ASP 8 Ca 0.00 -0.48 0.02 0.00 0.18 0.00 0.00 52.55 52.27 2dar s ASP 8 Cb 0.00 -2.55 0.06 0.00 1.07 0.00 0.00 42.92 41.49 2dar s ASP 8 CO 0.00 -2.48 -0.10 -1.58 1.18 0.00 0.00 175.17 172.20 2dar s GLN 9 N 6.75 2.07 -0.17 8.23 2.00 -1.26 -4.99 119.66 132.29 2dar s GLN 9 Ca 0.65 -1.16 0.00 0.00 -2.00 0.00 0.00 55.36 52.85 2dar s GLN 9 Cb -0.08 -2.73 0.17 0.00 0.80 0.00 0.00 33.01 31.17 2dar s GLN 9 CO 0.05 -0.55 1.63 -0.25 -0.50 0.00 0.00 175.29 175.67 2dar n ASP 10 N 4.54 4.59 -4.01 6.67 8.00 -1.26 -4.81 116.55 130.26 2dar n ASP 10 Ca -0.14 -2.64 -0.21 0.00 0.71 0.00 0.00 54.79 52.51 2dar n ASP 10 Cb 0.43 -0.84 -0.15 0.00 -0.02 0.00 0.00 41.12 40.55 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 -1.20 0.83 0.40 -3.53 2.01 -1.26 -5.02 115.64 107.88 2dar s THR 11 Ca 0.18 -0.39 0.27 0.00 0.31 0.00 0.00 61.69 62.06 2dar s THR 11 Cb 0.15 -0.73 0.43 0.00 0.01 0.00 0.00 72.50 72.35 2dar s THR 11 CO 0.02 0.26 1.55 0.18 -0.69 0.00 0.00 174.62 175.93 2dar n LEU 12 N 3.24 0.27 -3.11 4.42 4.32 -1.26 -4.58 117.00 120.30 2dar n LEU 12 Ca -0.18 1.49 -0.43 0.00 -0.02 0.00 0.00 56.01 56.87 2dar n LEU 12 Cb 0.54 -0.73 -0.06 0.00 -1.62 0.00 0.00 43.42 41.55 2dar n LEU 12 CO 0.25 -1.64 0.65 0.52 -1.22 0.00 0.00 177.39 175.94 2dar n VAL 13 N -4.93 0.00 -4.26 4.08 0.31 -1.26 -4.77 118.33 107.50 2dar n VAL 13 Ca 0.39 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.43 2dar n VAL 13 Cb 1.42 -0.23 -0.04 0.00 -0.91 0.00 0.00 33.84 34.08 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 1.38 2.23 -0.12 5.55 -0.21 0.11 -4.85 119.66 123.76 2dar s GLN 14 Ca 0.67 -2.14 -0.04 0.00 0.02 0.00 0.00 55.36 53.86 2dar s GLN 14 Cb -0.95 -1.86 0.06 0.00 1.00 0.00 0.00 33.01 31.26 2dar s GLN 14 CO 0.49 -0.45 0.24 1.03 -2.12 0.00 0.00 175.29 174.48 2dar s ARG 15 N -4.07 0.13 -0.05 2.91 0.52 -1.26 -2.31 118.95 114.81 2dar s ARG 15 Ca 0.24 0.69 -0.30 0.00 -0.52 0.00 0.00 55.73 55.84 2dar s ARG 15 Cb 0.00 -0.09 -0.05 0.00 0.52 0.00 0.00 34.95 35.33 2dar s ARG 15 CO 0.14 -0.28 1.46 0.00 0.02 0.00 0.00 175.30 176.64 2dar s ALA 16 N 2.26 3.61 -0.27 2.13 0.00 -1.26 -4.94 121.76 123.29 2dar s ALA 16 Ca 0.00 0.82 -0.28 0.00 0.00 0.00 0.00 51.96 52.50 2dar s ALA 16 Cb -0.12 -3.65 -0.03 0.00 0.00 0.00 0.00 23.12 19.33 2dar s ALA 16 CO -0.08 -1.11 1.86 -2.00 0.00 0.00 0.00 175.76 174.42 2dar s GLU 17 N 3.11 3.41 -0.12 0.00 2.12 -1.15 -4.77 118.70 121.30 2dar s GLU 17 Ca 0.65 1.64 -0.29 0.00 0.36 0.00 0.00 54.97 57.33 2dar s GLU 