#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 5.59 0.37 1.61 0.01 -1.26 -5.13 113.70 114.89 2dar s SER 2 Ca 0.00 -0.36 0.08 0.00 1.31 0.00 0.00 55.95 56.98 2dar s SER 2 Cb 0.00 -1.09 -0.03 0.00 0.21 0.00 0.00 66.02 65.11 2dar s SER 2 CO 0.00 -0.39 0.28 -0.94 0.41 0.00 0.00 173.24 172.60 2dar s SER 3 N -4.07 4.98 -0.84 2.44 1.04 -1.26 -5.06 113.70 110.93 2dar s SER 3 Ca 0.43 -0.71 -0.23 0.00 0.48 0.00 0.00 55.95 55.93 2dar s SER 3 Cb -0.07 -0.73 0.07 0.00 0.10 0.00 0.00 66.02 65.39 2dar s SER 3 CO 0.29 -0.47 1.20 -0.83 0.98 0.00 0.00 173.24 174.41 2dar s GLY 4 N -4.00 1.38 -0.56 7.32 0.00 -1.26 -4.97 107.32 105.23 2dar s GLY 4 Ca 0.43 -2.08 -0.18 0.00 0.00 0.00 0.00 44.72 42.88 2dar s GLY 4 CO 0.26 2.34 0.63 -0.45 0.00 0.00 0.00 173.10 175.88 2dar s SER 5 N 4.02 6.19 0.11 1.64 0.15 -1.26 -5.02 113.70 119.53 2dar s SER 5 Ca 0.34 -1.39 -0.07 0.00 0.70 0.00 0.00 55.95 55.53 2dar s SER 5 Cb -0.08 -2.28 -0.01 0.00 -1.71 0.00 0.00 66.02 61.94 2dar s SER 5 CO 0.01 -1.00 0.17 -0.55 1.20 0.00 0.00 173.24 173.07 2dar s SER 6 N 3.38 0.18 0.00 5.45 0.15 -1.26 -5.18 113.70 116.42 2dar s SER 6 Ca 0.10 -0.84 0.00 0.00 0.70 0.00 0.00 55.95 55.91 2dar s SER 6 Cb -0.24 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.41 2dar s SER 6 CO 0.07 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 174.36 2dar n GLY 7 N -0.08 2.05 0.37 9.45 0.00 -1.26 -4.96 105.19 110.77 2dar n GLY 7 Ca -0.11 -2.10 0.20 0.00 0.00 0.00 0.00 46.02 44.00 2dar n GLY 7 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2dar h ASP 8 N 0.00 0.00 -5.23 1.61 3.04 -2.05 -3.42 116.42 110.37 2dar h ASP 8 Ca 0.00 0.00 -0.11 0.00 -3.24 0.00 0.00 57.03 53.68 2dar h ASP 8 Cb 0.00 0.00 -0.15 0.00 -1.04 0.00 0.00 39.33 38.14 2dar h ASP 8 CO 0.00 0.00 -0.58 -1.10 -2.04 0.00 0.00 179.24 175.52 2dar s GLN 9 N -4.73 0.71 -0.13 4.15 -1.52 -1.26 -5.15 119.66 111.72 2dar s GLN 9 Ca -0.05 -1.16 0.00 0.00 -1.95 0.00 0.00 55.36 52.21 2dar s GLN 9 Cb 0.17 0.25 0.02 0.00 -0.22 0.00 0.00 33.01 33.23 2dar s GLN 9 CO 0.60 -0.17 -0.12 0.16 -0.25 0.00 0.00 175.29 175.51 2dar s ASP 10 N -2.91 2.43 0.34 5.90 1.47 -1.26 -5.05 116.67 117.59 2dar s ASP 10 Ca 0.08 -0.41 -0.13 0.00 1.18 0.00 0.00 52.55 53.27 2dar s ASP 10 Cb 0.07 -1.04 -0.08 0.00 -0.34 0.00 0.00 42.92 41.53 2dar s ASP 10 CO -0.09 -0.06 0.73 -0.89 0.68 0.00 0.00 175.17 175.54 2dar s THR 11 N 1.41 4.75 0.11 2.11 2.01 -1.26 -5.00 115.64 119.77 2dar s THR 11 Ca 0.02 0.77 -0.07 0.00 0.31 0.00 0.00 61.69 62.71 2dar s THR 11 Cb -0.13 -3.66 -0.21 0.00 0.01 0.00 0.00 72.50 68.51 2dar s THR 11 CO -0.07 -0.30 1.26 -0.07 -0.69 0.00 0.00 174.62 174.74 2dar h LEU 12 N 1.90 