#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 3.51 0.05 1.61 0.01 -1.26 -5.13 113.70 112.48 2dar s SER 2 Ca 0.00 -0.37 0.08 0.00 1.31 0.00 0.00 55.95 56.97 2dar s SER 2 Cb 0.00 -0.56 -0.03 0.00 0.21 0.00 0.00 66.02 65.64 2dar s SER 2 CO 0.00 0.32 -0.21 -0.44 0.41 0.00 0.00 173.24 173.32 2dar s SER 3 N -0.77 2.57 0.00 2.44 0.01 -1.26 -5.10 113.70 111.59 2dar s SER 3 Ca 0.11 -0.55 0.00 0.00 1.31 0.00 0.00 55.95 56.82 2dar s SER 3 Cb -0.10 -0.21 0.00 0.00 0.21 0.00 0.00 66.02 65.92 2dar s SER 3 CO 0.00 0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.43 2dar n GLY 4 N 1.76 4.56 3.45 3.44 0.00 -1.26 -5.15 105.19 111.99 2dar n GLY 4 Ca -0.17 -1.21 -0.27 0.00 0.00 0.00 0.00 46.02 44.36 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 3.60 0.20 1.61 0.01 -1.26 -5.15 113.70 112.71 2dar s SER 5 Ca 0.00 -0.77 0.08 0.00 1.31 0.00 0.00 55.95 56.57 2dar s SER 5 Cb 0.00 -0.35 -0.04 0.00 0.21 0.00 0.00 66.02 65.83 2dar s SER 5 CO 0.00 0.13 -0.02 -0.44 0.41 0.00 0.00 173.24 173.32 2dar s SER 6 N -2.54 4.59 -0.54 2.44 0.01 -1.26 -5.10 113.70 111.30 2dar s SER 6 Ca 0.20 -0.51 -0.08 0.00 1.31 0.00 0.00 55.95 56.87 2dar s SER 6 Cb -0.09 -0.90 0.14 0.00 0.21 0.00 0.00 66.02 65.38 2dar s SER 6 CO 0.10 0.07 0.40 -0.83 0.41 0.00 0.00 173.24 173.39 2dar s GLY 7 N -3.11 2.19 -0.20 3.44 0.00 -1.26 -5.03 107.32 103.36 2dar s GLY 7 Ca 0.28 -2.76 -0.02 0.00 0.00 0.00 0.00 44.72 42.21 2dar s GLY 7 CO 0.18 1.12 0.01 0.99 0.00 0.00 0.00 173.10 175.41 2dar s ASP 8 N 2.19 3.08 0.11 1.64 1.01 -1.26 -5.11 116.67 118.33 2dar s ASP 8 Ca 0.09 -0.88 -0.31 0.00 0.71 0.00 0.00 52.55 52.17 2dar s ASP 8 Cb -0.23 -0.72 -0.09 0.00 1.01 0.00 0.00 42.92 42.89 2dar s ASP 8 CO -0.02 -0.29 1.62 -1.10 0.21 0.00 0.00 175.17 175.59 2dar s GLN 9 N 1.76 4.21 -0.15 8.23 -0.21 -1.26 -5.00 119.66 127.23 2dar s GLN 9 Ca -0.02 2.34 -0.10 0.00 0.02 0.00 0.00 55.36 57.60 2dar s GLN 9 Cb -0.17 -3.42 0.05 0.00 1.00 0.00 0.00 33.01 30.47 2dar s GLN 9 CO -0.07 -0.68 0.38 0.16 -2.12 0.00 0.00 175.29 172.96 2dar s ASP 10 N 1.89 -0.45 0.45 5.90 -4.77 -1.26 -5.15 116.67 113.28 2dar s ASP 10 Ca 0.72 0.81 -0.25 0.00 -3.30 0.00 0.00 52.55 50.54 2dar s ASP 10 Cb -0.41 0.73 -0.08 0.00 -1.09 0.00 0.00 42.92 42.07 2dar s ASP 10 CO 0.32 -0.17 1.32 -0.89 0.70 0.00 0.00 175.17 176.45 2dar s THR 11 N 1.01 2.48 0.46 2.11 2.01 -1.26 -4.86 115.64 117.60 2dar s THR 11 Ca -0.07 0.41 0.33 0.00 0.31 0.00 0.00 61.69 62.67 2dar s THR 11 Cb -0.07 -3.23 0.52 0.00 0.01 0.00 0.00 72.50 69.73 2dar s THR 11 CO -0.08 0.04 1.64 -0.07 -0.69 0.00 0.00 174.62 175.46 2dar h LEU 12 N 2.32 0.20 -6.57 4.42 4.07 -2.01 -3.41 115.31 114.32 2dar h LEU 12 Ca -0.50 0.10 -0.64 0.00 0.08 