#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 6.40 0.11 1.61 0.01 -1.26 -5.10 113.70 115.48 2dar s SER 2 Ca 0.00 0.88 0.07 0.00 1.31 0.00 0.00 55.95 58.22 2dar s SER 2 Cb 0.00 -2.22 -0.04 0.00 0.21 0.00 0.00 66.02 63.97 2dar s SER 2 CO 0.00 -0.38 -0.10 -0.55 0.41 0.00 0.00 173.24 172.62 2dar s SER 3 N -3.53 4.41 0.00 2.44 0.15 -1.26 -5.11 113.70 110.80 2dar s SER 3 Ca 0.47 -0.40 0.00 0.00 0.70 0.00 0.00 55.95 56.72 2dar s SER 3 Cb -0.10 -0.84 0.00 0.00 -1.71 0.00 0.00 66.02 63.37 2dar s SER 3 CO 0.35 0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.57 2dar n GLY 4 N 0.63 1.18 3.53 9.45 0.00 -1.26 -5.10 105.19 113.62 2dar n GLY 4 Ca -0.13 0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.99 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 0.00 6.33 0.33 1.61 0.01 -1.26 -4.94 113.70 115.79 2dar s SER 5 Ca 0.00 -1.06 -0.03 0.00 1.31 0.00 0.00 55.95 56.17 2dar s SER 5 Cb 0.00 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.71 2dar s SER 5 CO 0.00 -1.57 0.46 -0.94 0.41 0.00 0.00 173.24 171.60 2dar s SER 6 N 4.14 0.85 0.03 2.44 1.04 -1.26 -5.10 113.70 115.85 2dar s SER 6 Ca 0.36 -1.46 0.00 0.00 0.48 0.00 0.00 55.95 55.34 2dar s SER 6 Cb -0.06 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.71 2dar s SER 6 CO 0.03 -1.27 0.00 0.61 0.98 0.00 0.00 173.24 173.59 2dar n GLY 7 N -0.55 -0.03 2.31 7.32 0.00 -1.26 -4.92 105.19 108.06 2dar n GLY 7 Ca 0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 2dar n GLY 7 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dar n ASP 8 N -2.76 4.19 -4.08 1.61 5.68 -1.26 -4.95 116.55 114.98 2dar n ASP 8 Ca 0.00 -3.45 -0.36 0.00 -0.50 0.00 0.00 54.79 50.48 2dar n ASP 8 Cb 0.12 -0.41 -0.09 0.00 -1.14 0.00 0.00 41.12 39.61 2dar n ASP 8 CO 0.00 0.00 0.00 -1.58 -1.33 0.00 0.00 177.20 174.29 2dar s GLN 9 N -3.57 2.78 -0.27 0.11 2.00 -1.26 -5.02 119.66 114.43 2dar s GLN 9 Ca 0.45 -2.84 -0.21 0.00 -2.00 0.00 0.00 55.36 50.76 2dar s GLN 9 Cb 0.40 -3.77 0.07 0.00 0.80 0.00 0.00 33.01 30.51 2dar s GLN 9 CO -0.04 -1.21 0.70 -0.51 -0.50 0.00 0.00 175.29 173.72 2dar s ASP 10 N 0.22 -0.82 0.02 6.67 1.11 -1.26 -5.07 116.67 117.53 2dar s ASP 10 Ca 0.21 1.46 0.08 0.00 0.18 0.00 0.00 52.55 54.48 2dar s ASP 10 Cb -0.15 1.41 -0.02 0.00 1.07 0.00 0.00 42.92 45.23 2dar s ASP 10 CO -0.07 -0.24 -0.25 -0.89 1.18 0.00 0.00 175.17 174.90 2dar s THR 11 N 0.93 1.96 0.42 -1.27 2.01 -1.26 -5.01 115.64 113.42 2dar s THR 11 Ca -0.04 -1.20 0.24 0.00 0.31 0.00 0.00 61.69 60.99 2dar s THR 11 Cb -0.05 -1.66 0.44 0.00 0.01 0.00 0.00 72.50 71.23 2dar s THR 11 CO -0.08 0.42 1.72 0.25 -0.69 0.00 0.00 174.62 176.24 2dar h LEU 12 N 5.14 0.34 -6.62 4.42 5.85 -2.02 -3.42 115.31 119.00 2dar h LEU 12 Ca -0.44 0.10 -0.62 0.00 0.84 0.00 0.00 57.88 57.76 2dar h LEU 12 Cb 1.14 0.05 0.02 0.00 0.37 0.00 0.00 40.66 42.24 2dar h LEU 12 CO 0.45 -0.02 0.31 0.52 -0.34 0.00 0.00 178.44 179.36 2dar n VAL 13 N -4.62 0.00 -4.27 1.05 0.31 -1.26 -4.93 118.33 104.61 2dar n VAL 13 Ca 0.30 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 64.35 2dar n VAL 13 Cb 1.10 -0.21 -0.09 0.00 -0.91 0.00 0.00 33.84 33.73 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 1.25 2.07 0.27 5.55 -2.07 0.74 -4.86 119.66 122.62 2dar s GLN 14 Ca 0.73 -1.20 0.09 0.00 -1.82 0.00 0.00 55.36 53.16 2dar s GLN 14 Cb -1.03 -2.20 -0.05 0.00 -1.09 0.00 0.00 33.01 28.63 2dar s GLN 14 CO 0.52 0.46 -0.12 1.03 -1.32 0.00 0.00 175.29 175.86 2dar s ARG 15 N -2.64 1.58 -0.02 9.60 3.00 -1.26 -1.23 118.95 127.98 2dar s ARG 15 Ca 0.24 -1.76 -0.01 0.00 0.00 0.00 0.00 55.73 54.19 2dar s ARG 15 Cb -0.09 -1.40 -0.04 0.00 0.00 0.00 0.00 34.95 33.42 2dar s ARG 15 CO 0.15 0.16 0.08 0.00 0.00 0.00 0.00 175.30 175.69 2dar s ALA 16 N -2.81 3.59 -0.41 2.13 0.00 -1.26 -4.66 121.76 118.34 2dar s ALA 16 Ca 0.28 -0.85 -0.26 0.00 0.00 0.00 0.00 51.96 51.13 2dar s ALA 16 Cb 0.00 -1.60 0.02 0.00 0.00 0.00 0.00 23.12 21.54 2dar s ALA 16 CO 0.12 0.68 0.96 -2.00 0.00 0.00 0.00 175.76 175.52 2dar s GLU 17 N -1.61 3.75 0.09 0.00 2.12 0.23 -4.82 118.70 118.45 2dar s GLU 17 Ca 0.22 0.48 -0.31 0.00 0.36 0.00 0.00 54.97 55.71 2dar s GLU 17 Cb -0.12 -3.85 -0.11 0.00 0.26 0.00 0.00 34.13 30.31 2dar s GLU 17 CO 0.12 -1.09 1.86 0.72 -0.54 0.00 0.00 175.26 176.33 2dar n HIS 18 N 7.05 2.56 -4.43 5.30 8.25 -1.26 -3.22 115.22 129.48 2dar n HIS 18 Ca 0.08 -0.17 -0.33 0.00 -0.26 0.00 0.00 57.72 57.04 2dar n HIS 18 Cb 0.48 -2.73 -0.15 0.00 1.12 0.00 0.00 29.99 28.70 2dar n HIS 18 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2dar s ILE 19 N 3.12 2.53 1.12 1.59 -1.09 -0.47 -5.03 121.20 122.96 2dar s ILE 19 Ca 0.84 -0.81 -0.16 0.00 -2.23 0.00 0.00 60.65 58.29 2dar s ILE 19 Cb -0.50 -2.07 0.25 0.00 -1.58 0.00 0.00 42.46 38.56 2dar s ILE 19 CO 0.39 0.52 1.10 -2.16 -1.23 0.00 0.00 174.94 173.56 2dar s PRO 20 N 0.96 -0.56 0.55 2.79 0.04 -1.26 -1.69 135.00 135.82 2dar s PRO 20 Ca -0.03 0.17 -0.15 0.00 0.04 0.00 0.00 61.00 61.03 2dar s PRO 20 Cb -0.15 -1.65 -0.06 0.00 0.04 0.00 0.00 34.50 32.67 2dar s PRO 20 CO -0.03 -3.32 1.00 0.00 0.04 0.00 0.00 177.00 174.69 2dar s ALA 21 N -2.99 3.02 0.00 8.56 0.00 -1.26 -4.00 121.76 125.09 2dar s ALA 21 Ca 0.69 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.81 2dar s ALA 21 Cb -0.14 -3.13 0.00 0.00 0.00 0.00 0.00 23.12 19.85 2dar s ALA 21 CO 0.57 -0.41 0.00 0.41 0.00 0.00 0.00 