0.64 -5.94 4.42 3.38 -2.00 -3.45 115.31 114.26 2dar h LEU 12 Ca -0.47 -0.53 -0.58 0.00 0.09 0.00 0.00 57.88 56.39 2dar h LEU 12 Cb 1.18 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 2dar h LEU 12 CO 0.65 1.33 0.66 0.52 0.09 0.00 0.00 178.44 181.69 2dar n VAL 13 N -3.76 0.00 -3.78 1.22 0.31 -1.25 -4.77 118.33 106.29 2dar n VAL 13 Ca -0.08 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 64.00 2dar n VAL 13 Cb 0.87 -0.35 0.01 0.00 -0.91 0.00 0.00 33.84 33.46 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 3.76 0.68 -3.46 5.55 6.02 0.62 -4.81 117.38 125.74 2dar n GLN 14 Ca 0.28 -3.35 -0.16 0.00 -0.01 0.00 0.00 57.00 53.76 2dar n GLN 14 Cb -0.04 0.29 -0.12 0.00 1.02 0.00 0.00 30.24 31.40 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 -4.27 0.23 0.10 -1.09 0.52 -1.26 -2.79 118.95 110.38 2dar s ARG 15 Ca 0.34 0.28 -0.31 0.00 -0.52 0.00 0.00 55.73 55.52 2dar s ARG 15 Cb -0.03 -1.04 -0.09 0.00 0.52 0.00 0.00 34.95 34.32 2dar s ARG 15 CO 0.22 -0.65 1.61 0.00 0.02 0.00 0.00 175.30 176.50 2dar s ALA 16 N 2.38 3.71 -0.09 2.13 0.00 -1.26 -4.93 121.76 123.69 2dar s ALA 16 Ca 0.08 1.25 -0.30 0.00 0.00 0.00 0.00 51.96 52.99 2dar s ALA 16 Cb -0.16 -3.66 -0.04 0.00 0.00 0.00 0.00 23.12 19.26 2dar s ALA 16 CO -0.13 -0.98 1.49 -2.00 0.00 0.00 0.00 175.76 174.14 2dar s GLU 17 N 2.12 4.21 -0.04 0.00 2.56 -0.95 -4.79 118.70 121.81 2dar s GLU 17 Ca 0.72 1.97 -0.30 0.00 0.00 0.00 0.00 54.97 57.37 2dar s GLU 17 Cb -0.41 -3.87 -0.04 0.00 2.00 0.00 0.00 34.13 31.81 2dar s GLU 17 CO 0.32 -0.77 1.28 -1.01 -0.56 0.00 0.00 175.26 174.51 2dar s HIS 18 N 3.71 3.04 -0.20 5.30 3.76 -1.26 -2.66 115.29 126.97 2dar s HIS 18 Ca 0.66 1.05 -0.04 0.00 -0.15 0.00 0.00 55.06 56.58 2dar s HIS 18 Cb -0.29 -3.51 -0.01 0.00 1.11 0.00 0.00 32.58 29.87 2dar s HIS 18 CO 0.24 -1.75 -0.04 0.42 -0.85 0.00 0.00 174.74 172.75 2dar s ILE 19 N 2.38 3.52 0.97 0.60 -1.09 -0.84 -5.03 121.20 121.71 2dar s ILE 19 Ca 0.59 -0.46 -0.12 0.00 -2.23 0.00 0.00 60.65 58.43 2dar s ILE 19 Cb -0.27 -2.58 0.17 0.00 -1.58 0.00 0.00 42.46 38.20 2dar s ILE 19 CO 0.23 0.44 1.09 -2.16 -1.23 0.00 0.00 174.94 173.32 2dar s PRO 20 N 1.12 0.68 0.71 2.79 0.04 -1.26 -2.46 135.00 136.62 2dar s PRO 20 Ca 0.02 0.61 -0.11 0.00 0.04 0.00 0.00 61.00 61.56 2dar s PRO 20 Cb -0.15 -1.76 0.02 0.00 0.04 0.00 0.00 34.50 32.65 2dar s PRO 20 CO -0.00 -2.59 1.07 0.00 0.04 0.00 0.00 177.00 175.52 2dar s ALA 21 N -2.96 2.63 -1.51 8.56 0.00 -1.26 -3.82 121.76 123.41 2dar s ALA 21 Ca 0.65 -0.00 0.00 0.00 0.00 0.00 0.00 51.96 52.60 2dar s ALA 21 Cb -0.18 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 19.79 2dar s ALA 21 CO 0.57 -1.29 