17 Cb -0.30 -4.20 -0.06 0.00 0.26 0.00 0.00 34.13 29.82 2dar s GLU 17 CO 0.25 -1.77 2.03 -1.01 -0.54 0.00 0.00 175.26 174.22 2dar s HIS 18 N 6.77 1.35 -0.17 5.30 3.76 -1.26 -3.15 115.29 127.88 2dar s HIS 18 Ca 0.83 0.14 -0.05 0.00 -0.15 0.00 0.00 55.06 55.83 2dar s HIS 18 Cb -0.26 -4.06 -0.03 0.00 1.11 0.00 0.00 32.58 29.33 2dar s HIS 18 CO 0.34 -4.51 0.01 0.42 -0.85 0.00 0.00 174.74 170.15 2dar s ILE 19 N 6.34 4.30 0.88 0.60 -1.09 0.11 -5.01 121.20 127.32 2dar s ILE 19 Ca 0.91 -0.21 -0.11 0.00 -2.23 0.00 0.00 60.65 59.01 2dar s ILE 19 Cb -0.36 -2.91 0.12 0.00 -1.58 0.00 0.00 42.46 37.73 2dar s ILE 19 CO 0.37 0.47 1.09 -2.16 -1.23 0.00 0.00 174.94 173.48 2dar s PRO 20 N 0.42 1.39 0.96 2.79 0.04 -1.26 -1.33 135.00 138.01 2dar s PRO 20 Ca -0.01 0.87 -0.15 0.00 0.04 0.00 0.00 61.00 61.75 2dar s PRO 20 Cb -0.13 -1.82 0.18 0.00 0.04 0.00 0.00 34.50 32.76 2dar s PRO 20 CO 0.02 -2.16 1.22 0.00 0.04 0.00 0.00 177.00 176.11 2dar s ALA 21 N -2.93 1.96 -1.48 8.56 0.00 -1.26 -4.21 121.76 122.40 2dar s ALA 21 Ca 0.63 -0.90 -0.04 0.00 0.00 0.00 0.00 51.96 51.64 2dar s ALA 21 Cb -0.18 -2.89 0.04 0.00 0.00 0.00 0.00 23.12 20.09 2dar s ALA 21 CO 0.57 -2.44 0.49 0.41 0.00 0.00 0.00 175.76 174.79 2dar n GLY 22 N -2.90 -0.27 1.65 0.00 0.00 -1.22 -4.82 105.19 97.63 2dar n GLY 22 Ca 0.12 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.28 2dar n GLY 22 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2dar n LYS 23 N -4.42 0.00 0.00 1.61 3.00 -1.26 -5.00 118.16 112.09 2dar n LYS 23 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.09 2dar n LYS 23 Cb 0.64 -0.18 0.00 0.00 0.00 0.00 0.00 35.03 35.49 2dar n LYS 23 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2dar n ARG 24 N -3.25 1.12 -4.15 1.64 1.74 -1.26 -5.04 116.66 107.46 2dar n ARG 24 Ca 0.00 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.78 2dar n ARG 24 Cb 0.06 -0.81 -0.05 0.00 -1.02 0.00 0.00 32.46 30.63 2dar n ARG 24 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2dar n THR 25 N -1.82 -1.91 -1.14 0.55 -2.24 -1.26 -4.92 114.28 101.54 2dar n THR 25 Ca 0.00 -0.40 -0.29 0.00 -2.27 0.00 0.00 64.05 61.10 2dar n THR 25 Cb 0.31 -1.85 0.19 0.00 -2.10 0.00 0.00 70.33 66.89 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 -6.92 0.02 -0.07 -0.78 0.04 -1.26 -4.07 135.00 121.96 2dar s PRO 26 Ca 0.16 0.38 -0.21 0.00 0.04 0.00 0.00 61.00 61.37 2dar s PRO 26 Cb -0.09 -1.70 -0.04 0.00 0.04 0.00 0.00 34.50 32.71 2dar s PRO 26 CO 0.94 -2.98 0.59 1.41 0.04 0.00 0.00 177.00 177.00 2dar s MET 27 N -5.04 4.37 1.05 4.56 1.75 -1.26 -0.71 119.30 124.01 2dar s MET 27 Ca 0.67 0.68 -0.14 0.00 -1.25 0.00 0.00 55.69 55.64 2dar s MET 27 Cb -0.17 -3.42 0.13 0.00 2.84 0.00 0.00 34.83 34.21 2dar s MET 27 CO 0.57 0.17 0.52 0.00 -0.65 0.00 0.00 175.02 175.63 2dar n ALA 29 N -4.27 1.52 -0.01 0.00 0.00 -1.11 -3.55 120.51 113.10 2dar n ALA 29 Ca 0.05 -1.22 -0.00 0.00 0.00 0.00 0.00 53.44 52.26 2dar n ALA 29 Cb 0.56 -0.14 -0.00 0.00 0.00 0.00 0.00 19.45 19.87 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 0.00 -0.01 0.00 -0.00 -1.93 -3.39 115.15 109.81 2dar h HIS 30 Ca -0.52 0.00 -0.15 0.00 -0.00 0.00 0.00 60.37 59.69 2dar h HIS 30 Cb 2.12 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 29.52 2dar h HIS 30 CO 0.00 0.00 -0.71 0.00 -0.00 0.00 0.00 177.93 177.22 2dar n ASN 32 N -3.73 -2.29 -3.85 0.00 2.85 -1.23 -5.01 115.26 102.00 2dar n ASN 32 Ca -0.02 -0.22 -0.16 0.00 -0.11 0.00 0.00 54.58 54.08 2dar n ASN 32 Cb 0.69 -2.08 -0.15 0.00 1.24 0.00 0.00 39.78 39.48 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 -4.29 0.27 0.22 1.20 -0.21 -1.26 -4.74 119.66 110.85 2dar s GLN 33 Ca 0.03 0.01 -0.28 0.00 0.02 0.00 0.00 55.36 55.13 2dar s GLN 33 Cb -0.00 -0.38 -0.16 0.00 1.00 0.00 0.00 33.01 33.46 2dar s GLN 33 CO 0.25 -0.06 0.70 1.55 -2.12 0.00 0.00 175.29 175.60 2dar n VAL 34 N 3.72 1.92 -3.56 1.09 3.14 -1.26 -2.17 118.33 121.20 2dar n VAL 34 Ca -0.22 -0.48 -0.41 0.00 -2.96 0.00 0.00 64.34 60.28 2dar n VAL 34 Cb 0.53 -0.32 -0.07 0.00 -1.06 0.00 0.00 33.84 32.92 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 -0.97 4.34 0.07 1.55 1.01 0.11 -4.84 121.20 122.48 2dar s ILE 35 Ca 0.63 -2.27 -0.36 0.00 0.00 0.00 0.00 60.65 58.65 2dar s ILE 35 Cb -0.87 -3.81 -0.19 0.00 0.01 0.00 0.00 42.46 37.60 2dar s ILE 35 CO 0.57 -0.86 1.59 0.03 0.00 0.00 0.00 174.94 176.27 2dar h ARG 36 N 7.90 -1.11 0.00 2.79 3.08 -1.88 -3.37 114.38 121.79 2dar h ARG 36 Ca -0.09 0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2dar h ARG 36 Cb 1.03 0.25 0.00 0.00 0.08 0.00 0.00 29.97 31.33 2dar h ARG 36 CO 0.79 -0.74 0.00 0.41 -1.07 0.00 0.00 179.97 179.36 2dar n GLY 37 N -1.59 -2.06 3.76 0.04 0.00 -1.26 -3.43 105.19 100.66 2dar n GLY 37 Ca -0.15 -1.43 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 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 -0.55 4.45 0.41 1.61 0.04 -1.26 -4.31 135.00 135.39 2dar s PRO 38 Ca 0.00 2.06 0.04 0.00 0.04 0.00 