175.76 176.33 2dar n GLY 22 N -1.69 1.28 0.25 0.00 0.00 -1.24 -4.70 105.19 99.09 2dar n GLY 22 Ca 0.07 -0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.16 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 0.00 -0.06 -3.58 1.61 4.81 -1.26 -4.56 118.16 115.13 2dar n LYS 23 Ca 0.00 1.07 -0.13 0.00 -0.87 0.00 0.00 58.31 58.38 2dar n LYS 23 Cb 0.00 -1.65 -0.06 0.00 0.02 0.00 0.00 35.03 33.34 2dar n LYS 23 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 2dar s ARG 24 N -5.75 0.75 -0.61 1.64 3.52 -1.26 -5.10 118.95 112.14 2dar s ARG 24 Ca -0.10 0.35 0.06 0.00 -0.13 0.00 0.00 55.73 55.92 2dar s ARG 24 Cb 0.20 0.36 0.25 0.00 -1.56 0.00 0.00 34.95 34.19 2dar s ARG 24 CO 0.55 -0.20 0.71 0.25 -0.81 0.00 0.00 175.30 175.80 2dar n THR 25 N 1.26 1.96 -0.93 4.11 -2.24 -1.26 -4.89 114.28 112.29 2dar n THR 25 Ca -0.14 -5.06 -0.23 0.00 -2.27 0.00 0.00 64.05 56.35 2dar n THR 25 Cb 0.57 -2.08 0.20 0.00 -2.10 0.00 0.00 70.33 66.91 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 0.97 -2.68 -3.69 -0.78 -0.04 -1.26 -4.39 135.00 123.13 2dar n PRO 26 Ca 0.28 -1.37 -0.37 0.00 -0.04 0.00 0.00 63.50 62.00 2dar n PRO 26 Cb 0.42 -1.28 -0.12 0.00 -0.04 0.00 0.00 33.50 32.48 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 -4.95 3.66 1.03 0.54 -1.94 -1.26 -1.57 119.30 114.81 2dar s MET 27 Ca 0.56 -0.49 -0.21 0.00 -1.71 0.00 0.00 55.69 53.83 2dar s MET 27 Cb -0.05 -3.47 -0.02 0.00 2.01 0.00 0.00 34.83 33.30 2dar s MET 27 CO 0.43 -0.24 -0.61 0.00 -0.01 0.00 0.00 175.02 174.59 2dar n ALA 29 N -3.99 1.58 0.06 0.00 0.00 -0.17 -3.66 120.51 114.33 2dar n ALA 29 Ca -0.00 -0.87 -0.03 0.00 0.00 0.00 0.00 53.44 52.53 2dar n ALA 29 Cb 0.62 0.15 -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 -0.48 -0.20 0.00 0.00 -0.00 -1.94 -3.35 115.15 109.18 2dar h HIS 30 Ca -0.52 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.85 2dar h HIS 30 Cb 1.57 0.07 0.00 0.00 -0.00 0.00 0.00 27.41 29.05 2dar h HIS 30 CO -0.03 -0.13 0.00 0.00 -0.00 0.00 0.00 177.93 177.77 2dar n ASN 32 N -3.00 -1.12 -4.21 0.00 3.02 -1.24 -4.96 115.26 103.74 2dar n ASN 32 Ca 0.04 -0.90 -0.28 0.00 -0.03 0.00 0.00 54.58 53.41 2dar n ASN 32 Cb 0.51 -3.60 -0.16 0.00 -0.61 0.00 0.00 39.78 35.92 2dar n ASN 32 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2dar s GLN 33 N -6.29 1.93 -0.22 3.52 -0.21 -1.26 -4.69 119.66 112.45 2dar s GLN 33 Ca 0.07 -0.75 -0.41 0.00 0.02 0.00 0.00 55.36 54.29 2dar s GLN 33 Cb -0.04 -1.75 -0.17 0.00 1.00 0.00 0.00 33.01 32.05 2dar s GLN 33 CO 0.85 0.38 1.58 1.55 -2.12 0.00 0.00 175.29 177.52 2dar n VAL 34 N 2.82 0.16 -3.20 1.09 3.14 -1.26 -2.90 118.33 118.18 2dar n VAL 34 Ca -0.17 -0.03 -0.41 0.00 -2.96 0.00 0.00 64.34 60.78 2dar n VAL 34 Cb 0.53 -0.90 -0.07 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 2.51 5.02 -0.15 1.55 1.01 -0.61 -4.95 121.20 125.58 2dar s ILE 35 Ca 0.96 0.74 -0.14 0.00 0.00 0.00 0.00 60.65 62.21 2dar s ILE 35 Cb -1.14 -3.91 -0.11 0.00 0.01 0.00 0.00 42.46 37.30 2dar s ILE 35 CO 0.64 -0.06 0.18 0.03 0.00 0.00 0.00 174.94 175.73 2dar h ARG 36 N 8.18 0.00 0.00 2.79 3.08 -1.90 -3.38 114.38 123.16 2dar h ARG 36 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2dar h ARG 36 Cb 1.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.18 2dar h ARG 36 CO 0.75 0.48 0.00 0.41 -1.07 0.00 0.00 179.97 180.54 2dar n GLY 37 N 1.61 -1.34 3.75 0.04 0.00 -1.26 -3.68 105.19 104.30 2dar n GLY 37 Ca -0.12 -1.50 -0.41 0.00 0.00 0.00 0.00 46.02 43.99 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 4.43 0.40 1.61 0.04 -1.26 -4.52 135.00 135.71 2dar s PRO 38 Ca 0.00 2.05 0.03 0.00 0.04 0.00 0.00 61.00 63.13 2dar s PRO 38 Cb 0.00 -3.15 -0.03 0.00 0.04 0.00 0.00 34.50 31.35 2dar s PRO 38 CO 0.00 -0.13 0.09 -0.59 0.04 0.00 0.00 177.00 176.41 2dar s PHE 39 N -0.58 1.86 0.23 0.56 -0.12 -0.68 -4.49 117.98 114.76 2dar s PHE 39 Ca 0.51 -1.14 0.11 0.00 -0.05 0.00 0.00 56.93 56.37 2dar s PHE 39 Cb -0.37 -1.28 -0.05 0.00 -0.63 0.00 0.00 43.02 40.70 2dar s PHE 39 CO 0.44 -0.12 -0.19 -0.51 -0.05 0.00 0.00 175.22 174.79 2dar s LEU 40 N -3.62 2.63 -0.18 -1.99 1.43 -0.58 -1.37 118.68 115.00 2dar s LEU 40 Ca 0.24 -0.86 -0.04 0.00 -1.03 0.00 0.00 54.13 52.44 2dar s LEU 40 Cb 0.04 -1.26 0.09 0.00 0.03 0.00 0.00 46.19 45.09 2dar s LEU 40 CO 0.13 0.08 0.24 0.54 0.23 0.00 0.00 176.35 177.58 2dar s VAL 41 N -2.01 -0.37 0.19 -1.59 0.11 -1.20 -1.29 120.40 114.24 2dar s VAL 41 Ca 0.25 0.04 0.00 0.00 -2.93 0.00 0.00 61.98 59.34 2dar s VAL 41 Cb -0.07 -0.59 0.00 0.00 -1.53 0.00 0.00 36.38 34.19 2dar s VAL 41 CO 0.13 -0.08 0.00 0.00 -3.33 0.00 0.00 175.10 171.82 2dar n ALA 42 N 5.33 3.00 -2.55 1.54 0.00 -1.22 -0.60 120.51 126.00 2dar n ALA 42 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.96 2dar n ALA 42 Cb 0.50 0.05 0.00 0.00 0.00 0.00 0.00 19.45 20.00 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 -3.28 5.92 -2.86 0.00 7.99 -1.26 -4.67 117.00 118.85 2dar n LEU 43 Ca 0.00 -4.45 -0.19 0.00 -0.01 0.00 0.00 56.01 51.36 2dar n LEU 43 Cb 0.00 -1.58 -0.04 0.00 -0.11 0.00 0.00 43.42 41.70 2dar n LEU 43 CO 0.00 0.97 -0.07 0.61 -1.51 0.00 0.00 177.39 177.39 2dar n GLY 44 N 3.70 -0.23 3.79 -0.72 0.00 -1.26 -4.76 105.19 105.72 2dar n GLY 44 Ca 0.41 0.03 -0.08 0.00 0.00 0.00 0.00 46.02 46.37 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 -4.07 2.00 -0.15 1.61 1.02 -1.26 -5.16 