0.00 0.41 0.00 0.00 0.00 175.76 175.46 2dar n GLY 22 N -2.10 -0.13 1.41 0.00 0.00 -1.26 -4.84 105.19 98.27 2dar n GLY 22 Ca 0.07 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.64 0.00 -3.86 1.61 0.00 -1.25 -5.11 118.16 106.91 2dar n LYS 23 Ca -0.20 0.00 -0.12 0.00 0.00 0.00 0.00 58.31 57.99 2dar n LYS 23 Cb 0.65 -0.31 -0.14 0.00 0.00 0.00 0.00 35.03 35.23 2dar n LYS 23 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2dar s ARG 24 N -2.00 0.03 -0.45 1.64 0.52 -1.26 -5.08 118.95 112.35 2dar s ARG 24 Ca 0.00 0.02 0.09 0.00 -0.52 0.00 0.00 55.73 55.33 2dar s ARG 24 Cb 0.00 0.01 0.33 0.00 0.52 0.00 0.00 34.95 35.81 2dar s ARG 24 CO 0.00 -0.00 0.77 0.25 0.02 0.00 0.00 175.30 176.34 2dar n THR 25 N 3.05 0.88 -1.17 0.02 -2.24 -1.26 -4.85 114.28 108.71 2dar n THR 25 Ca -0.12 -4.86 -0.29 0.00 -2.27 0.00 0.00 64.05 56.51 2dar n THR 25 Cb 0.60 -0.90 0.17 0.00 -2.10 0.00 0.00 70.33 68.10 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 -2.60 0.60 -0.32 -0.78 0.04 -1.26 -4.29 135.00 126.39 2dar s PRO 26 Ca 0.42 0.58 -0.20 0.00 0.04 0.00 0.00 61.00 61.85 2dar s PRO 26 Cb 0.30 -1.75 -0.01 0.00 0.04 0.00 0.00 34.50 33.08 2dar s PRO 26 CO -0.10 -2.63 0.61 1.41 0.04 0.00 0.00 177.00 176.33 2dar s MET 27 N -4.96 3.83 1.05 4.56 1.75 -1.26 -1.77 119.30 122.51 2dar s MET 27 Ca 0.65 0.19 -0.23 0.00 -1.25 0.00 0.00 55.69 55.05 2dar s MET 27 Cb -0.18 -3.75 -0.06 0.00 2.84 0.00 0.00 34.83 33.68 2dar s MET 27 CO 0.57 -0.59 -0.80 0.00 -0.65 0.00 0.00 175.02 173.55 2dar n ALA 29 N -3.88 1.72 0.15 0.00 0.00 -1.14 -3.69 120.51 113.67 2dar n ALA 29 Ca -0.01 -0.66 -0.07 0.00 0.00 0.00 0.00 53.44 52.71 2dar n ALA 29 Cb 0.69 0.17 -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 -0.10 -0.40 0.00 0.00 -0.00 -1.93 -3.36 115.15 109.35 2dar h HIS 30 Ca -0.36 -0.01 -0.22 0.00 -0.00 0.00 0.00 60.37 59.78 2dar h HIS 30 Cb 1.50 0.13 -0.03 0.00 -0.00 0.00 0.00 27.41 29.01 2dar h HIS 30 CO 0.01 -0.25 -1.15 0.00 -0.00 0.00 0.00 177.93 176.53 2dar n ASN 32 N -3.26 -3.63 -4.24 0.00 5.15 -1.24 -5.01 115.26 103.03 2dar n ASN 32 Ca -0.04 -0.29 -0.31 0.00 -0.60 0.00 0.00 54.58 53.33 2dar n ASN 32 Cb 0.95 -2.88 -0.17 0.00 -0.53 0.00 0.00 39.78 37.16 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 -5.40 2.68 -0.05 1.20 -0.21 -1.26 -4.72 119.66 111.90 2dar s GLN 33 Ca 0.22 -0.87 -0.37 0.00 0.02 0.00 0.00 55.36 54.35 2dar s GLN 33 Cb -0.10 -2.17 -0.15 0.00 1.00 0.00 0.00 33.01 31.59 2dar s GLN 33 CO 0.38 0.29 1.60 1.55 -2.12 0.00 0.00 175.29 177.00 2dar n VAL 34 N 3.18 0.20 -3.12 1.09 3.14 -1.26 -2.82 118.33 118.74 2dar n VAL 34 Ca -0.18 -0.04 -0.40 0.00 -2.96 0.00 0.00 64.34 60.76 2dar n