0.00 0.00 57.88 56.92 2dar h LEU 12 Cb 1.26 0.09 0.00 0.00 1.08 0.00 0.00 40.66 43.09 2dar h LEU 12 CO 0.61 -0.12 0.54 0.52 -1.08 0.00 0.00 178.44 178.92 2dar n VAL 13 N -4.53 0.00 -4.24 1.22 0.31 -1.26 -4.79 118.33 105.04 2dar n VAL 13 Ca 0.36 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.40 2dar n VAL 13 Cb 1.46 -0.37 -0.04 0.00 -0.91 0.00 0.00 33.84 33.98 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 2.38 2.23 -0.05 5.55 -0.21 0.92 -4.82 119.66 125.65 2dar s GLN 14 Ca 0.78 -2.17 -0.01 0.00 0.02 0.00 0.00 55.36 53.98 2dar s GLN 14 Cb -1.11 -1.87 0.03 0.00 1.00 0.00 0.00 33.01 31.07 2dar s GLN 14 CO 0.60 -0.50 0.03 1.03 -2.12 0.00 0.00 175.29 174.32 2dar s ARG 15 N -4.11 0.28 0.17 2.91 0.52 -1.26 -2.36 118.95 115.10 2dar s ARG 15 Ca 0.23 0.22 -0.30 0.00 -0.52 0.00 0.00 55.73 55.35 2dar s ARG 15 Cb -0.01 -0.72 -0.07 0.00 0.52 0.00 0.00 34.95 34.67 2dar s ARG 15 CO 0.14 -0.29 1.12 0.00 0.02 0.00 0.00 175.30 176.28 2dar s ALA 16 N 1.93 3.38 -0.12 2.13 0.00 -1.26 -4.93 121.76 122.89 2dar s ALA 16 Ca 0.03 0.83 -0.30 0.00 0.00 0.00 0.00 51.96 52.53 2dar s ALA 16 Cb -0.12 -3.37 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 2dar s ALA 16 CO -0.04 -0.25 1.18 -2.00 0.00 0.00 0.00 175.76 174.66 2dar s GLU 17 N -0.26 4.31 -0.43 0.00 2.12 -0.68 -4.85 118.70 118.91 2dar s GLU 17 Ca 0.50 1.60 -0.29 0.00 0.36 0.00 0.00 54.97 57.15 2dar s GLU 17 Cb -0.30 -3.64 0.02 0.00 0.26 0.00 0.00 34.13 30.48 2dar s GLU 17 CO 0.35 -0.54 1.17 -1.01 -0.54 0.00 0.00 175.26 174.69 2dar s HIS 18 N 2.74 2.81 -0.25 5.30 3.76 -1.26 -2.48 115.29 125.90 2dar s HIS 18 Ca 0.53 0.80 -0.14 0.00 -0.15 0.00 0.00 55.06 56.10 2dar s HIS 18 Cb -0.22 -4.27 -0.04 0.00 1.11 0.00 0.00 32.58 29.16 2dar s HIS 18 CO 0.17 -1.31 0.32 0.42 -0.85 0.00 0.00 174.74 173.50 2dar s ILE 19 N 4.45 5.23 1.02 0.60 -1.09 -0.44 -5.03 121.20 125.93 2dar s ILE 19 Ca 0.50 0.50 -0.13 0.00 -2.23 0.00 0.00 60.65 59.29 2dar s ILE 19 Cb -0.09 -3.66 0.20 0.00 -1.58 0.00 0.00 42.46 37.33 2dar s ILE 19 CO 0.29 0.22 1.09 -2.16 -1.23 0.00 0.00 174.94 173.15 2dar s PRO 20 N 1.67 0.23 0.55 2.79 0.04 -1.26 -2.01 135.00 137.02 2dar s PRO 20 Ca 0.14 0.45 -0.17 0.00 0.04 0.00 0.00 61.00 61.46 2dar s PRO 20 Cb -0.15 -1.72 -0.06 0.00 0.04 0.00 0.00 34.50 32.61 2dar s PRO 20 CO 0.09 -2.85 1.03 0.00 0.04 0.00 0.00 177.00 175.31 2dar s ALA 21 N -2.97 2.85 -0.45 8.56 0.00 -1.26 -4.08 121.76 124.40 2dar s ALA 21 Ca 0.66 0.39 -0.02 0.00 0.00 0.00 0.00 51.96 52.98 2dar s ALA 21 Cb -0.18 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.73 2dar s ALA 21 CO 0.58 -0.56 0.39 0.41 0.00 0.00 0.00 175.76 176.57 2dar n GLY 22 N -0.97 0.38 1.55 0.00 0.00 -1.26 -4.95 105.19 