119.74 113.73 2dar s LYS 45 Ca 0.37 -1.28 -0.01 0.00 0.02 0.00 0.00 55.97 55.07 2dar s LYS 45 Cb -0.22 0.60 -0.01 0.00 -0.52 0.00 0.00 37.83 37.68 2dar s LYS 45 CO 0.45 -0.92 -0.11 -1.54 -0.92 0.00 0.00 175.35 172.32 2dar s SER 46 N -3.02 4.13 -0.03 2.83 1.04 -1.26 -3.45 113.70 113.94 2dar s SER 46 Ca 0.15 -0.32 0.04 0.00 0.48 0.00 0.00 55.95 56.31 2dar s SER 46 Cb -0.05 -1.65 -0.00 0.00 0.10 0.00 0.00 66.02 64.42 2dar s SER 46 CO 0.10 0.14 -0.16 0.26 0.98 0.00 0.00 173.24 174.56 2dar s TRP 47 N 0.51 1.61 0.39 5.02 0.52 -0.41 -1.00 118.94 125.59 2dar s TRP 47 Ca -0.08 -0.42 -0.27 0.00 0.02 0.00 0.00 56.10 55.35 2dar s TRP 47 Cb -0.15 -1.08 -0.10 0.00 -1.15 0.00 0.00 33.47 30.99 2dar s TRP 47 CO 0.04 -0.13 1.41 -1.01 0.02 0.00 0.00 176.95 177.28 2dar s HIS 48 N -0.05 2.68 -0.76 -1.98 3.76 -1.26 -1.52 115.29 116.16 2dar s HIS 48 Ca -0.01 1.28 0.18 0.00 -0.15 0.00 0.00 55.06 56.36 2dar s HIS 48 Cb -0.10 -3.88 0.78 0.00 1.11 0.00 0.00 32.58 30.49 2dar s HIS 48 CO 0.01 -2.61 1.57 -0.35 -0.85 0.00 0.00 174.74 172.51 2dar n PRO 49 N 0.31 0.09 -0.08 8.40 -0.04 -1.26 -0.57 135.00 141.85 2dar n PRO 49 Ca 0.02 0.34 -0.14 0.00 -0.04 0.00 0.00 63.50 63.67 2dar n PRO 49 Cb 0.41 -1.67 -0.14 0.00 -0.04 0.00 0.00 33.50 32.06 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 -1.84 0.68 -0.02 0.54 0.28 -1.26 -4.54 120.64 114.48 2dar n GLU 50 Ca 0.03 0.15 -0.20 0.00 -0.16 0.00 0.00 57.16 56.98 2dar n GLU 50 Cb 0.19 -1.60 -0.13 0.00 1.43 0.00 0.00 31.44 31.32 2dar n GLU 50 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 2dar h GLU 51 N 0.01 0.17 -5.08 3.44 5.08 -1.90 -3.44 114.58 112.86 2dar h GLU 51 Ca -0.49 -0.28 -0.29 0.00 -1.00 0.00 0.00 59.36 57.30 2dar h GLU 51 Cb 2.06 0.11 -0.09 0.00 0.50 0.00 0.00 28.75 31.32 2dar h GLU 51 CO 0.01 1.14 1.58 0.34 -1.00 0.00 0.00 179.01 181.08 2dar n PHE 52 N -4.18 0.30 -4.32 4.33 7.35 0.26 -4.84 117.46 116.36 2dar n PHE 52 Ca -0.21 0.01 -0.19 0.00 -0.76 0.00 0.00 57.45 56.31 2dar n PHE 52 Cb 0.77 -1.07 -0.13 0.00 0.35 0.00 0.00 39.48 39.39 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 2.91 1.45 1.06 -2.13 0.01 -1.26 -3.37 114.94 113.60 2dar s ASN 53 Ca 1.23 -0.41 -0.21 0.00 -0.71 0.00 0.00 52.86 52.76 2dar s ASN 53 Cb -0.70 -0.09 -0.03 0.00 0.41 0.00 0.00 41.25 40.84 2dar s ASN 53 CO 0.46 0.02 -0.59 0.00 -1.51 0.00 0.00 177.10 175.48 2dar n ALA 55 N -3.89 3.68 -0.08 0.00 0.00 -0.85 -3.17 120.51 116.21 2dar n ALA 55 Ca -0.00 -0.52 -0.16 0.00 0.00 0.00 0.00 53.44 52.76 2dar n ALA 55 Cb 0.66 -0.70 -0.05 0.00 0.00 0.00 0.00 19.45 19.35 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 -1.82 0.00 1.00 0.00 -0.00 -1.26 -4.69 115.22 108.45 2dar