VAL 34 Cb 0.52 -1.24 -0.06 0.00 -1.06 0.00 0.00 33.84 32.01 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 2.17 5.03 -0.19 1.55 1.01 -0.73 -4.94 121.20 125.10 2dar s ILE 35 Ca 0.90 1.20 -0.16 0.00 0.00 0.00 0.00 60.65 62.59 2dar s ILE 35 Cb -0.91 -3.95 -0.11 0.00 0.01 0.00 0.00 42.46 37.51 2dar s ILE 35 CO 0.53 0.14 -0.05 0.54 0.00 0.00 0.00 174.94 176.10 2dar n ARG 36 N 4.82 0.52 0.00 2.79 1.74 -1.26 -4.16 116.66 121.11 2dar n ARG 36 Ca -0.02 0.49 0.00 0.00 -0.77 0.00 0.00 57.85 57.56 2dar n ARG 36 Cb 0.50 -1.67 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 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 1.49 -0.65 3.75 -0.13 0.00 -1.26 -4.32 105.19 104.07 2dar n GLY 37 Ca -0.23 -1.56 -0.41 0.00 0.00 0.00 0.00 46.02 43.82 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 4.42 0.47 1.61 0.04 -1.26 -4.66 135.00 135.62 2dar s PRO 38 Ca 0.00 2.05 0.03 0.00 0.04 0.00 0.00 61.00 63.11 2dar s PRO 38 Cb 0.00 -3.17 -0.01 0.00 0.04 0.00 0.00 34.50 31.36 2dar s PRO 38 CO 0.00 -0.16 0.09 -0.59 0.04 0.00 0.00 177.00 176.37 2dar s PHE 39 N -0.37 1.77 -0.17 0.56 -0.12 -1.03 -4.60 117.98 114.03 2dar s PHE 39 Ca 0.53 -1.21 0.01 0.00 -0.05 0.00 0.00 56.93 56.21 2dar s PHE 39 Cb -0.36 -1.32 0.02 0.00 -0.63 0.00 0.00 43.02 40.72 2dar s PHE 39 CO 0.42 -0.13 -0.18 -0.51 -0.05 0.00 0.00 175.22 174.76 2dar s LEU 40 N -3.74 2.00 -0.33 -1.99 1.43 -0.54 -1.98 118.68 113.52 2dar s LEU 40 Ca 0.13 -0.60 -0.15 0.00 -1.03 0.00 0.00 54.13 52.49 2dar s LEU 40 Cb 0.01 -1.38 -0.02 0.00 0.03 0.00 0.00 46.19 44.83 2dar s LEU 40 CO 0.09 -0.01 0.35 0.54 0.23 0.00 0.00 176.35 177.55 2dar s VAL 41 N 1.29 5.18 0.05 -1.59 0.11 -1.09 -0.06 120.40 124.30 2dar s VAL 41 Ca 0.03 0.08 -0.16 0.00 -2.93 0.00 0.00 61.98 59.01 2dar s VAL 41 Cb -0.13 -3.79 0.03 0.00 -1.53 0.00 0.00 36.38 30.95 2dar s VAL 41 CO -0.11 -0.05 0.36 0.00 -3.33 0.00 0.00 175.10 171.97 2dar s ALA 42 N 1.99 -0.85 -1.60 1.54 0.00 0.12 -2.23 121.76 120.73 2dar s ALA 42 Ca 0.11 0.12 -0.16 0.00 0.00 0.00 0.00 51.96 52.04 2dar s ALA 42 Cb -0.16 0.38 0.11 0.00 0.00 0.00 0.00 23.12 23.45 2dar s ALA 42 CO 0.11 -0.46 0.92 1.28 0.00 0.00 0.00 175.76 177.61 2dar n LEU 43 N 0.43 -2.24 -3.51 0.00 7.99 -1.26 -0.70 117.00 117.71 2dar n LEU 43 Ca -0.18 -0.86 -0.25 0.00 -0.01 0.00 0.00 56.01 54.71 2dar n LEU 43 Cb 0.60 -2.39 0.05 0.00 -0.11 0.00 0.00 43.42 41.58 2dar n LEU 43 CO 0.20 0.41 0.15 0.61 -1.51 0.00 0.00 177.39 177.25 2dar n GLY 44 N -1.59 -0.53 3.60 -0.72 0.00 -1.26 -4.97 105.19 99.73 2dar n GLY 44 Ca 0.06 0.21 -0.10 0.00 0.00 0.00 0.00 46.02 46.19 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 -6.22 1.45 -0.11 