0.00 61.00 63.13 2dar s PRO 38 Cb 0.00 -3.13 -0.04 0.00 0.04 0.00 0.00 34.50 31.37 2dar s PRO 38 CO 0.00 -0.07 0.06 -0.59 0.04 0.00 0.00 177.00 176.44 2dar s PHE 39 N -0.91 1.96 -0.08 0.56 -0.12 -0.44 -4.45 117.98 114.50 2dar s PHE 39 Ca 0.49 -1.02 0.05 0.00 -0.05 0.00 0.00 56.93 56.39 2dar s PHE 39 Cb -0.37 -1.39 -0.00 0.00 -0.63 0.00 0.00 43.02 40.63 2dar s PHE 39 CO 0.46 0.02 -0.24 -0.51 -0.05 0.00 0.00 175.22 174.91 2dar s LEU 40 N -3.65 2.05 -0.33 -1.99 1.43 -0.47 -0.72 118.68 115.02 2dar s LEU 40 Ca 0.25 -0.52 -0.10 0.00 -1.03 0.00 0.00 54.13 52.73 2dar s LEU 40 Cb 0.05 -1.35 0.00 0.00 0.03 0.00 0.00 46.19 44.93 2dar s LEU 40 CO 0.13 0.19 0.16 0.54 0.23 0.00 0.00 176.35 177.60 2dar s VAL 41 N 0.13 4.57 0.00 -1.59 0.11 -1.19 -0.10 120.40 122.33 2dar s VAL 41 Ca -0.12 -0.55 -0.01 0.00 -2.93 0.00 0.00 61.98 58.37 2dar s VAL 41 Cb -0.16 -3.39 -0.01 0.00 -1.53 0.00 0.00 36.38 31.29 2dar s VAL 41 CO 0.06 -0.02 0.02 0.00 -3.33 0.00 0.00 175.10 171.83 2dar s ALA 42 N 1.59 -0.02 -1.82 1.54 0.00 0.16 -2.92 121.76 120.29 2dar s ALA 42 Ca 0.04 -0.26 0.00 0.00 0.00 0.00 0.00 51.96 51.73 2dar s ALA 42 Cb -0.18 0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.01 2dar s ALA 42 CO 0.06 -0.11 0.00 1.28 0.00 0.00 0.00 175.76 176.99 2dar n LEU 43 N 2.14 -1.58 0.00 0.00 7.99 -1.26 -0.56 117.00 123.74 2dar n LEU 43 Ca -0.19 0.25 0.00 0.00 -0.01 0.00 0.00 56.01 56.06 2dar n LEU 43 Cb 0.57 -2.71 0.00 0.00 -0.11 0.00 0.00 43.42 41.17 2dar n LEU 43 CO 0.22 -0.60 0.00 0.61 -1.51 0.00 0.00 177.39 176.11 2dar n GLY 44 N -0.66 2.58 3.87 -0.72 0.00 -1.26 -5.00 105.19 104.00 2dar n GLY 44 Ca -0.21 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.21 2.41 0.27 1.61 1.02 0.28 -5.11 119.74 120.00 2dar s LYS 45 Ca 0.00 -1.71 0.08 0.00 0.02 0.00 0.00 55.97 54.36 2dar s LYS 45 Cb 0.00 -2.26 -0.04 0.00 -0.52 0.00 0.00 37.83 35.02 2dar s LYS 45 CO 0.00 -0.31 0.14 -1.54 -0.92 0.00 0.00 175.35 172.72 2dar s SER 46 N -4.15 5.13 0.12 2.83 1.04 -1.26 0.38 113.70 117.78 2dar s SER 46 Ca 0.44 -0.44 -0.16 0.00 0.48 0.00 0.00 55.95 56.28 2dar s SER 46 Cb -0.02 -1.14 0.03 0.00 0.10 0.00 0.00 66.02 65.00 2dar s SER 46 CO 0.26 -0.07 0.39 0.26 0.98 0.00 0.00 173.24 175.06 2dar s TRP 47 N -2.23 -0.19 0.16 5.02 0.52 0.86 -2.74 118.94 120.33 2dar s TRP 47 Ca 0.33 -0.11 -0.27 0.00 0.02 0.00 0.00 56.10 56.08 2dar s TRP 47 Cb -0.07 0.24 -0.08 0.00 -1.15 0.00 0.00 33.47 32.42 2dar s TRP 47 CO 0.23 -0.68 0.84 -1.01 0.02 0.00 0.00 176.95 