n HIS 56 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.72 57.83 2dar n HIS 56 Cb 0.41 -0.55 -0.04 0.00 -0.00 0.00 0.00 29.99 29.82 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 -0.55 -1.89 -4.94 0.00 4.01 -1.19 -4.86 118.16 108.75 2dar n LYS 58 Ca 0.07 0.29 -0.31 0.00 -0.51 0.00 0.00 58.31 57.85 2dar n LYS 58 Cb 0.42 -3.91 -0.14 0.00 -0.51 0.00 0.00 35.03 30.89 2dar n LYS 58 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 2dar s ASN 59 N -4.07 3.53 -0.10 4.39 0.02 -1.26 -4.53 114.94 112.92 2dar s ASN 59 Ca 0.17 -0.42 -0.38 0.00 -1.02 0.00 0.00 52.86 51.22 2dar s ASN 59 Cb -0.08 -0.53 -0.15 0.00 0.02 0.00 0.00 41.25 40.51 2dar s ASN 59 CO 0.92 0.29 1.64 1.07 0.02 0.00 0.00 177.10 181.04 2dar n THR 60 N 2.01 0.24 -1.60 1.60 5.66 -1.26 -1.82 114.28 119.11 2dar n THR 60 Ca -0.16 -0.04 -0.29 0.00 -3.05 0.00 0.00 64.05 60.51 2dar n THR 60 Cb 0.52 -1.25 0.07 0.00 -1.55 0.00 0.00 70.33 68.12 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 4.58 2.98 -0.02 1.09 0.00 -1.22 -4.66 117.12 119.86 2dar n MET 61 Ca 0.23 -3.61 -0.15 0.00 0.00 0.00 0.00 57.70 54.16 2dar n MET 61 Cb 0.19 -2.25 -0.10 0.00 0.00 0.00 0.00 33.22 31.06 2dar n MET 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2dar h ALA 62 N 1.97 0.10 0.05 3.04 0.00 -1.89 -3.38 119.26 119.15 2dar h ALA 62 Ca 0.50 -0.46 -0.34 0.00 0.00 0.00 0.00 54.91 54.61 2dar h ALA 62 Cb 1.21 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 2dar h ALA 62 CO 1.19 0.18 -1.88 0.66 0.00 0.00 0.00 179.25 179.40 2dar n TYR 63 N -4.42 0.87 -1.42 0.00 4.01 -1.26 -4.74 117.16 110.19 2dar n TYR 63 Ca -0.09 0.26 -0.29 0.00 -0.16 0.00 0.00 57.90 57.62 2dar n TYR 63 Cb 0.52 -1.10 0.18 0.00 -0.31 0.00 0.00 39.34 38.63 2dar n TYR 63 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 2dar s ILE 64 N -2.48 1.89 0.01 -0.72 -4.36 -1.26 -5.02 121.20 109.26 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 0.08 -2.68 0.00 0.00 1.25 0.00 0.00 42.46 41.11 2dar s ILE 64 CO 0.65 0.00 0.02 0.61 0.24 0.00 0.00 174.94 176.46 2dar n GLY 65 N -1.95 0.75 3.74 6.27 0.00 -1.26 -4.79 105.19 107.94 2dar n GLY 65 Ca 0.09 -1.95 -0.04 0.00 0.00 0.00 0.00 46.02 44.12 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 0.18 -0.15 -0.04 1.61 -0.12 -0.37 -3.55 117.98 115.55 2dar s PHE 66 Ca 0.01 -0.15 -0.02 0.00 -0.05 0.00 0.00 56.93 56.73 2dar s PHE 66 Cb -0.00 0.63 0.03 0.00 -0.63 0.00 0.00 43.02 43.05 2dar s PHE 66 CO 0.01 -0.81 0.07 0.08 -0.05 0.00 0.00 175.22 174.52 2dar s VAL 67 N -3.27 -0.11 -0.12 -2.49 1.01 0.24 -0.18 120.40 115.48 2dar s VAL 67 Ca 0.12 0.35 -0.24 0.00 0.00 0.00 0.00 61.98 62.21 2dar s VAL 67 Cb -0.01 -0.15 -0.03 0.00 