99.94 2dar n GLY 22 Ca 0.08 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.04 0.00 -3.67 1.61 4.76 -1.26 -5.13 118.16 112.43 2dar n LYS 23 Ca -0.02 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.27 2dar n LYS 23 Cb 0.53 -0.23 -0.08 0.00 -1.84 0.00 0.00 35.03 33.40 2dar n LYS 23 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2dar s ARG 24 N -2.00 0.76 -0.81 1.97 3.52 -1.26 -5.09 118.95 116.04 2dar s ARG 24 Ca 0.00 0.24 0.02 0.00 -0.13 0.00 0.00 55.73 55.86 2dar s ARG 24 Cb 0.00 0.35 0.30 0.00 -1.56 0.00 0.00 34.95 34.04 2dar s ARG 24 CO 0.00 -0.19 1.19 0.25 -0.81 0.00 0.00 175.30 175.74 2dar n THR 25 N 1.68 4.00 -1.23 4.11 -2.24 -1.26 -4.86 114.28 114.49 2dar n THR 25 Ca -0.18 -5.64 -0.30 0.00 -2.27 0.00 0.00 64.05 55.66 2dar n THR 25 Cb 0.56 -1.83 0.12 0.00 -2.10 0.00 0.00 70.33 67.09 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 -3.15 1.70 -0.25 -0.78 0.04 -1.26 -4.42 135.00 126.89 2dar s PRO 26 Ca 0.40 0.98 -0.18 0.00 0.04 0.00 0.00 61.00 62.24 2dar s PRO 26 Cb 0.16 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.83 2dar s PRO 26 CO -0.03 -1.98 0.51 -1.64 0.04 0.00 0.00 177.00 173.91 2dar s MET 27 N -4.92 4.10 0.19 4.56 -1.94 -1.26 -1.74 119.30 118.28 2dar s MET 27 Ca 0.62 0.34 -0.33 0.00 -1.71 0.00 0.00 55.69 54.61 2dar s MET 27 Cb -0.18 -3.63 -0.14 0.00 2.01 0.00 0.00 34.83 32.89 2dar s MET 27 CO 0.57 -0.31 1.46 0.00 -0.01 0.00 0.00 175.02 176.73 2dar n ALA 29 N 2.60 2.66 0.00 0.00 0.00 0.01 -0.60 120.51 125.18 2dar n ALA 29 Ca 0.15 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2dar n ALA 29 Cb 0.29 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.72 2dar n ALA 29 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2dar n HIS 30 N 0.03 0.00 0.31 0.00 -0.00 -1.26 -4.84 115.22 109.46 2dar n HIS 30 Ca 0.05 0.00 0.07 0.00 -0.00 0.00 0.00 57.72 57.83 2dar n HIS 30 Cb 0.32 0.07 -0.10 0.00 -0.00 0.00 0.00 29.99 30.28 2dar n HIS 30 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2dar n ASN 32 N -1.68 -5.49 -4.27 0.00 3.02 0.24 -4.98 115.26 102.10 2dar n ASN 32 Ca -0.00 -0.40 -0.31 0.00 -0.03 0.00 0.00 54.58 53.84 2dar n ASN 32 Cb 0.30 -4.13 -0.16 0.00 -0.61 0.00 0.00 39.78 35.18 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 -5.98 2.32 0.08 3.52 -1.52 -1.26 -4.77 119.66 112.05 2dar s GLN 33 Ca 0.44 -0.88 -0.35 0.00 -1.95 0.00 0.00 55.36 52.62 2dar s GLN 33 Cb -0.19 -2.05 -0.14 0.00 -0.22 0.00 0.00 33.01 30.40 2dar s GLN 33 CO 0.55 0.42 1.57 1.55 -0.25 0.00 0.00 175.29 179.12 2dar n VAL 34 N 2.81 0.10 -3.37 1.09 3.14 -1.26 -2.65 118.33 118.20 2dar n VAL 34 Ca -0.17 -0.02 -0.39 0.00 -2.96 0.00 0.00 64.34 60.80 2dar n VAL 34 Cb 0.52 -1.36 -0.08 