176.35 2dar s HIS 48 N -3.68 3.90 -1.29 -1.98 3.76 -1.26 -1.36 115.29 113.37 2dar s HIS 48 Ca 0.02 1.70 0.15 0.00 -0.15 0.00 0.00 55.06 56.78 2dar s HIS 48 Cb 0.02 -2.86 0.70 0.00 1.11 0.00 0.00 32.58 31.55 2dar s HIS 48 CO -0.11 0.43 1.42 -0.35 -0.85 0.00 0.00 174.74 175.29 2dar n PRO 49 N 1.87 0.14 -0.01 8.40 -0.04 -1.26 0.15 135.00 144.25 2dar n PRO 49 Ca -0.03 0.18 0.03 0.00 -0.04 0.00 0.00 63.50 63.64 2dar n PRO 49 Cb 0.48 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.38 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 -1.36 0.70 -0.09 0.54 -0.58 -1.26 -4.64 120.64 113.96 2dar n GLU 50 Ca 0.06 -0.06 -0.10 0.00 -0.42 0.00 0.00 57.16 56.64 2dar n GLU 50 Cb 0.13 -1.20 -0.16 0.00 -0.57 0.00 0.00 31.44 29.65 2dar n GLU 50 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 2dar n GLU 51 N -1.88 0.68 -1.76 3.49 2.13 -1.04 -4.86 120.64 117.41 2dar n GLU 51 Ca -0.03 0.04 -0.39 0.00 0.66 0.00 0.00 57.16 57.44 2dar n GLU 51 Cb 0.31 -1.56 -0.03 0.00 0.27 0.00 0.00 31.44 30.43 2dar n GLU 51 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 2dar s PHE 52 N -2.51 1.34 0.31 4.31 5.36 0.12 -4.92 117.98 122.00 2dar s PHE 52 Ca -0.09 1.09 0.03 0.00 -0.96 0.00 0.00 56.93 56.99 2dar s PHE 52 Cb 0.06 -3.84 -0.04 0.00 -0.34 0.00 0.00 43.02 38.86 2dar s PHE 52 CO 0.83 -2.73 0.13 -0.80 -1.46 0.00 0.00 175.22 171.18 2dar s ASN 53 N 9.74 1.70 1.23 6.13 0.01 -1.26 -2.82 114.94 129.68 2dar s ASN 53 Ca 0.87 -1.51 -0.21 0.00 -0.71 0.00 0.00 52.86 51.31 2dar s ASN 53 Cb -0.19 0.29 0.30 0.00 0.41 0.00 0.00 41.25 42.07 2dar s ASN 53 CO 0.27 -0.82 1.13 0.00 -1.51 0.00 0.00 177.10 176.16 2dar n ALA 55 N -4.82 2.15 -0.05 0.00 0.00 -1.21 -3.97 120.51 112.61 2dar n ALA 55 Ca -0.21 -0.66 -0.06 0.00 0.00 0.00 0.00 53.44 52.51 2dar n ALA 55 Cb 0.60 -0.32 -0.02 0.00 0.00 0.00 0.00 19.45 19.70 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 -2.29 0.00 0.43 0.00 -0.00 -1.26 -4.63 115.22 107.47 2dar n HIS 56 Ca -0.13 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.72 2dar n HIS 56 Cb 0.68 -0.32 0.40 0.00 -0.00 0.00 0.00 29.99 30.76 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 -2.59 -3.79 -3.50 0.00 4.76 -1.25 -4.91 118.16 106.87 2dar n LYS 58 Ca 0.04 0.45 -0.23 0.00 -2.87 0.00 0.00 58.31 55.70 2dar n LYS 58 Cb 0.40 -4.89 0.02 0.00 -1.84 0.00 0.00 35.03 28.71 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 -3.93 4.88 -0.25 4.39 0.01 -1.26 -4.63 114.94 114.15 2dar s ASN 59 Ca 0.29 -1.03 -0.29 0.00 -0.71 0.00 0.00 52.86 51.12 2dar s ASN 59 Cb -0.16 0.26 -0.01 0.00 0.41 0.00 0.00 41.25 41.76 2dar s ASN 59 CO 0.88 -1.15 1.39 0.28 -1.51 0.00 0.00 177.10 176.98 2dar s THR 60 N -2.70 4.03 -0.60 1.60 -1.32 -1.26 -1.52 115.64 113.88 2dar s THR 60 Ca 0.47 1.19 0.01 0.00 -1.21 0.00 0.00 61.69 62.14 2dar s THR 60 Cb -0.04 -3.99 0.43 0.00 -1.51 0.00 0.00 72.50 67.39 2dar s THR 60 CO 0.29 -0.35 1.74 0.23 -2.21 0.00 0.00 174.62 174.32 2dar n MET 61 N 7.27 3.00 -0.06 7.08 2.81 -1.13 -4.61 117.12 131.47 2dar n MET 61 Ca 0.16 -3.67 -0.21 0.00 -1.81 0.00 0.00 57.70 52.17 2dar n MET 61 Cb 0.46 -2.28 -0.12 0.00 -0.71 0.00 0.00 33.22 30.56 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 2.31 0.24 0.00 3.04 0.00 -1.89 -3.42 119.26 119.54 2dar h ALA 62 Ca 0.51 -1.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.08 2dar h ALA 62 Cb 0.82 0.60 -0.03 0.00 0.00 0.00 0.00 17.79 19.19 2dar h ALA 62 CO 1.29 0.73 -1.25 0.66 0.00 0.00 0.00 179.25 180.68 2dar n TYR 63 N -4.22 0.92 -0.44 0.00 4.02 -1.26 -4.72 117.16 111.46 2dar n TYR 63 Ca -0.28 0.40 -0.29 0.00 -0.01 0.00 0.00 57.90 57.71 2dar n TYR 63 Cb 0.75 -1.04 0.27 0.00 -0.02 0.00 0.00 39.34 39.31 2dar n TYR 63 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 2dar s ILE 64 N -2.36 1.60 0.21 -0.72 -4.36 -1.26 -4.95 121.20 109.36 2dar s ILE 64 Ca -0.28 0.00 -0.00 0.00 -0.26 0.00 0.00 60.65 60.11 2dar s ILE 64 Cb 0.06 -2.05 0.04 0.00 1.25 0.00 0.00 42.46 41.76 2dar s ILE 64 CO 0.53 0.00 0.29 0.61 0.24 0.00 0.00 174.94 176.61 2dar n GLY 65 N 1.16 0.71 3.54 6.27 0.00 -1.26 -4.78 105.19 110.83 2dar n GLY 65 Ca 0.07 -1.97 -0.13 0.00 0.00 0.00 0.00 46.02 43.99 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 -0.72 -0.48 -0.11 1.61 -0.12 -0.98 -3.66 117.98 113.52 2dar s PHE 66 Ca 0.19 0.76 0.02 0.00 -0.05 0.00 0.00 56.93 57.86 2dar s PHE 66 Cb -0.01 0.45 0.01 0.00 -0.63 0.00 0.00 43.02 42.84 2dar s PHE 66 CO 0.13 -0.48 -0.17 0.08 -0.05 0.00 0.00 175.22 174.72 2dar s VAL 67 N -1.42 1.64 -0.13 -2.49 1.01 0.17 0.07 120.40 119.24 2dar s VAL 67 Ca -0.04 -0.74 -0.24 0.00 0.00 0.00 0.00 61.98 60.96 2dar s VAL 67 Cb -0.00 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.88 2dar s VAL 67 CO 0.03 0.47 0.73 -0.70 0.00 0.00 0.00 175.10 175.63 2dar s GLU 68 N 0.81 4.34 -0.15 2.72 2.12 -1.26 -0.83 118.70 126.46 2dar s GLU 68 Ca -0.10 0.88 -0.05 0.00 0.36 0.00 0.00 54.97 56.06 2dar s GLU 68 Cb -0.16 -3.52 0.07 0.00 0.26 0.00 0.00 34.13 30.79 