1.61 1.02 0.12 -5.16 119.74 112.45 2dar s LYS 45 Ca 0.53 -0.67 -0.03 0.00 0.02 0.00 0.00 55.97 55.82 2dar s LYS 45 Cb -0.24 0.58 -0.03 0.00 -0.52 0.00 0.00 37.83 37.62 2dar s LYS 45 CO 0.65 -0.65 -0.01 -1.54 -0.92 0.00 0.00 175.35 172.89 2dar s SER 46 N -2.81 5.13 0.25 2.83 1.04 -1.26 0.11 113.70 118.98 2dar s SER 46 Ca 0.05 0.06 0.04 0.00 0.48 0.00 0.00 55.95 56.59 2dar s SER 46 Cb -0.03 -1.57 -0.05 0.00 0.10 0.00 0.00 66.02 64.46 2dar s SER 46 CO -0.05 0.31 -0.02 0.26 0.98 0.00 0.00 173.24 174.72 2dar s TRP 47 N -0.46 1.69 0.10 5.02 0.52 0.92 -2.86 118.94 123.86 2dar s TRP 47 Ca 0.08 -0.86 -0.20 0.00 0.02 0.00 0.00 56.10 55.14 2dar s TRP 47 Cb -0.12 -0.98 -0.07 0.00 -1.15 0.00 0.00 33.47 31.15 2dar s TRP 47 CO 0.02 0.06 0.61 -1.01 0.02 0.00 0.00 176.95 176.64 2dar s HIS 48 N -3.29 3.81 -1.63 -1.98 3.76 -1.26 -1.47 115.29 113.23 2dar s HIS 48 Ca 0.29 1.33 0.15 0.00 -0.15 0.00 0.00 55.06 56.68 2dar s HIS 48 Cb 0.05 -2.54 0.82 0.00 1.11 0.00 0.00 32.58 32.02 2dar s HIS 48 CO 0.10 0.56 1.39 -0.35 -0.85 0.00 0.00 174.74 175.59 2dar n PRO 49 N 1.63 0.31 -0.07 8.40 -0.04 -1.26 -0.83 135.00 143.13 2dar n PRO 49 Ca -0.09 0.09 -0.09 0.00 -0.04 0.00 0.00 63.50 63.37 2dar n PRO 49 Cb 0.50 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.37 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 -1.19 1.19 0.03 0.54 0.28 -1.26 -4.66 120.64 115.58 2dar n GLU 50 Ca 0.09 0.04 -0.22 0.00 -0.16 0.00 0.00 57.16 56.91 2dar n GLU 50 Cb 0.10 -1.34 -0.14 0.00 1.43 0.00 0.00 31.44 31.48 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 0.00 0.29 -5.15 3.44 4.11 -1.92 -3.44 114.58 111.91 2dar h GLU 51 Ca -0.37 -0.50 -0.31 0.00 0.07 0.00 0.00 59.36 58.25 2dar h GLU 51 Cb 1.71 0.19 -0.07 0.00 0.50 0.00 0.00 28.75 31.08 2dar h GLU 51 CO -0.02 1.24 1.44 0.34 0.07 0.00 0.00 179.01 182.09 2dar n PHE 52 N -3.89 0.55 -4.59 2.06 7.35 -0.01 -4.86 117.46 114.07 2dar n PHE 52 Ca -0.23 0.08 -0.22 0.00 -0.76 0.00 0.00 57.45 56.33 2dar n PHE 52 Cb 0.93 -1.63 -0.15 0.00 0.35 0.00 0.00 39.48 38.98 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 5.80 1.65 1.02 -2.13 2.20 -1.26 -3.28 114.94 118.95 2dar s ASN 53 Ca 1.20 -0.29 -0.20 0.00 -0.94 0.00 0.00 52.86 52.62 2dar s ASN 53 Cb -0.68 -0.17 -0.07 0.00 -2.00 0.00 0.00 41.25 38.33 2dar s ASN 53 CO 0.40 0.15 -0.65 0.00 -2.94 0.00 0.00 177.10 174.05 2dar n ALA 55 N -3.49 2.99 -0.01 0.00 0.00 0.11 -3.21 120.51 116.90 2dar n ALA 55 Ca 0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 53.44 53.08 2dar n ALA 55 Cb 0.64 -1.02 -0.01 0.00 0.00 0.00 0.00 19.45 19.06 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 -2.24 0.00 0.39 0.00 -0.00 -1.26 -4.69 115.22 107.42 2dar n HIS 56 Ca 0.01 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.86 2dar n HIS 56 Cb 0.49 -0.12 0.43 0.00 -0.00 0.00 0.00 29.99 30.78 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 -2.66 -5.00 -4.40 0.00 4.76 -1.20 -4.90 118.16 104.76 2dar n LYS 58 Ca 0.03 0.69 -0.24 0.00 -2.87 0.00 0.00 58.31 55.92 2dar n LYS 58 Cb 0.38 -5.35 -0.11 0.00 -1.84 0.00 0.00 35.03 28.11 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 -4.26 3.16 0.13 4.39 0.01 -1.26 -4.57 114.94 112.54 2dar s ASN 59 Ca 0.05 -0.92 -0.31 0.00 -0.71 0.00 0.00 52.86 50.97 2dar s ASN 59 Cb -0.01 -0.22 -0.10 0.00 0.41 0.00 0.00 41.25 41.32 2dar s ASN 59 CO 0.79 0.02 1.79 0.28 -1.51 0.00 0.00 177.10 178.47 2dar s THR 60 N -2.13 2.53 -0.64 1.60 -1.32 -1.26 -0.08 115.64 114.35 2dar s THR 60 Ca 0.22 0.11 0.01 0.00 -1.21 0.00 0.00 61.69 60.81 2dar s THR 60 Cb -0.06 -3.07 0.41 0.00 -1.51 0.00 0.00 72.50 68.27 2dar s THR 60 CO 0.10 0.00 1.73 0.23 -2.21 0.00 0.00 174.62 174.47 2dar n MET 61 N 5.41 3.00 -0.07 7.08 0.00 -1.20 -4.67 117.12 126.66 2dar n MET 61 Ca 0.17 -3.75 -0.11 0.00 0.00 0.00 0.00 57.70 54.01 2dar n MET 61 Cb 0.38 -2.27 -0.09 0.00 0.00 0.00 0.00 33.22 31.24 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 2.53 0.04 -0.93 3.04 0.00 -1.90 -3.37 119.26 118.67 2dar h ALA 62 Ca 0.50 -0.50 -0.67 0.00 0.00 0.00 0.00 54.91 54.24 2dar h ALA 62 Cb 0.63 0.16 -0.26 0.00 0.00 0.00 0.00 17.79 18.31 2dar h ALA 62 CO 1.27 0.15 0.87 0.66 0.00 0.00 0.00 179.25 182.20 2dar n TYR 63 N -4.62 2.93 -3.77 0.00 4.02 -1.26 -4.84 117.16 109.61 2dar n TYR 63 Ca -0.11 -2.67 -0.08 0.00 -0.01 0.00 0.00 57.90 55.03 2dar n TYR 63 Cb 0.39 -1.33 0.03 0.00 -0.02 0.00 0.00 39.34 38.40 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 -0.60 0.00 -2.71 -0.72 -5.35 -1.26 -5.18 119.36 103.54 2dar n ILE 64 Ca 0.57 -0.92 -0.18 0.00 -0.27 0.00 0.00 62.75 61.94 2dar n ILE 64 Cb 0.51 0.94 0.08 0.00 -1.74 0.00 0.00 39.64 39.44 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 -0.53 1.09 3.53 3.28 0.00 -1.26 -4.70 105.19 106.60 2dar n GLY 65 Ca -0.08 -2.08 -0.09 0.00 0.00 0.00 0.00 46.02 43.77 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 -2.35 -0.35 -0.05 1.61 -0.12 -1.12 -3.33 117.98 112.27 2dar s PHE 66 Ca 0.54 0.34 0.01 0.00 -0.05 0.00 0.00 56.93 57.77 2dar s PHE 66 Cb -0.03 0.51 0.02 0.00 -0.63 0.00 0.00 43.02 42.88 2dar s PHE 66 CO 0.35 -0.46 -0.06 0.08 -0.05 0.00 0.00 175.22 175.08 2dar s VAL 67 N -2.45 0.64 -0.00 -2.49 1.01 0.14 -0.28 120.40 116.97 2dar s VAL 67 Ca 0.03 -0.18 -0.22 0.00 0.00 0.00 0.00 61.98 61.61 2dar s VAL 67 Cb -0.01 -0.65 -0.05 0.00 0.00 0.00 0.00 