0.00 0.00 0.00 36.38 36.19 2dar s VAL 67 CO 0.01 0.15 0.73 -0.70 0.00 0.00 0.00 175.10 175.29 2dar s GLU 68 N 1.84 4.36 -0.23 2.72 2.12 -1.26 -0.38 118.70 127.87 2dar s GLU 68 Ca 0.00 0.88 -0.10 0.00 0.36 0.00 0.00 54.97 56.11 2dar s GLU 68 Cb -0.12 -3.50 0.09 0.00 0.26 0.00 0.00 34.13 30.86 2dar s GLU 68 CO -0.03 -0.10 0.53 -2.00 -0.54 0.00 0.00 175.26 173.11 2dar s GLU 69 N 1.36 0.47 -1.39 4.30 2.12 0.26 -4.91 118.70 120.92 2dar s GLU 69 Ca 0.36 1.13 -0.08 0.00 0.36 0.00 0.00 54.97 56.74 2dar s GLU 69 Cb -0.17 0.37 0.05 0.00 0.26 0.00 0.00 34.13 34.65 2dar s GLU 69 CO 0.15 -0.20 0.57 1.63 -0.54 0.00 0.00 175.26 176.87 2dar n LYS 70 N 5.00 -4.04 -2.78 4.30 5.02 -1.26 -1.50 118.16 122.90 2dar n LYS 70 Ca -0.14 0.62 -0.08 0.00 -2.02 0.00 0.00 58.31 56.68 2dar n LYS 70 Cb 0.52 -5.39 0.03 0.00 -0.02 0.00 0.00 35.03 30.18 2dar n LYS 70 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dar n GLY 71 N -1.32 0.29 3.38 0.72 0.00 -1.26 -5.05 105.19 101.94 2dar n GLY 71 Ca -0.04 -0.30 -0.09 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 -3.13 -1.31 -0.24 4.61 0.00 -0.56 -5.14 121.76 115.99 2dar s ALA 72 Ca 0.14 1.78 -0.13 0.00 0.00 0.00 0.00 51.96 53.75 2dar s ALA 72 Cb -0.06 -1.13 -0.04 0.00 0.00 0.00 0.00 23.12 21.88 2dar s ALA 72 CO 0.28 -0.38 0.30 -0.51 0.00 0.00 0.00 175.76 175.45 2dar s LEU 73 N 1.66 4.09 -0.14 0.00 1.43 -1.25 -0.57 118.68 123.89 2dar s LEU 73 Ca -0.09 0.27 0.01 0.00 -1.03 0.00 0.00 54.13 53.29 2dar s LEU 73 Cb -0.08 -2.33 -0.00 0.00 0.03 0.00 0.00 46.19 43.81 2dar s LEU 73 CO -0.15 -0.07 -0.16 -0.31 0.23 0.00 0.00 176.35 175.90 2dar s TYR 74 N 1.53 2.76 0.34 0.29 2.02 0.49 -2.02 117.35 122.76 2dar s TYR 74 Ca 0.13 -0.95 -0.29 0.00 -0.37 0.00 0.00 57.07 55.60 2dar s TYR 74 Cb -0.15 -1.85 -0.11 0.00 -0.40 0.00 0.00 41.96 39.45 2dar s TYR 74 CO 0.08 -0.40 1.39 0.00 -1.57 0.00 0.00 175.55 175.05 2dar n GLU 76 N 0.82 -0.04 0.30 0.00 0.28 -1.23 0.99 120.64 121.76 2dar n GLU 76 Ca 0.01 0.90 -0.18 0.00 -0.16 0.00 0.00 57.16 57.73 2dar n GLU 76 Cb 0.41 -1.58 -0.09 0.00 1.43 0.00 0.00 31.44 31.60 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 -1.23 -0.44 -1.84 4.07 -1.90 0.38 115.31 114.34 2dar h LEU 77 Ca 0.52 0.09 0.03 0.00 0.08 0.00 0.00 57.88 58.60 2dar h LEU 77 Cb 1.33 0.40 -0.04 0.00 1.08 0.00 0.00 40.66 43.43 2dar h LEU 77 CO -0.51 -0.64 0.23 0.00 -1.08 0.00 0.00 178.44 176.44 2dar h TYR 79 N 0.46 -0.38 -0.78 0.00 5.03 -1.05 -1.32 116.97 118.92 2dar h TYR 79 Ca 0.19 -0.01 0.23 0.00 2.58 0.00 0.00 58.73 61.72 2dar h TYR 79 Cb 0.08 0.13 -0.03 0.00 1.55 0.00 0.00 36.73 38.46 2dar h TYR 79 CO -0.10 -0.23 0.63 1.49 -1.32 0.00 0.00 178.16 178.64 2dar h GLU 80 N -0.39 0.00 0.25 1.82 4.81 -0.25 1.09 114.58 121.91 2dar h GLU 80 Ca -0.04 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2dar h GLU 80 Cb 0.