0.00 -1.06 0.00 0.00 33.84 31.85 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 1.41 5.17 -0.18 1.55 1.01 -0.71 -4.95 121.20 124.49 2dar s ILE 35 Ca 0.84 0.66 -0.17 0.00 0.00 0.00 0.00 60.65 61.97 2dar s ILE 35 Cb -0.78 -3.73 -0.14 0.00 0.01 0.00 0.00 42.46 37.82 2dar s ILE 35 CO 0.44 0.18 0.11 0.03 0.00 0.00 0.00 174.94 175.69 2dar h ARG 36 N 7.88 0.00 0.00 2.79 3.08 -1.90 -3.38 114.38 122.85 2dar h ARG 36 Ca -0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.72 2dar h ARG 36 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.21 2dar h ARG 36 CO 0.68 0.66 0.00 0.41 -1.07 0.00 0.00 179.97 180.65 2dar n GLY 37 N 1.51 -1.63 3.73 0.04 0.00 -1.26 -4.28 105.19 103.29 2dar n GLY 37 Ca -0.22 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 43.91 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 4.38 0.39 1.61 0.04 -1.26 -4.63 135.00 135.53 2dar s PRO 38 Ca 0.00 2.04 0.05 0.00 0.04 0.00 0.00 61.00 63.13 2dar s PRO 38 Cb 0.00 -3.21 -0.06 0.00 0.04 0.00 0.00 34.50 31.27 2dar s PRO 38 CO 0.00 -0.28 0.04 -0.59 0.04 0.00 0.00 177.00 176.21 2dar s PHE 39 N 0.35 2.13 0.04 0.56 -0.12 -0.85 -4.44 117.98 115.65 2dar s PHE 39 Ca 0.58 -0.89 0.06 0.00 -0.05 0.00 0.00 56.93 56.64 2dar s PHE 39 Cb -0.36 -1.50 -0.03 0.00 -0.63 0.00 0.00 43.02 40.49 2dar s PHE 39 CO 0.36 0.17 -0.15 -0.51 -0.05 0.00 0.00 175.22 175.04 2dar s LEU 40 N -3.64 2.74 -0.14 -1.99 1.43 0.25 -1.33 118.68 116.00 2dar s LEU 40 Ca 0.30 -0.37 -0.02 0.00 -1.03 0.00 0.00 54.13 53.01 2dar s LEU 40 Cb 0.07 -1.60 0.04 0.00 0.03 0.00 0.00 46.19 44.74 2dar s LEU 40 CO 0.14 0.25 0.00 0.54 0.23 0.00 0.00 176.35 177.52 2dar s VAL 41 N -0.96 0.59 0.07 -1.59 0.11 -1.04 0.12 120.40 117.71 2dar s VAL 41 Ca 0.16 -0.32 0.00 0.00 -2.93 0.00 0.00 61.98 58.88 2dar s VAL 41 Cb -0.11 -0.90 0.00 0.00 -1.53 0.00 0.00 36.38 33.84 2dar s VAL 41 CO 0.06 0.03 0.00 0.00 -3.33 0.00 0.00 175.10 171.87 2dar n ALA 42 N 5.05 3.00 -0.53 1.54 0.00 -1.23 -1.68 120.51 126.66 2dar n ALA 42 Ca -0.09 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.34 2dar n ALA 42 Cb 0.48 0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.98 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 -2.86 5.43 0.00 0.00 7.99 -1.26 -4.75 117.00 121.55 2dar n LEU 43 Ca 0.00 -2.48 0.00 0.00 -0.01 0.00 0.00 56.01 53.52 2dar n LEU 43 Cb 0.00 -1.13 0.00 0.00 -0.11 0.00 0.00 43.42 42.18 2dar n LEU 43 CO 0.00 1.03 0.00 0.61 -1.51 0.00 0.00 177.39 177.52 2dar n GLY 44 N 1.42 1.28 3.95 -0.72 0.00 -1.26 -4.94 105.19 104.93 2dar n GLY 44 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 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 0.00 2.06 -0.03 1.61 1.02 -1.26 -5.03 119.74 