2dar s GLU 68 CO 0.01 -0.15 0.27 -2.00 -0.54 0.00 0.00 175.26 172.85 2dar s GLU 69 N 1.53 0.17 -1.44 4.30 2.56 0.11 -4.90 118.70 121.03 2dar s GLU 69 Ca 0.36 0.66 -0.02 0.00 0.00 0.00 0.00 54.97 55.97 2dar s GLU 69 Cb -0.17 -0.24 0.01 0.00 2.00 0.00 0.00 34.13 35.73 2dar s GLU 69 CO 0.14 -0.37 0.41 1.63 -0.56 0.00 0.00 175.26 176.52 2dar n LYS 70 N 5.35 -3.11 -3.08 4.30 4.76 -1.26 -1.70 118.16 123.42 2dar n LYS 70 Ca -0.06 0.38 -0.13 0.00 -2.87 0.00 0.00 58.31 55.63 2dar n LYS 70 Cb 0.50 -4.50 0.07 0.00 -1.84 0.00 0.00 35.03 29.25 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 -1.99 -0.17 3.64 0.72 0.00 -1.26 -5.03 105.19 101.10 2dar n GLY 71 Ca -0.28 -0.04 -0.06 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.91 -0.11 4.61 0.00 -0.69 -5.16 121.76 115.24 2dar s ALA 72 Ca 0.00 2.42 -0.10 0.00 0.00 0.00 0.00 51.96 54.28 2dar s ALA 72 Cb -0.00 -1.47 -0.05 0.00 0.00 0.00 0.00 23.12 21.60 2dar s ALA 72 CO 0.55 -0.43 0.23 -0.51 0.00 0.00 0.00 175.76 175.60 2dar s LEU 73 N 1.75 4.35 -0.07 0.00 1.43 -1.25 0.09 118.68 124.97 2dar s LEU 73 Ca -0.10 0.55 -0.00 0.00 -1.03 0.00 0.00 54.13 53.55 2dar s LEU 73 Cb -0.06 -2.25 0.03 0.00 0.03 0.00 0.00 46.19 43.94 2dar s LEU 73 CO -0.20 0.29 -0.03 -0.31 0.23 0.00 0.00 176.35 176.34 2dar s TYR 74 N -0.53 0.84 0.49 0.29 2.02 -0.01 -3.32 117.35 117.13 2dar s TYR 74 Ca 0.16 -0.28 -0.24 0.00 -0.37 0.00 0.00 57.07 56.34 2dar s TYR 74 Cb -0.13 -0.83 -0.07 0.00 -0.40 0.00 0.00 41.96 40.53 2dar s TYR 74 CO 0.05 -0.31 1.37 0.00 -1.57 0.00 0.00 175.55 175.09 2dar n GLU 76 N -0.52 -0.05 0.31 0.00 0.28 -1.24 0.12 120.64 119.54 2dar n GLU 76 Ca 0.07 1.10 -0.16 0.00 -0.16 0.00 0.00 57.16 58.02 2dar n GLU 76 Cb 0.44 -1.94 -0.08 0.00 1.43 0.00 0.00 31.44 31.28 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 -1.06 -0.57 -1.84 3.38 -1.91 0.39 115.31 113.70 2dar h LEU 77 Ca 0.64 0.07 0.09 0.00 0.09 0.00 0.00 57.88 58.77 2dar h LEU 77 Cb 1.67 0.33 -0.07 0.00 0.09 0.00 0.00 40.66 42.68 2dar h LEU 77 CO -0.62 -0.59 0.19 0.00 0.09 0.00 0.00 178.44 177.51 2dar h TYR 79 N 0.35 -0.44 0.00 0.00 5.03 -1.05 -0.81 116.97 120.05 2dar h TYR 79 Ca 0.29 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.59 2dar h TYR 79 Cb 0.36 0.14 0.00 0.00 1.55 0.00 0.00 36.73 38.79 2dar h TYR 79 CO -0.19 -0.27 0.43 1.49 -1.32 0.00 0.00 178.16 178.30 2dar h GLU 80 N -0.48 0.00 0.02 1.82 4.57 -0.11 0.68 114.58 121.10 2dar h GLU 80 Ca -0.05 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.13 