36.38 35.67 2dar s VAL 67 CO -0.05 0.25 0.65 -0.70 0.00 0.00 0.00 175.10 175.25 2dar s GLU 68 N 0.94 4.38 -0.27 2.72 2.12 -1.26 -0.52 118.70 126.81 2dar s GLU 68 Ca -0.11 0.83 -0.16 0.00 0.36 0.00 0.00 54.97 55.90 2dar s GLU 68 Cb -0.14 -3.37 0.08 0.00 0.26 0.00 0.00 34.13 30.96 2dar s GLU 68 CO 0.00 0.30 0.67 -2.00 -0.54 0.00 0.00 175.26 173.69 2dar s GLU 69 N 0.01 0.69 -1.61 4.30 2.12 0.43 -4.92 118.70 119.72 2dar s GLU 69 Ca 0.34 1.21 -0.12 0.00 0.36 0.00 0.00 54.97 56.76 2dar s GLU 69 Cb -0.19 0.14 0.12 0.00 0.26 0.00 0.00 34.13 34.46 2dar s GLU 69 CO 0.19 -0.15 0.29 1.63 -0.54 0.00 0.00 175.26 176.68 2dar n LYS 70 N 4.33 -0.83 -2.88 4.30 4.76 -1.26 -0.12 118.16 126.46 2dar n LYS 70 Ca -0.20 0.11 -0.11 0.00 -2.87 0.00 0.00 58.31 55.24 2dar n LYS 70 Cb 0.59 -3.89 0.06 0.00 -1.84 0.00 0.00 35.03 29.94 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 -1.71 -0.19 3.64 0.72 0.00 -1.26 -5.05 105.19 101.34 2dar n GLY 71 Ca -0.09 0.01 -0.08 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.88 -0.28 4.61 0.00 0.83 -5.11 121.76 116.68 2dar s ALA 72 Ca 0.08 2.36 -0.10 0.00 0.00 0.00 0.00 51.96 54.30 2dar s ALA 72 Cb -0.01 -1.40 -0.03 0.00 0.00 0.00 0.00 23.12 21.67 2dar s ALA 72 CO 0.49 -0.37 0.16 -0.51 0.00 0.00 0.00 175.76 175.53 2dar s LEU 73 N 1.44 3.94 -0.18 0.00 1.43 -1.25 -0.43 118.68 123.63 2dar s LEU 73 Ca -0.08 -0.19 -0.03 0.00 -1.03 0.00 0.00 54.13 52.80 2dar s LEU 73 Cb -0.05 -2.05 -0.02 0.00 0.03 0.00 0.00 46.19 44.10 2dar s LEU 73 CO -0.17 -0.09 -0.06 -0.31 0.23 0.00 0.00 176.35 175.96 2dar s TYR 74 N 1.70 2.95 0.35 0.29 2.02 0.32 -0.72 117.35 124.25 2dar s TYR 74 Ca 0.06 -0.64 -0.28 0.00 -0.37 0.00 0.00 57.07 55.84 2dar s TYR 74 Cb -0.16 -2.01 -0.10 0.00 -0.40 0.00 0.00 41.96 39.29 2dar s TYR 74 CO 0.08 -0.30 1.32 0.00 -1.57 0.00 0.00 175.55 175.08 2dar n GLU 76 N 0.68 -0.03 0.23 0.00 0.28 -1.21 0.14 120.64 120.73 2dar n GLU 76 Ca 0.01 0.92 -0.15 0.00 -0.16 0.00 0.00 57.16 57.78 2dar n GLU 76 Cb 0.42 -1.82 -0.08 0.00 1.43 0.00 0.00 31.44 31.38 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 -0.47 -0.74 -1.84 3.38 -1.89 0.28 115.31 114.03 2dar h LEU 77 Ca 0.65 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.57 2dar h LEU 77 Cb 2.10 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 42.94 2dar h LEU 77 CO -0.34 -0.27 0.39 0.00 0.09 0.00 0.00 178.44 178.31 2dar h TYR 79 N 1.03 -0.43 -0.59 0.00 5.03 -1.14 -1.28 116.97 119.58 2dar h TYR 79 Ca 0.26 -0.01 0.17 0.00 2.58 0.00 0.00 58.73 61.73 2dar h TYR 79 Cb 0.06 0.14 -0.02 0.00 1.55 0.00 0.00 36.73 38.46 2dar h TYR 79 CO 0.00 -0.27 0.73 1.49 -1.32 0.00 0.00 178.16 178.79 2dar h GLU 80 