118.11 2dar s LYS 45 Ca 0.00 -0.58 -0.02 0.00 0.02 0.00 0.00 55.97 55.39 2dar s LYS 45 Cb 0.00 -2.26 -0.04 0.00 -0.52 0.00 0.00 37.83 35.01 2dar s LYS 45 CO 0.00 -1.24 0.12 -1.54 -0.92 0.00 0.00 175.35 171.78 2dar s SER 46 N -4.57 6.01 0.01 2.83 1.04 -1.26 -3.51 113.70 114.26 2dar s SER 46 Ca 0.62 0.27 0.01 0.00 0.48 0.00 0.00 55.95 57.32 2dar s SER 46 Cb -0.09 -1.82 -0.01 0.00 0.10 0.00 0.00 66.02 64.20 2dar s SER 46 CO 0.44 0.30 -0.03 0.26 0.98 0.00 0.00 173.24 175.18 2dar s TRP 47 N -1.20 0.29 0.31 5.02 0.52 0.12 -0.81 118.94 123.19 2dar s TRP 47 Ca 0.23 -0.19 -0.29 0.00 0.02 0.00 0.00 56.10 55.87 2dar s TRP 47 Cb -0.12 -0.19 -0.11 0.00 -1.15 0.00 0.00 33.47 31.91 2dar s TRP 47 CO 0.13 -0.05 1.46 -1.01 0.02 0.00 0.00 176.95 177.50 2dar s HIS 48 N -0.47 2.86 -1.08 -1.98 3.76 -1.26 -0.58 115.29 116.53 2dar s HIS 48 Ca -0.03 1.09 0.14 0.00 -0.15 0.00 0.00 55.06 56.11 2dar s HIS 48 Cb -0.04 -3.89 0.63 0.00 1.11 0.00 0.00 32.58 30.39 2dar s HIS 48 CO -0.00 -2.77 1.44 -0.35 -0.85 0.00 0.00 174.74 172.21 2dar n PRO 49 N 1.51 0.04 -0.12 8.40 -0.04 -1.26 -0.64 135.00 142.89 2dar n PRO 49 Ca 0.04 0.23 -0.16 0.00 -0.04 0.00 0.00 63.50 63.58 2dar n PRO 49 Cb 0.40 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.25 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 -1.46 0.59 0.00 0.54 1.02 -1.26 -4.64 120.64 115.44 2dar n GLU 50 Ca 0.04 0.13 -0.18 0.00 -0.02 0.00 0.00 57.16 57.14 2dar n GLU 50 Cb 0.16 -1.46 -0.14 0.00 -0.02 0.00 0.00 31.44 29.98 2dar n GLU 50 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2dar h GLU 51 N 0.00 0.19 -5.07 3.49 5.08 -1.93 -3.44 114.58 112.91 2dar h GLU 51 Ca -0.52 -0.31 -0.43 0.00 -1.00 0.00 0.00 59.36 57.10 2dar h GLU 51 Cb 1.81 0.12 -0.09 0.00 0.50 0.00 0.00 28.75 31.09 2dar h GLU 51 CO -0.08 1.14 1.76 0.34 -1.00 0.00 0.00 179.01 181.17 2dar n PHE 52 N -4.32 0.50 -4.41 4.33 7.35 0.19 -4.84 117.46 116.26 2dar n PHE 52 Ca -0.12 0.23 -0.22 0.00 -0.76 0.00 0.00 57.45 56.58 2dar n PHE 52 Cb 0.68 -1.86 -0.09 0.00 0.35 0.00 0.00 39.48 38.56 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 6.72 2.13 1.13 -2.13 0.01 -1.26 -2.38 114.94 119.15 2dar s ASN 53 Ca 1.30 -1.60 -0.17 0.00 -0.71 0.00 0.00 52.86 51.68 2dar s ASN 53 Cb -1.00 0.40 0.24 0.00 0.41 0.00 0.00 41.25 41.30 2dar s ASN 53 CO 0.48 -0.89 1.04 0.00 -1.51 0.00 0.00 177.10 176.22 2dar n ALA 55 N -4.27 1.57 -0.07 0.00 0.00 -1.23 -3.91 120.51 112.60 2dar n ALA 55 Ca -0.18 -1.13 -0.07 0.00 0.00 0.00 0.00 53.44 52.05 2dar n ALA 55 Cb 0.51 -0.11 -0.02 0.00 0.00 0.00 0.00 19.45 19.82 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 -2.68 0.00 0.66 0.00 -0.00 -1.26 -4.57 115.22 107.37 