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.68 2dar h GLU 80 CO 0.06 0.00 -0.12 0.87 -0.73 0.00 0.00 179.01 179.09 2dar h LYS 81 N 0.00 -0.32 0.00 1.92 1.57 -0.54 -2.58 116.57 116.63 2dar h LYS 81 Ca 0.37 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 2dar h LYS 81 Cb 1.63 0.07 0.00 0.00 0.08 0.00 0.00 32.23 34.01 2dar h LYS 81 CO -0.00 -0.00 -0.37 0.74 -0.57 0.00 0.00 179.45 179.24 2dar h PHE 82 N -0.67 0.00 0.17 -1.35 0.04 0.01 -3.26 116.94 111.88 2dar h PHE 82 Ca -0.03 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.75 2dar h PHE 82 Cb 0.47 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.57 2dar h PHE 82 CO 0.03 0.00 -0.52 0.74 -0.60 0.00 0.00 178.31 177.96 2dar h PHE 83 N -0.97 -1.48 -0.58 -0.55 0.04 0.96 -1.89 116.94 112.46 2dar h PHE 83 Ca 0.00 0.04 -0.34 0.00 2.80 0.00 0.00 57.97 60.46 2dar h PHE 83 Cb 0.37 0.63 -0.13 0.00 2.20 0.00 0.00 35.95 39.02 2dar h PHE 83 CO -0.16 -0.60 0.30 0.00 -0.60 0.00 0.00 178.31 177.25 2dar n ALA 84 N -2.91 5.58 -2.63 2.45 0.00 -0.97 -4.92 120.51 117.11 2dar n ALA 84 Ca -0.09 -1.99 -0.42 0.00 0.00 0.00 0.00 53.44 50.94 2dar n ALA 84 Cb 0.42 -1.68 -0.03 0.00 0.00 0.00 0.00 19.45 18.15 2dar n ALA 84 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2dar s SER 85 N 0.55 6.84 -0.83 0.00 0.15 -0.71 -4.68 113.70 115.01 2dar s SER 85 Ca 0.41 0.95 0.01 0.00 0.70 0.00 0.00 55.95 58.02 2dar s SER 85 Cb 0.28 -2.47 0.24 0.00 -1.71 0.00 0.00 66.02 62.35 2dar s SER 85 CO -0.07 -0.69 0.86 0.61 1.20 0.00 0.00 173.24 175.14 2dar n GLY 86 N 3.89 4.50 3.77 9.45 0.00 -1.26 -5.06 105.19 120.48 2dar n GLY 86 Ca 0.08 -2.66 -0.34 0.00 0.00 0.00 0.00 46.02 43.09 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 -1.97 3.16 -0.98 1.61 0.04 -1.26 -4.97 135.00 130.64 2dar s PRO 87 Ca 0.32 1.53 -0.17 0.00 0.04 0.00 0.00 61.00 62.71 2dar s PRO 87 Cb 0.02 -1.99 0.15 0.00 0.04 0.00 0.00 34.50 32.72 2dar s PRO 87 CO -0.06 -0.98 1.16 -1.54 0.04 0.00 0.00 177.00 175.62 2dar s SER 88 N -2.07 6.73 -0.24 6.66 1.04 -1.26 -5.00 113.70 119.57 2dar s SER 88 Ca 0.71 -2.30 -0.08 0.00 0.48 0.00 0.00 55.95 54.76 2dar s SER 88 Cb -0.23 -2.38 -0.04 0.00 0.10 0.00 0.00 66.02 63.47 2dar s SER 88 CO 0.32 -0.96 0.10 -0.44 0.98 0.00 0.00 173.24 173.24 2dar s SER 89 N 3.34 5.47 0.00 7.02 0.01 -1.26 -5.37 113.70 122.90 2dar s SER 89 Ca 0.33 -0.09 0.06 0.00 1.31 0.00 0.00 55.95 57.57 2dar s SER 89 Cb -0.05 -1.98 0.36 0.00 0.21 0.00 0.00 66.02 64.56 2dar s SER 89 CO -0.08 0.01 0.83 0.61 0.41 0.00 0.00 173.24 175.02