N -0.48 0.00 0.31 1.82 4.57 -0.97 0.95 114.58 120.77 2dar h GLU 80 Ca -0.05 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.12 2dar h GLU 80 Cb 0.35 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 -0.15 0.87 -1.18 0.00 0.00 179.01 178.63 2dar h LYS 81 N 0.00 -0.40 0.00 1.92 1.57 -1.01 -3.32 116.57 115.33 2dar h LYS 81 Ca 0.28 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 2dar h LYS 81 Cb 1.73 0.09 0.00 0.00 0.08 0.00 0.00 32.23 34.13 2dar h LYS 81 CO -0.00 -0.27 -0.86 1.19 -0.57 0.00 0.00 179.45 178.94 2dar n PHE 82 N -4.92 0.23 -0.42 -1.35 3.72 -0.42 -4.43 117.46 109.88 2dar n PHE 82 Ca -0.05 0.10 0.34 0.00 -0.05 0.00 0.00 57.45 57.79 2dar n PHE 82 Cb 0.16 -0.56 0.64 0.00 -0.94 0.00 0.00 39.48 38.79 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 -0.98 0.42 -3.51 1.38 -1.00 0.66 -2.98 116.94 110.92 2dar h PHE 83 Ca 0.00 0.02 -0.72 0.00 2.81 0.00 0.00 57.97 60.08 2dar h PHE 83 Cb 0.86 -0.11 -0.33 0.00 3.61 0.00 0.00 35.95 39.98 2dar h PHE 83 CO -0.37 -0.08 -0.14 0.00 -1.61 0.00 0.00 178.31 176.11 2dar s ALA 84 N -5.25 3.98 -0.09 2.45 0.00 0.21 -4.94 121.76 118.12 2dar s ALA 84 Ca -0.07 -3.53 -0.30 0.00 0.00 0.00 0.00 51.96 48.06 2dar s ALA 84 Cb 0.27 -2.91 -0.03 0.00 0.00 0.00 0.00 23.12 20.45 2dar s ALA 84 CO 0.82 -2.16 1.30 -1.12 0.00 0.00 0.00 175.76 174.60 2dar s SER 85 N 0.64 6.94 0.00 0.00 0.01 -1.13 -4.50 113.70 115.65 2dar s SER 85 Ca 0.22 1.86 0.00 0.00 1.31 0.00 0.00 55.95 59.34 2dar s SER 85 Cb -0.13 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.55 2dar s SER 85 CO -0.08 -0.71 0.00 0.61 0.41 0.00 0.00 173.24 173.47 2dar n GLY 86 N 3.59 -0.70 0.00 3.44 0.00 -1.26 -4.96 105.19 105.30 2dar n GLY 86 Ca 0.13 -0.45 0.07 0.00 0.00 0.00 0.00 46.02 45.78 2dar n GLY 86 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dar n PRO 87 N 0.00 0.49 -1.37 1.61 -0.04 -1.26 -4.81 135.00 129.62 2dar n PRO 87 Ca 0.00 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 2dar n PRO 87 Cb 0.00 -1.47 0.08 0.00 -0.04 0.00 0.00 33.50 32.07 2dar n PRO 87 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2dar s SER 88 N -1.97 4.54 0.22 3.54 0.01 -1.26 -4.97 113.70 113.80 2dar s SER 88 Ca 0.22 1.93 -0.30 0.00 1.31 0.00 0.00 55.95 59.12 2dar s SER 88 Cb 0.10 -2.54 -0.09 0.00 0.21 0.00 0.00 66.02 63.71 2dar s SER 88 CO 0.17 -2.01 1.27 -0.44 0.41 0.00 0.00 173.24 172.64 2dar s SER 89 N -3.03 6.95 0.00 2.44 0.01 -1.26 -5.05 113.70 113.76 2dar s SER 89 Ca 0.64 2.39 0.00 0.00 1.31 0.00 0.00 55.95 60.29 2dar s SER 89 Cb -0.19 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.42 2dar s SER 89 CO 0.51 -0.46 0.00 0.61 0.41 0.00 0.00 173.24 174.31