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 1.06 -0.41 0.46 0.00 -0.00 0.00 0.00 29.99 31.10 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 -2.04 -2.03 -4.25 0.00 4.76 -1.25 -4.88 118.16 108.47 2dar n LYS 58 Ca 0.05 0.24 -0.26 0.00 -2.87 0.00 0.00 58.31 55.47 2dar n LYS 58 Cb 0.36 -4.01 -0.08 0.00 -1.84 0.00 0.00 35.03 29.46 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 -4.35 4.52 -0.18 4.39 0.01 -1.26 -4.57 114.94 113.49 2dar s ASN 59 Ca 0.02 -0.49 -0.37 0.00 -0.71 0.00 0.00 52.86 51.30 2dar s ASN 59 Cb -0.01 -0.87 -0.14 0.00 0.41 0.00 0.00 41.25 40.64 2dar s ASN 59 CO 0.95 0.09 1.80 1.07 -1.51 0.00 0.00 177.10 179.50 2dar n THR 60 N -0.07 0.42 -1.73 1.60 5.66 -1.26 -1.57 114.28 117.33 2dar n THR 60 Ca -0.10 -0.08 -0.33 0.00 -3.05 0.00 0.00 64.05 60.50 2dar n THR 60 Cb 0.55 -1.52 0.05 0.00 -1.55 0.00 0.00 70.33 67.86 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 5.88 3.00 -0.07 1.09 2.81 -1.00 -4.66 117.12 124.17 2dar n MET 61 Ca 0.24 -3.67 -0.05 0.00 -1.81 0.00 0.00 57.70 52.41 2dar n MET 61 Cb 0.21 -2.28 -0.02 0.00 -0.71 0.00 0.00 33.22 30.41 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 2.30 0.02 0.00 3.04 0.00 -1.89 -3.43 119.26 119.29 2dar h ALA 62 Ca 0.51 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2dar h ALA 62 Cb 0.84 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2dar h ALA 62 CO 1.29 0.34 -0.03 1.88 0.00 0.00 0.00 179.25 182.73 2dar h TYR 63 N -1.00 0.00 -2.14 0.00 0.05 -1.94 -3.42 116.97 108.52 2dar h TYR 63 Ca -0.03 0.00 -0.43 0.00 0.05 0.00 0.00 58.73 58.32 2dar h TYR 63 Cb 0.44 0.00 0.23 0.00 1.01 0.00 0.00 36.73 38.41 2dar h TYR 63 CO -0.10 0.00 -1.16 0.44 -1.05 0.00 0.00 178.16 176.29 2dar n ILE 64 N -4.76 0.00 -1.08 -2.88 -5.35 -1.26 -4.90 119.36 99.13 2dar n ILE 64 Ca -0.00 -0.25 0.00 0.00 -0.27 0.00 0.00 62.75 62.23 2dar n ILE 64 Cb 0.02 -0.54 0.00 0.00 -1.74 0.00 0.00 39.64 37.37 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 2.21 -0.34 3.55 3.28 0.00 -1.26 -4.77 105.19 107.86 2dar n GLY 65 Ca 0.01 -1.75 -0.07 0.00 0.00 0.00 0.00 46.02 44.20 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 -0.26 -0.03 1.61 -0.71 -1.00 -3.95 117.98 113.46 2dar s PHE 66 Ca 0.00 0.20 -0.01 0.00 -1.04 0.00 0.00 56.93 56.08 2dar s PHE 66 Cb 0.00 0.52 0.03 0.00 -1.21 0.00 0.00 43.02 42.36 2dar s PHE 66 CO 0.00 -0.38 0.04 0.08 -1.34 0.00 0.00 175.22 173.62 2dar s VAL 67 N -2.57 -0.03 -0.22 -2.49 1.01 0.47 -0.06 120.40 116.51 2dar s VAL 67 Ca 0.06 0.30 -0.23 0.00 0.00 0.00 0.00 61.98 62.11 2dar s VAL 67 Cb -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 36.38 36.19 2dar s VAL 67 CO -0.06 0.15 0.77 -0.70 0.00 0.00 0.00 175.10 175.26 2dar s GLU 