2dar h GLU 80 Cb 0.36 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.95 2dar h GLU 80 CO 0.08 0.00 -0.01 0.87 -1.18 0.00 0.00 179.01 178.77 2dar h LYS 81 N 0.00 -0.03 0.00 1.92 1.57 -0.45 -3.33 116.57 116.25 2dar h LYS 81 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2dar h LYS 81 Cb 0.86 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.18 2dar h LYS 81 CO 0.00 0.52 -0.61 1.19 -0.57 0.00 0.00 179.45 179.98 2dar n PHE 82 N -4.72 0.25 0.06 -1.35 3.72 -0.26 -4.33 117.46 110.83 2dar n PHE 82 Ca -0.06 0.11 0.17 0.00 -0.05 0.00 0.00 57.45 57.61 2dar n PHE 82 Cb 0.27 -0.47 0.38 0.00 -0.94 0.00 0.00 39.48 38.73 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 -0.74 0.00 -3.28 1.38 -1.00 0.12 -2.77 116.94 110.66 2dar h PHE 83 Ca 0.00 0.00 -0.65 0.00 2.81 0.00 0.00 57.97 60.13 2dar h PHE 83 Cb 0.61 0.00 -0.39 0.00 3.61 0.00 0.00 35.95 39.78 2dar h PHE 83 CO -0.26 0.00 -0.47 0.00 -1.61 0.00 0.00 178.31 175.97 2dar s ALA 84 N -4.28 3.73 -0.16 2.45 0.00 -1.01 -4.96 121.76 117.54 2dar s ALA 84 Ca -0.02 -3.61 -0.08 0.00 0.00 0.00 0.00 51.96 48.25 2dar s ALA 84 Cb 0.09 -2.36 -0.04 0.00 0.00 0.00 0.00 23.12 20.80 2dar s ALA 84 CO 0.31 -2.09 0.13 -1.12 0.00 0.00 0.00 175.76 172.99 2dar s SER 85 N -0.59 6.29 0.00 0.00 0.01 -1.05 -4.64 113.70 113.72 2dar s SER 85 Ca 0.22 0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.84 2dar s SER 85 Cb -0.13 -2.07 0.00 0.00 0.21 0.00 0.00 66.02 64.03 2dar s SER 85 CO -0.09 0.31 0.00 0.61 0.41 0.00 0.00 173.24 174.47 2dar n GLY 86 N 2.67 0.58 3.57 3.44 0.00 -1.26 -4.64 105.19 109.55 2dar n GLY 86 Ca -0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.48 2.53 0.32 1.61 0.04 -1.26 -4.81 135.00 132.95 2dar s PRO 87 Ca 0.00 -0.62 0.09 0.00 0.04 0.00 0.00 61.00 60.51 2dar s PRO 87 Cb 0.00 -5.13 0.94 0.00 0.04 0.00 0.00 34.50 30.35 2dar s PRO 87 CO 0.00 -3.61 1.63 0.66 0.04 0.00 0.00 177.00 175.72 2dar h SER 88 N 10.70 0.15 -2.45 6.66 4.64 -2.04 -3.38 113.55 127.83 2dar h SER 88 Ca 0.14 0.22 -0.53 0.00 -0.47 0.00 0.00 61.79 61.15 2dar h SER 88 Cb 0.98 0.26 0.03 0.00 -0.31 0.00 0.00 62.40 63.36 2dar h SER 88 CO 1.21 -0.23 1.17 -0.55 -0.87 0.00 0.00 176.83 177.57 2dar s SER 89 N -4.92 6.43 0.00 4.97 0.15 -1.26 -5.19 113.70 113.88 2dar s SER 89 Ca -0.11 2.72 0.00 0.00 0.70 0.00 0.00 55.95 59.26 2dar s SER 89 Cb 0.29 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 62.05 2dar s SER 89 CO 0.78 -1.03 0.00 0.61 1.20 0.00 0.00 173.24 174.80