68 N 1.68 4.21 -0.08 2.72 2.12 -1.26 -0.87 118.70 127.23 2dar s GLU 68 Ca -0.01 0.85 -0.07 0.00 0.36 0.00 0.00 54.97 56.10 2dar s GLU 68 Cb -0.13 -3.62 0.02 0.00 0.26 0.00 0.00 34.13 30.67 2dar s GLU 68 CO -0.03 -0.41 0.21 -2.00 -0.54 0.00 0.00 175.26 172.50 2dar s GLU 69 N 2.46 0.25 -1.32 4.30 2.56 0.11 -4.89 118.70 122.17 2dar s GLU 69 Ca 0.33 0.31 -0.13 0.00 0.00 0.00 0.00 54.97 55.48 2dar s GLU 69 Cb -0.16 0.11 0.13 0.00 2.00 0.00 0.00 34.13 36.22 2dar s GLU 69 CO 0.09 -0.04 0.34 1.63 -0.56 0.00 0.00 175.26 176.72 2dar n LYS 70 N 3.03 -0.83 -2.79 4.30 4.01 -1.26 0.88 118.16 125.50 2dar n LYS 70 Ca -0.13 0.09 -0.10 0.00 -0.51 0.00 0.00 58.31 57.66 2dar n LYS 70 Cb 0.58 -3.24 0.05 0.00 -0.51 0.00 0.00 35.03 31.92 2dar n LYS 70 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2dar n GLY 71 N -1.19 -0.11 3.64 0.72 0.00 -1.26 -5.05 105.19 101.94 2dar n GLY 71 Ca 0.01 -0.04 -0.08 0.00 0.00 0.00 0.00 46.02 45.91 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 -3.22 -1.93 -0.32 4.61 0.00 0.25 -5.14 121.76 116.01 2dar s ALA 72 Ca 0.06 2.22 -0.12 0.00 0.00 0.00 0.00 51.96 54.13 2dar s ALA 72 Cb -0.01 -1.41 -0.02 0.00 0.00 0.00 0.00 23.12 21.68 2dar s ALA 72 CO 0.44 -0.35 0.21 -0.51 0.00 0.00 0.00 175.76 175.55 2dar s LEU 73 N 1.08 4.31 -0.16 0.00 1.43 -1.25 0.06 118.68 124.15 2dar s LEU 73 Ca -0.06 -0.35 -0.00 0.00 -1.03 0.00 0.00 54.13 52.69 2dar s LEU 73 Cb -0.05 -2.10 -0.00 0.00 0.03 0.00 0.00 46.19 44.07 2dar s LEU 73 CO -0.12 -0.18 -0.13 -0.31 0.23 0.00 0.00 176.35 175.83 2dar s TYR 74 N 1.70 2.82 0.70 0.29 2.02 -0.05 -3.54 117.35 121.30 2dar s TYR 74 Ca 0.06 -0.97 -0.16 0.00 -0.37 0.00 0.00 57.07 55.63 2dar s TYR 74 Cb -0.17 -1.91 0.02 0.00 -0.40 0.00 0.00 41.96 39.49 2dar s TYR 74 CO 0.10 -0.44 1.26 0.00 -1.57 0.00 0.00 175.55 174.89 2dar h GLU 76 N 0.07 0.09 0.51 0.00 4.11 -1.89 -0.09 114.58 117.38 2dar h GLU 76 Ca -0.49 -0.01 -0.02 0.00 0.07 0.00 0.00 59.36 58.91 2dar h GLU 76 Cb 1.32 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.55 2dar h GLU 76 CO 0.51 0.06 -0.28 -0.07 0.07 0.00 0.00 179.01 179.30 2dar h LEU 77 N 0.09 -0.67 -0.29 3.06 3.38 -1.93 0.27 115.31 119.23 2dar h LEU 77 Ca 0.82 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.89 2dar h LEU 77 Cb 2.24 0.18 -0.08 0.00 0.09 0.00 0.00 40.66 43.10 2dar h LEU 77 CO -0.63 -0.45 -0.25 0.00 0.09 0.00 0.00 178.44 177.20 2dar h TYR 79 N -0.24 -1.36 -0.83 0.00 5.03 -1.20 0.50 116.97 118.87 2dar h TYR 79 Ca 0.15 0.01 0.24 0.00 2.58 0.00 0.00 58.73 61.71 2dar h TYR 79 Cb 0.48 0.53 -0.03 0.00 1.55 0.00 0.00 36.73 39.25 2dar h TYR 79 CO -0.43 -0.64 0.76 1.49 -1.32 0.00 0.00 178.16 178.02 2dar h GLU 80 N -0.96 0.00 0.07 1.82 4.81 -0.14 0.78 114.58 120.96 2dar h GLU 80 Ca -0.06 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2dar h GLU 80 Cb 0.84 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.22 2dar h GLU 80 CO -0.07 0.00 -0.04 0.87 -0.73 0.00 0.00 179.01 179.04 2dar h LYS 81 N 0.00 -0.10 0.41 1.92 1.57 0.21 -3.04 116.57 117.55 2dar h LYS 81 Ca 0.40 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 59.16 2dar h LYS 81 Cb 1.92 0.02 0.00 0.00 0.08 0.00 0.00 32.23 34.25 2dar h LYS 81 CO -0.00 -0.06 -0.20 0.74 -0.57 0.00 0.00 179.45 179.35 2dar h PHE 82 N -0.85 -0.51 0.04 -1.35 0.04 -0.07 -3.30 116.94 110.94 2dar h PHE 82 Ca -0.01 -0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.75 2dar h PHE 82 Cb 0.08 0.17 -0.00 0.00 2.20 0.00 0.00 35.95 38.39 2dar h PHE 82 CO 0.00 -0.32 -0.04 0.74 -0.60 0.00 0.00 178.31 178.09 2dar h PHE 83 N -0.92 -0.12 -0.80 -0.55 -1.00 0.33 -3.27 116.94 110.61 2dar h PHE 83 Ca -0.06 0.00 -0.69 0.00 2.81 0.00 0.00 57.97 60.03 2dar h PHE 83 Cb 0.42 0.05 -0.08 0.00 3.61 0.00 0.00 35.95 39.95 2dar h PHE 83 CO 0.03 -0.06 2.32 0.00 -1.61 0.00 0.00 178.31 179.00 2dar n ALA 84 N -2.33 3.98 -2.71 2.45 0.00 -1.09 -4.96 120.51 115.84 2dar n ALA 84 Ca -0.01 -3.89 -0.40 0.00 0.00 0.00 0.00 53.44 49.14 2dar n ALA 84 Cb 0.04 -3.55 -0.04 0.00 0.00 0.00 0.00 19.45 15.90 2dar n ALA 84 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2dar s SER 85 N 3.88 7.02 0.00 0.00 1.04 -1.24 -4.32 113.70 120.08 2dar s SER 85 Ca 0.52 1.23 0.00 0.00 0.48 0.00 0.00 55.95 58.17 2dar s SER 85 Cb 0.06 -2.43 0.00 0.00 0.10 0.00 0.00 66.02 63.75 2dar s SER 85 CO 0.04 -0.16 0.00 0.61 0.98 0.00 0.00 173.24 174.71 2dar n GLY 86 N 3.13 0.73 0.21 7.32 0.00 -1.26 -4.94 105.19 110.38 2dar n GLY 86 Ca -0.00 0.04 0.07 0.00 0.00 0.00 0.00 46.02 46.13 2dar n GLY 86 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dar h PRO 87 N 0.00 0.00 -7.38 1.61 0.13 -1.93 -3.45 132.00 120.99 2dar h PRO 87 Ca 0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.63 2dar h PRO 87 Cb 0.00 0.00 0.07 0.00 0.13 0.00 0.00 31.00 31.20 2dar h PRO 87 CO 0.00 0.30 0.40 -1.12 -0.23 0.00 0.00 178.00 177.34 2dar s SER 88 N -6.42 5.92 0.15 1.44 0.01 -1.26 -5.01 113.70 108.53 2dar s SER 88 Ca -0.01 1.27 -0.30 0.00 1.31 0.00 0.00 55.95 58.22 2dar s SER 88 Cb 0.12 -2.24 -0.08 0.00 0.21 0.00 0.00 66.02 64.04 2dar s SER 88 CO 0.66 -1.04 1.26 -0.55 0.41 0.00 0.00 173.24 173.99 2dar s SER 89 N -4.25 6.98 0.00 2.44 0.15 -1.26 -5.10 113.70 112.67 2dar s SER 89 Ca 0.56 2.25 0.00 0.00 0.70 0.00 0.00 55.95 59.46 2dar s SER 89 Cb -0.11 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.60 2dar s SER 89 CO 0.52 -0.49 0.00 0.61 1.20 0.00 0.00 173.24 175.09